#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 0.00 0.00 2.46 0.31 -1.18 -2.67 118.33 117.25 2w3s n VAL 3 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2w3s n VAL 3 Cb 0.00 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 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 1.49 0.90 3.79 2.92 0.00 0.17 -4.98 105.19 109.49 2w3s n GLY 4 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.75 3.77 -1.52 1.61 1.02 -1.09 -4.48 119.74 118.29 2w3s s LYS 5 Ca 0.00 1.42 -0.09 0.00 0.02 0.00 0.00 55.97 57.32 2w3s s LYS 5 Cb 0.00 -2.13 -0.01 0.00 -0.52 0.00 0.00 37.83 35.17 2w3s s LYS 5 CO 0.00 -0.47 2.70 -0.35 -0.92 0.00 0.00 175.35 176.31 2w3s n PRO 6 N -0.92 3.84 -2.78 -1.68 -0.04 -1.26 -4.26 135.00 127.91 2w3s n PRO 6 Ca 0.09 -2.61 -0.37 0.00 -0.04 0.00 0.00 63.50 60.57 2w3s n PRO 6 Cb 0.52 -2.81 -0.06 0.00 -0.04 0.00 0.00 33.50 31.10 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 -0.21 4.30 0.80 1.53 1.43 -1.26 -4.76 118.68 120.51 2w3s s LEU 7 Ca 0.62 1.83 -0.12 0.00 -1.03 0.00 0.00 54.13 55.43 2w3s s LEU 7 Cb 0.17 -4.07 0.08 0.00 0.03 0.00 0.00 46.19 42.40 2w3s s LEU 7 CO -0.07 -0.11 1.15 -2.16 0.23 0.00 0.00 176.35 175.39 2w3s s PRO 8 N -2.18 1.80 0.25 1.29 0.04 -1.26 -4.71 135.00 130.24 2w3s s PRO 8 Ca 0.52 1.49 -0.29 0.00 0.04 0.00 0.00 61.00 62.76 2w3s s PRO 8 Cb -0.18 -1.82 -0.15 0.00 0.04 0.00 0.00 34.50 32.39 2w3s s PRO 8 CO 0.23 -2.04 0.89 1.58 0.04 0.00 0.00 177.00 177.70 2w3s n HIS 9 N -3.47 0.77 0.32 0.56 -0.00 -1.26 -4.81 115.22 107.34 2w3s n HIS 9 Ca 0.11 0.78 0.15 0.00 -0.00 0.00 0.00 57.72 58.77 2w3s n HIS 9 Cb 0.52 -2.17 0.83 0.00 -0.00 0.00 0.00 29.99 29.16 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 1.86 0.00 0.00 0.26 2.03 -1.92 -2.02 116.42 116.62 2w3s h ASP 10 Ca -0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 2w3s h ASP 10 Cb 1.37 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.87 2w3s h ASP 10 CO 0.61 0.00 -0.04 -1.20 -1.03 0.00 0.00 179.24 177.58 2w3s n SER 11 N -2.84 1.43 -0.22 4.15 7.64 -1.26 -4.82 113.62 117.69 2w3s n SER 11 Ca -0.02 -1.95 0.00 0.00 1.01 0.00 0.00 58.87 57.92 2w3s n SER 11 Cb 0.34 -0.09 0.08 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 0.00 0.47 -0.27 -0.43 0.00 -1.72 0.24 119.26 117.55 2w3s h ALA 12 Ca 0.00 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2w3s h ALA 12 Cb 0.77 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2w3s h ALA 12 CO 0.00 -0.42 0.15 -0.09 0.00 0.00 0.00 179.25 178.89 2w3s h ARG 13 N 0.02 0.37 0.00 0.00 2.43 -1.88 -0.50 114.38 114.81 2w3s h ARG 13 Ca 0.32 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.38 2w3s h ARG 13 Cb 0.50 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 2w3s h ARG 13 CO -0.66 0.31 -0.33 0.00 -1.51 0.00 0.00 179.97 177.78 2w3s h ALA 14 N 1.04 1.33 -0.39 2.80 0.00 -1.57 -1.95 119.26 120.51 2w3s h ALA 14 Ca 0.09 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2w3s h ALA 14 Cb 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2w3s h ALA 14 CO -0.02 0.42 0.01 0.45 0.00 0.00 0.00 179.25 180.11 2w3s h HIS 15 N 0.00 0.74 0.00 0.00 3.86 -0.20 0.22 115.15 119.77 2w3s h HIS 15 Ca -0.00 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.08 2w3s h HIS 15 Cb 0.64 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2w3s h HIS 15 CO 0.00 0.76 -0.07 1.55 0.86 0.00 0.00 177.93 181.03 2w3s n VAL 16 N -4.47 0.46 -0.05 2.45 3.14 -0.23 -2.90 118.33 116.73 2w3s n VAL 16 Ca -0.01 -0.23 0.03 0.00 -2.96 0.00 0.00 64.34 61.17 2w3s n VAL 16 Cb 0.28 -0.51 0.07 0.00 -1.06 0.00 0.00 33.84 32.61 2w3s n VAL 16 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2w3s n THR 17 N -2.11 0.88 -2.52 1.55 -2.24 -0.99 -5.00 114.28 103.85 2w3s n THR 17 Ca 0.06 -0.94 -0.14 0.00 -2.27 0.00 0.00 64.05 60.76 2w3s n THR 17 Cb 0.41 0.58 0.01 0.00 -2.10 0.00 0.00 70.33 69.23 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 0.04 -0.15 0.02 3.38 0.00 -1.11 -4.92 105.19 102.46 2w3s n GLY 18 Ca 0.05 -0.24 0.09 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.62 0.65 -1.79 1.61 6.02 0.65 -4.91 117.38 116.99 2w3s n GLN 19 Ca -0.12 -0.18 -0.42 0.00 -0.01 0.00 0.00 57.00 56.28 2w3s n GLN 19 Cb 0.60 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.33 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 -3.37 3.85 -0.12 -1.58 0.00 -0.40 -4.97 121.76 115.17 2w3s s ALA 20 Ca -0.08 1.49 -0.11 0.00 0.00 0.00 0.00 51.96 53.26 2w3s s ALA 20 Cb 0.13 -3.69 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 2w3s s ALA 20 CO 0.87 -0.96 0.24 1.03 0.00 0.00 0.00 175.76 176.94 2w3s s ARG 21 N 1.56 3.94 0.36 0.00 0.52 -1.26 -4.97 118.95 119.09 2w3s s ARG 21 Ca 0.75 0.04 0.08 0.00 -0.52 0.00 0.00 55.73 56.07 2w3s s ARG 21 Cb -0.47 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 31.65 2w3s s ARG 21 CO 0.33 0.49 0.25 0.71 0.02 0.00 0.00 175.30 177.10 2w3s s TYR 22 N -0.28 2.78 0.19 -0.53 1.51 -1.26 -4.80 117.35 114.96 2w3s s TYR 22 Ca 0.16 -0.38 -0.24 0.00 -1.01 0.00 0.00 57.07 55.60 2w3s s TYR 22 Cb -0.13 -1.83 0.09 0.00 -0.11 0.00 0.00 41.96 39.98 2w3s s TYR 22 CO 0.05 0.18 1.55 1.25 -1.11 0.00 0.00 175.55 177.47 2w3s h LEU 23 N 1.32 -1.65 -0.05 -1.29 6.46 -1.92 0.94 115.31 119.12 2w3s h LEU 23 Ca -0.44 0.29 0.00 0.00 -0.12 0.00 0.00 57.88 57.62 2w3s h LEU 23 Cb 1.26 0.79 0.00 0.00 -0.73 0.00 0.00 40.66 41.97 2w3s h LEU 23 CO 0.61 -0.29 0.00 -0.67 -0.62 0.00 0.00 178.44 177.47 2w3s n ASP 24 N -5.39 0.03 0.09 1.25 4.64 -1.26 -1.85 116.55 114.05 2w3s n ASP 24 Ca 0.05 0.51 0.12 0.00 -1.38 0.00 0.00 54.79 54.09 2w3s n ASP 24 Cb 0.35 -0.51 0.12 0.00 -1.04 0.00 0.00 41.12 40.03 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 -3.18 1.67 3.32 0.55 -3.47 116.42 115.30 2w3s h ASP 25 Ca 0.00 -0.12 -0.54 0.00 0.02 0.00 0.00 57.03 56.38 2w3s h ASP 25 Cb 0.10 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.73 2w3s h ASP 25 CO 0.00 0.06 0.82 0.18 -1.72 0.00 0.00 179.24 178.58 2w3s n LEU 26 N -2.37 4.12 -4.76 1.55 4.77 -0.77 -4.89 117.00 114.63 2w3s n LEU 26 Ca 0.02 1.15 -0.41 0.00 -0.03 0.00 0.00 56.01 56.75 2w3s n LEU 26 Cb 0.48 -1.56 -0.03 0.00 -2.33 0.00 0.00 43.42 39.98 2w3s n LEU 26 CO 0.37 0.01 0.90 -2.16 -1.33 0.00 0.00 177.39 175.18 2w3s s PRO 27 N -0.57 4.48 0.17 3.23 0.04 -1.26 -5.03 135.00 136.06 2w3s s PRO 27 Ca 0.64 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 63.70 2w3s s PRO 27 Cb -0.53 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 2w3s s PRO 27 CO 0.49 -0.01 0.08 0.00 0.04 0.00 0.00 177.00 177.60 2w3s s PRO 29 N -4.08 2.14 0.41 0.00 0.02 -1.26 -4.88 135.00 127.34 2w3s s PRO 29 Ca 0.31 1.80 0.14 0.00 0.02 0.00 0.00 61.00 63.27 2w3s s PRO 29 Cb 0.07 -1.83 0.87 0.00 0.02 0.00 0.00 34.50 33.63 2w3s s PRO 29 CO 0.06 -1.85 1.90 0.00 -0.33 0.00 0.00 177.00 176.79 2w3s h ALA 30 N -0.25 1.48 0.00 -1.55 0.00 -2.01 -2.43 119.26 114.49 2w3s h ALA 30 Ca -0.48 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2w3s h ALA 30 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2w3s h ALA 30 CO 0.50 0.36 0.00 0.27 0.00 0.00 0.00 179.25 180.38 2w3s n ASN 31 N -4.13 0.11 -4.76 0.00 6.94 -1.26 -4.92 115.26 107.24 2w3s n ASN 31 Ca -0.02 -1.99 -0.41 0.00 -0.02 0.00 0.00 54.58 52.14 2w3s n ASN 31 Cb 0.34 -0.06 -0.01 0.00 -2.36 0.00 0.00 39.78 37.69 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 -1.89 2.23 0.42 5.53 2.01 -0.92 -4.50 115.64 118.52 2w3s s THR 32 Ca 0.00 0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.24 2w3s s THR 32 Cb 0.00 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.38 2w3s s THR 32 CO 0.00 0.04 0.60 -0.76 -0.69 0.00 0.00 174.62 173.80 2w3s s LEU 33 N -0.93 3.72 -0.01 4.42 1.43 0.24 -4.86 118.68 122.68 2w3s s LEU 33 Ca 0.59 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 2w3s s LEU 33 Cb -0.46 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 42.87 2w3s s LEU 33 CO 0.51 -0.67 -0.04 -1.00 0.23 0.00 0.00 176.35 175.37 2w3s s HIS 34 N -2.41 0.47 0.01 0.29 3.76 -0.06 -1.28 115.29 116.08 2w3s s HIS 34 Ca 0.49 -0.09 0.07 0.00 -0.15 0.00 0.00 55.06 55.39 2w3s s HIS 34 Cb -0.10 -0.35 -0.02 0.00 1.11 0.00 0.00 32.58 33.22 2w3s s HIS 34 CO 0.35 -0.04 -0.22 -0.51 -0.85 0.00 0.00 174.74 173.46 2w3s s LEU 35 N 0.12 2.10 0.04 0.89 1.43 0.08 -0.90 118.68 122.44 2w3s s LEU 35 Ca -0.01 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 2w3s s LEU 35 Cb -0.05 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 45.05 2w3s s LEU 35 CO -0.00 0.23 -0.09 0.00 0.23 0.00 0.00 176.35 176.72 2w3s s ALA 36 N -0.66 0.67 0.29 4.21 0.00 -0.90 -4.46 121.76 120.92 2w3s s ALA 36 Ca 0.09 -0.70 -0.16 0.00 0.00 0.00 0.00 51.96 51.19 2w3s s ALA 36 Cb -0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 23.12 22.92 2w3s s ALA 36 CO 0.00 0.05 0.73 -0.06 0.00 0.00 0.00 175.76 176.48 2w3s s PHE 37 N -1.08 3.44 -0.16 0.00 2.99 -1.26 -0.71 117.98 121.19 2w3s s PHE 37 Ca -0.06 1.25 -0.09 0.00 0.00 0.00 0.00 56.93 58.03 2w3s s PHE 37 Cb -0.08 -2.55 -0.05 0.00 0.00 0.00 0.00 43.02 40.34 2w3s s PHE 37 CO 0.01 0.16 0.16 0.20 -0.00 0.00 0.00 175.22 175.74 2w3s s GLY 38 N -2.12 2.12 0.15 4.36 0.00 -0.20 -4.87 107.32 106.75 2w3s s GLY 38 Ca 0.51 -0.63 0.06 0.00 0.00 0.00 0.00 44.72 44.65 2w3s s GLY 38 CO 0.18 -0.04 0.04 1.08 0.00 0.00 0.00 173.10 174.36 2w3s s LEU 39 N -0.23 3.52 0.27 0.66 1.43 -1.26 -1.00 118.68 122.07 2w3s s LEU 39 Ca 0.12 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.67 2w3s s LEU 39 Cb -0.12 -2.18 -0.12 0.00 0.03 0.00 0.00 46.19 43.80 2w3s s LEU 39 CO 0.01 0.11 1.65 -0.55 0.23 0.00 0.00 176.35 177.80 2w3s s SER 40 N -2.80 6.35 0.00 2.29 0.15 0.13 -4.87 113.70 114.95 2w3s s SER 40 Ca 0.28 2.94 0.27 0.00 0.70 0.00 0.00 55.95 60.14 2w3s s SER 40 Cb -0.10 -2.62 0.90 0.00 -1.71 0.00 0.00 66.02 62.48 2w3s s SER 40 CO 0.20 -0.95 1.66 0.35 1.20 0.00 0.00 173.24 175.70 2w3s n THR 41 N 2.75 0.02 -4.54 6.45 -2.24 -1.26 -1.80 114.28 113.67 2w3s n THR 41 Ca 0.11 -0.30 -0.31 0.00 -2.27 0.00 0.00 64.05 61.28 2w3s n THR 41 Cb 0.36 0.65 -0.12 0.00 -2.10 0.00 0.00 70.33 69.13 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 -1.98 2.14 0.18 -0.78 0.41 -1.26 -4.88 118.70 112.53 2w3s s GLU 42 Ca 0.36 -0.96 0.00 0.00 -0.41 0.00 0.00 54.97 53.97 2w3s s GLU 42 Cb 0.21 -2.25 0.07 0.00 -1.78 0.00 0.00 34.13 30.38 2w3s s GLU 42 CO 0.33 0.54 1.44 0.00 -0.49 0.00 0.00 175.26 177.08 2w3s h ALA 43 N 4.35 0.62 -1.00 5.21 0.00 -1.80 -2.93 119.26 123.70 2w3s h ALA 43 Ca -0.48 -0.62 0.13 0.00 0.00 0.00 0.00 54.91 53.94 2w3s h ALA 43 Cb 1.16 -0.07 -0.21 0.00 0.00 0.00 0.00 17.79 18.67 2w3s h ALA 43 CO 0.49 0.79 -0.10 0.45 0.00 0.00 0.00 179.25 180.88 2w3s s SER 44 N -6.95 -1.05 0.15 0.00 0.15 -1.26 -2.41 113.70 102.32 2w3s s SER 44 Ca -0.05 0.84 -0.24 0.00 0.70 0.00 0.00 55.95 57.21 2w3s s SER 44 Cb 0.11 1.96 0.06 0.00 -1.71 0.00 0.00 66.02 66.44 2w3s s SER 44 CO 0.83 -0.20 0.77 0.00 1.20 0.00 0.00 173.24 175.84 2w3s s ALA 45 N 2.84 -1.56 0.05 5.45 0.00 -1.03 0.42 121.76 127.93 2w3s s ALA 45 Ca 0.09 0.32 -0.00 0.00 0.00 0.00 0.00 51.96 52.37 2w3s s ALA 45 Cb -0.13 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 2w3s s ALA 45 CO -0.18 -0.88 0.19 0.00 0.00 0.00 0.00 175.76 174.89 2w3s s ALA 46 N -3.55 3.96 -0.37 0.00 0.00 -0.62 -0.35 121.76 120.82 2w3s s ALA 46 Ca 0.07 -0.85 -0.19 0.00 0.00 0.00 0.00 51.96 50.99 2w3s s ALA 46 Cb -0.02 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.30 2w3s s ALA 46 CO -0.04 0.81 0.56 0.42 0.00 0.00 0.00 175.76 177.52 2w3s s ILE 47 N -1.47 4.95 -0.04 0.00 1.01 0.14 0.12 121.20 125.91 2w3s s ILE 47 Ca 0.33 0.32 0.04 0.00 0.00 0.00 0.00 60.65 61.34 2w3s s ILE 47 Cb -0.13 -4.04 -0.25 0.00 0.01 0.00 0.00 42.46 38.05 2w3s s ILE 47 CO 0.26 -0.32 0.68 0.74 0.00 0.00 0.00 174.94 176.30 2w3s h THR 48 N 5.68 0.92 -2.27 2.92 2.02 -0.55 -3.47 112.91 118.17 2w3s h THR 48 Ca -0.27 -2.68 -0.07 0.00 0.77 0.00 0.00 66.41 64.16 2w3s h THR 48 Cb 1.11 2.55 -0.20 0.00 -1.74 0.00 0.00 68.15 69.88 2w3s h THR 48 CO 0.81 0.70 0.05 -0.83 0.37 0.00 0.00 175.52 176.62 2w3s s GLY 49 N -5.16 -0.46 -0.41 2.16 0.00 -1.01 -4.97 107.32 97.47 2w3s s GLY 49 Ca -0.10 1.28 0.04 0.00 0.00 0.00 0.00 44.72 45.94 2w3s s GLY 49 CO 0.82 0.99 0.41 -2.27 0.00 0.00 0.00 173.10 173.05 2w3s s LEU 50 N -0.71 0.30 -0.59 0.66 2.96 -1.26 -1.54 118.68 118.49 2w3s s LEU 50 Ca -0.08 -2.20 -0.21 0.00 -0.22 0.00 0.00 54.13 51.42 2w3s s LEU 50 Cb -0.02 0.37 0.07 0.00 0.50 0.00 0.00 46.19 47.10 2w3s s LEU 50 CO 0.06 -0.19 0.82 -0.62 -1.32 0.00 0.00 176.35 175.10 2w3s s ASP 51 N 0.80 6.21 -0.31 3.68 2.15 -0.06 -4.88 116.67 124.26 2w3s s ASP 51 Ca 0.25 -0.99 0.09 0.00 0.43 0.00 0.00 52.55 52.33 2w3s s ASP 51 Cb -0.06 -2.36 0.72 0.00 -0.30 0.00 0.00 42.92 40.92 2w3s s ASP 51 CO -0.09 -1.21 1.77 0.18 -0.17 0.00 0.00 175.17 175.66 2w3s n LEU 52 N 6.98 5.99 0.04 -1.34 4.77 -1.26 -1.70 117.00 130.47 2w3s n LEU 52 Ca -0.05 -3.12 -0.11 0.00 -0.03 0.00 0.00 56.01 52.70 2w3s n LEU 52 Cb 0.45 -0.74 -0.08 0.00 -2.33 0.00 0.00 43.42 40.71 2w3s n LEU 52 CO 0.60 0.79 0.45 -0.08 -1.33 0.00 0.00 177.39 177.82 2w3s h GLU 53 N 2.57 -0.16 -0.02 3.23 4.57 -1.90 -2.12 114.58 120.76 2w3s h GLU 53 Ca 0.26 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.46 2w3s h GLU 53 Cb 2.30 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 30.93 2w3s h GLU 53 CO 0.73 0.31 0.06 -1.35 -1.18 0.00 0.00 179.01 177.58 2w3s h PRO 54 N -0.80 0.00 0.01 0.92 0.11 -1.80 -1.55 132.00 128.89 2w3s h PRO 54 Ca -0.02 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 2w3s h PRO 54 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2w3s h PRO 54 CO 0.03 0.00 -0.00 0.28 -0.21 0.00 0.00 178.00 178.10 2w3s h VAL 55 N 0.00 1.49 -0.78 3.15 2.07 -1.69 -2.67 116.25 117.82 2w3s h VAL 55 Ca 0.01 -1.50 0.03 0.00 0.82 0.00 0.00 66.70 66.06 2w3s h VAL 55 Cb 0.14 2.50 -0.04 0.00 -1.52 0.00 0.00 31.29 32.37 2w3s h VAL 55 CO -0.00 0.39 0.52 0.03 0.02 0.00 0.00 177.57 178.52 2w3s h ARG 56 N -0.65 0.94 0.00 1.57 3.08 -0.96 -2.41 114.38 115.94 2w3s h ARG 56 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2w3s h ARG 56 Cb 0.64 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2w3s h ARG 56 CO 0.00 0.62 0.00 0.93 -1.07 0.00 0.00 179.97 180.45 2w3s h GLU 57 N 0.96 0.00 -7.06 0.04 5.08 -1.32 -3.44 114.58 108.84 2w3s h GLU 57 Ca 0.31 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 58.14 2w3s h GLU 57 Cb 0.04 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.41 2w3s h GLU 57 CO -0.09 0.00 0.53 0.45 -1.00 0.00 0.00 179.01 178.90 2w3s s SER 58 N -4.93 5.41 0.34 1.42 0.15 -0.91 -4.93 113.70 110.26 2w3s s SER 58 Ca 0.06 2.53 -0.28 0.00 0.70 0.00 0.00 55.95 58.95 2w3s s SER 58 Cb 0.09 -2.61 -0.12 0.00 -1.71 0.00 0.00 66.02 61.67 2w3s s SER 58 CO 0.52 -1.46 1.29 -2.65 1.20 0.00 0.00 173.24 172.14 2w3s n PRO 59 N -1.14 2.12 0.00 5.44 -0.02 -1.26 -2.93 135.00 137.20 2w3s n PRO 59 Ca 0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2w3s n PRO 59 Cb 0.47 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 0.77 2.86 3.74 -1.23 0.00 -1.26 -4.86 105.19 105.22 2w3s n GLY 60 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.61 3.27 -0.09 1.61 1.01 -1.15 -0.80 120.40 121.64 2w3s s VAL 61 Ca 0.00 1.09 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 2w3s s VAL 61 Cb 0.00 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2w3s s VAL 61 CO 0.00 0.18 -0.09 -0.38 0.00 0.00 0.00 175.10 174.81 2w3s n ILE 62 N 2.27 0.49 -3.73 2.22 2.08 0.12 -4.95 119.36 117.86 2w3s n ILE 62 Ca 0.04 -0.16 -0.14 0.00 0.56 0.00 0.00 62.75 63.05 2w3s n ILE 62 Cb 0.43 -1.09 -0.08 0.00 -0.75 0.00 0.00 39.64 38.15 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 -2.17 -0.89 -0.02 -1.39 0.00 -1.01 -5.03 121.76 111.25 2w3s s ALA 63 Ca -0.12 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.24 2w3s s ALA 63 Cb 0.04 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.29 2w3s s ALA 63 CO 0.18 -0.31 -0.05 0.08 0.00 0.00 0.00 175.76 175.67 2w3s s VAL 64 N -1.58 0.47 0.15 0.00 1.01 -1.26 -1.17 120.40 118.03 2w3s s VAL 64 Ca -0.11 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 61.80 2w3s s VAL 64 Cb -0.04 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2w3s s VAL 64 CO 0.03 0.18 -0.22 -0.36 0.00 0.00 0.00 175.10 174.73 2w3s s PHE 65 N 0.45 2.01 0.16 5.22 0.40 0.67 -4.95 117.98 121.93 2w3s s PHE 65 Ca -0.05 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 2w3s s PHE 65 Cb -0.09 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.36 2w3s s PHE 65 CO -0.00 0.35 -0.01 0.99 0.70 0.00 0.00 175.22 177.25 2w3s s THR 66 N -1.60 0.64 0.33 0.64 2.01 -1.26 -1.26 115.64 115.14 2w3s s THR 66 Ca 0.15 -1.97 0.08 0.00 0.31 0.00 0.00 61.69 60.26 2w3s s THR 66 Cb -0.08 -2.03 0.31 0.00 0.01 0.00 0.00 72.50 70.72 2w3s s THR 66 CO 0.07 -0.55 1.81 0.00 -0.69 0.00 0.00 174.62 175.25 2w3s h ALA 67 N 2.76 1.76 -0.67 7.40 0.00 -1.81 0.28 119.26 128.99 2w3s h ALA 67 Ca -0.36 0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.68 2w3s h ALA 67 Cb 1.20 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2w3s h ALA 67 CO 0.63 -0.09 0.44 0.00 0.00 0.00 0.00 179.25 180.22 2w3s h ALA 68 N 1.62 1.81 0.00 0.00 0.00 -1.95 -1.56 119.26 119.17 2w3s h ALA 68 Ca 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.43 2w3s h ALA 68 Cb 0.88 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2w3s h ALA 68 CO -0.31 0.07 0.00 -0.25 0.00 0.00 0.00 179.25 178.76 2w3s n ASP 69 N -4.48 0.57 -4.67 0.00 8.00 0.96 -4.79 116.55 112.14 2w3s n ASP 69 Ca 0.10 0.58 -0.42 0.00 0.71 0.00 0.00 54.79 55.76 2w3s n ASP 69 Cb 0.27 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 40.62 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 -4.13 4.33 0.18 0.64 1.43 -0.59 -4.89 118.68 115.65 2w3s s LEU 70 Ca 0.09 2.26 -0.13 0.00 -1.03 0.00 0.00 54.13 55.32 2w3s s LEU 70 Cb 0.12 -3.55 0.08 0.00 0.03 0.00 0.00 46.19 42.88 2w3s s LEU 70 CO 0.51 -0.86 1.83 1.55 0.23 0.00 0.00 176.35 179.61 2w3s h PRO 71 N 8.75 0.77 0.00 1.29 0.13 -1.87 -3.47 132.00 137.60 2w3s h PRO 71 Ca -0.39 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2w3s h PRO 71 Cb 1.18 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2w3s h PRO 71 CO 0.94 0.53 0.00 0.72 -0.23 0.00 0.00 178.00 179.95 2w3s n HIS 72 N -4.66 0.00 -1.69 1.56 8.25 -1.23 -5.05 115.22 112.39 2w3s n HIS 72 Ca 0.04 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.09 2w3s n HIS 72 Cb 0.03 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.16 2w3s n HIS 72 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2w3s n ASP 73 N 0.00 2.42 -3.24 0.41 9.92 -1.11 -4.97 116.55 119.98 2w3s n ASP 73 Ca 0.00 1.09 -0.28 0.00 -0.53 0.00 0.00 54.79 55.07 2w3s n ASP 73 Cb 0.00 -1.49 -0.06 0.00 -0.64 0.00 0.00 41.12 38.93 2w3s n ASP 73 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2w3s n ASN 74 N 0.14 4.28 -3.58 -2.24 5.15 -1.26 -4.53 115.26 113.21 2w3s n ASN 74 Ca 0.07 -3.56 -0.23 0.00 -0.60 0.00 0.00 54.58 50.26 2w3s n ASN 74 Cb 0.40 -0.66 -0.16 0.00 -0.53 0.00 0.00 39.78 38.84 2w3s n ASN 74 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2w3s s ASP 75 N -2.86 1.96 0.00 1.20 2.15 -1.26 -3.35 116.67 114.52 2w3s s ASP 75 Ca 0.44 -0.44 0.23 0.00 0.43 0.00 0.00 52.55 53.20 2w3s s ASP 75 Cb 0.20 -0.04 0.04 0.00 -0.30 0.00 0.00 42.92 42.82 2w3s s ASP 75 CO -0.06 -0.34 1.12 0.00 -0.17 0.00 0.00 175.17 175.72 2w3s n ALA 76 N 5.29 3.52 -1.91 3.66 0.00 0.15 -4.90 120.51 126.32 2w3s n ALA 76 Ca -0.06 -0.63 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 2w3s n ALA 76 Cb 0.49 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 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 -2.47 6.66 0.02 0.00 0.15 -1.25 -4.84 113.70 111.97 2w3s s SER 77 Ca 0.19 2.62 0.19 0.00 0.70 0.00 0.00 55.95 59.65 2w3s s SER 77 Cb 0.18 -2.61 0.80 0.00 -1.71 0.00 0.00 66.02 62.68 2w3s s SER 77 CO 0.57 -0.71 1.61 -0.81 1.20 0.00 0.00 173.24 175.09 2w3s n PRO 78 N 2.76 0.02 -4.06 5.44 -0.04 -1.26 -4.84 135.00 133.02 2w3s n PRO 78 Ca 0.08 0.20 -0.23 0.00 -0.04 0.00 0.00 63.50 63.51 2w3s n PRO 78 Cb 0.40 -1.53 -0.04 0.00 -0.04 0.00 0.00 33.50 32.29 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 -3.02 3.70 0.47 0.55 0.00 -1.26 -5.02 121.76 117.17 2w3s s ALA 79 Ca 0.09 -1.28 0.16 0.00 0.00 0.00 0.00 51.96 50.93 2w3s s ALA 79 Cb 0.12 -1.46 1.14 0.00 0.00 0.00 0.00 23.12 22.91 2w3s s ALA 79 CO 0.35 0.35 2.02 -1.35 0.00 0.00 0.00 175.76 177.13 2w3s h PRO 80 N 1.74 0.25 -6.77 0.00 0.11 -1.93 -3.43 132.00 121.97 2w3s h PRO 80 Ca -0.49 -0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.08 2w3s h PRO 80 Cb 1.22 -0.06 0.06 0.00 0.11 0.00 0.00 31.00 32.34 2w3s h PRO 80 CO 0.62 0.17 0.76 -1.12 -0.21 0.00 0.00 178.00 178.22 2w3s s SER 81 N -6.45 6.62 0.48 -2.05 0.01 -1.26 -4.99 113.70 106.07 2w3s s SER 81 Ca -0.07 2.71 -0.24 0.00 1.31 0.00 0.00 55.95 59.66 2w3s s SER 81 Cb 0.19 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.72 2w3s s SER 81 CO 0.73 -0.72 1.37 -2.16 0.41 0.00 0.00 173.24 172.87 2w3s s PRO 82 N -0.56 3.53 -0.26 12.44 0.04 -1.26 -4.74 135.00 144.19 2w3s s PRO 82 Ca 0.59 2.28 -0.03 0.00 0.04 0.00 0.00 61.00 63.87 2w3s s PRO 82 Cb -0.42 -2.51 0.10 0.00 0.04 0.00 0.00 34.50 31.71 2w3s s PRO 82 CO 0.45 -0.89 0.19 -2.00 0.04 0.00 0.00 177.00 174.79 2w3s s GLU 83 N -2.60 0.21 0.67 4.56 2.12 -1.26 -4.96 118.70 117.45 2w3s s GLU 83 Ca 0.64 -0.24 -0.17 0.00 0.36 0.00 0.00 54.97 55.56 2w3s s GLU 83 Cb -0.41 -1.11 0.00 0.00 0.26 0.00 0.00 34.13 32.88 2w3s s GLU 83 CO 0.51 -0.92 1.29 -1.25 -0.54 0.00 0.00 175.26 174.34 2w3s s PRO 84 N 2.22 2.39 -0.11 4.30 0.04 -1.21 0.32 135.00 142.95 2w3s s PRO 84 Ca 0.08 2.03 -0.20 0.00 0.04 0.00 0.00 61.00 62.94 2w3s s PRO 84 Cb -0.15 -1.83 -0.27 0.00 0.04 0.00 0.00 34.50 32.29 2w3s s PRO 84 CO -0.28 -1.71 0.62 0.28 0.04 0.00 0.00 177.00 175.95 2w3s h VAL 85 N 0.31 1.26 -3.46 -0.36 2.07 -1.91 -3.42 116.25 110.75 2w3s h VAL 85 Ca -0.50 -2.39 -0.67 0.00 0.82 0.00 0.00 66.70 63.96 2w3s h VAL 85 Cb 1.33 2.88 -0.19 0.00 -1.52 0.00 0.00 31.29 33.80 2w3s h VAL 85 CO 0.52 0.63 -0.66 -0.76 0.02 0.00 0.00 177.57 177.32 2w3s s LEU 86 N -7.79 3.32 0.01 2.57 1.43 -1.26 -4.57 118.68 112.39 2w3s s LEU 86 Ca -0.20 -0.00 -0.34 0.00 -1.03 0.00 0.00 54.13 52.57 2w3s s LEU 86 Cb 0.02 -1.76 -0.12 0.00 0.03 0.00 0.00 46.19 44.37 2w3s s LEU 86 CO 0.74 0.31 1.79 0.00 0.23 0.00 0.00 176.35 179.43 2w3s n ALA 87 N 2.58 1.18 -3.15 4.21 0.00 -0.39 -4.69 120.51 120.26 2w3s n ALA 87 Ca -0.18 0.33 -0.44 0.00 0.00 0.00 0.00 53.44 53.15 2w3s n ALA 87 Cb 0.53 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2w3s n ALA 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2w3s n THR 88 N 4.62 4.54 0.00 0.00 -2.24 -1.26 -4.57 114.28 115.37 2w3s n THR 88 Ca 0.20 -5.20 0.00 0.00 -2.27 0.00 0.00 64.05 56.78 2w3s n THR 88 Cb 0.31 -2.50 0.00 0.00 -2.10 0.00 0.00 70.33 66.04 2w3s n THR 88 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w3s n GLY 89 N 2.97 3.19 3.28 3.38 0.00 -1.26 -4.97 105.19 111.79 2w3s n GLY 89 Ca 0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.38 1.00 0.07 1.61 -1.05 -1.26 0.26 118.70 118.95 2w3s s GLU 90 Ca 0.00 -0.81 0.09 0.00 -0.15 0.00 0.00 54.97 54.10 2w3s s GLU 90 Cb 0.00 0.42 -0.03 0.00 -0.44 0.00 0.00 34.13 34.08 2w3s s GLU 90 CO 0.00 -0.37 -0.22 0.14 0.95 0.00 0.00 175.26 175.76 2w3s s VAL 91 N -3.83 2.50 0.00 1.83 -7.23 0.52 -4.82 120.40 109.37 2w3s s VAL 91 Ca 0.04 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 2w3s s VAL 91 Cb 0.03 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.91 2w3s s VAL 91 CO -0.11 0.25 0.26 1.41 -0.31 0.00 0.00 175.10 176.60 2w3s n HIS 92 N 1.36 0.00 -3.64 2.82 8.25 -1.26 -2.48 115.22 120.28 2w3s n HIS 92 Ca -0.17 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.20 2w3s n HIS 92 Cb 0.52 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.61 2w3s n HIS 92 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2w3s s PHE 93 N -0.36 -0.34 -0.59 4.41 -0.12 -1.01 -3.99 117.98 115.97 2w3s s PHE 93 Ca 0.00 0.02 -0.27 0.00 -0.05 0.00 0.00 56.93 56.63 2w3s s PHE 93 Cb 0.00 0.59 0.03 0.00 -0.63 0.00 0.00 43.02 43.02 2w3s s PHE 93 CO 0.00 -1.01 1.12 0.08 -0.05 0.00 0.00 175.22 175.36 2w3s s VAL 94 N -3.83 4.10 0.00 -2.49 1.01 -1.11 -2.94 120.40 115.14 2w3s s VAL 94 Ca 0.06 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.66 2w3s s VAL 94 Cb -0.03 -4.69 0.00 0.00 0.00 0.00 0.00 36.38 31.66 2w3s s VAL 94 CO -0.04 -1.34 0.00 0.61 0.00 0.00 0.00 175.10 174.34 2w3s n GLY 95 N 5.12 1.25 3.68 4.51 0.00 -0.74 -4.83 105.19 114.19 2w3s n GLY 95 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 4.14 0.14 1.61 0.74 -1.15 -4.53 119.66 120.62 2w3s s GLN 96 Ca 0.00 2.57 -0.31 0.00 0.05 0.00 0.00 55.36 57.67 2w3s s GLN 96 Cb 0.00 -3.81 -0.11 0.00 1.10 0.00 0.00 33.01 30.19 2w3s s GLN 96 CO 0.00 -0.88 1.82 -2.30 -0.55 0.00 0.00 175.29 173.39 2w3s n PRO 97 N 6.39 2.82 -0.08 1.67 -0.02 -1.26 0.19 135.00 144.71 2w3s n PRO 97 Ca 0.18 1.02 -0.17 0.00 -2.02 0.00 0.00 63.50 62.52 2w3s n PRO 97 Cb 0.40 -2.92 -0.06 0.00 -0.02 0.00 0.00 33.50 30.90 2w3s n PRO 97 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2w3s n ILE 98 N 4.59 1.09 -4.45 4.25 5.41 -0.17 -1.26 119.36 128.82 2w3s n ILE 98 Ca 0.18 -0.15 -0.22 0.00 1.00 0.00 0.00 62.75 63.55 2w3s n ILE 98 Cb 0.37 -1.82 -0.09 0.00 -0.71 0.00 0.00 39.64 37.39 2w3s n ILE 98 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2w3s s PHE 99 N -2.39 1.81 -0.13 1.39 -0.12 -1.18 -3.85 117.98 113.50 2w3s s PHE 99 Ca -0.24 -1.15 -0.02 0.00 -0.05 0.00 0.00 56.93 55.47 2w3s s PHE 99 Cb 0.08 -1.16 0.05 0.00 -0.63 0.00 0.00 43.02 41.36 2w3s s PHE 99 CO 0.31 -0.20 0.03 -1.17 -0.05 0.00 0.00 175.22 174.14 2w3s s LEU 100 N -3.51 0.79 -0.05 -1.99 2.96 -0.39 -1.03 118.68 115.46 2w3s s LEU 100 Ca 0.31 -0.45 -0.14 0.00 -0.22 0.00 0.00 54.13 53.63 2w3s s LEU 100 Cb 0.06 -0.47 -0.05 0.00 0.50 0.00 0.00 46.19 46.23 2w3s s LEU 100 CO 0.15 -0.26 0.37 -0.69 -1.32 0.00 0.00 176.35 174.60 2w3s s VAL 101 N 1.95 5.13 -0.16 1.68 1.01 0.11 -0.24 120.40 129.88 2w3s s VAL 101 Ca 0.02 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.75 2w3s s VAL 101 Cb -0.15 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.59 2w3s s VAL 101 CO -0.07 0.53 -0.11 0.00 0.00 0.00 0.00 175.10 175.46 2w3s s ALA 102 N -0.70 1.78 0.27 5.51 0.00 -0.31 -2.12 121.76 126.18 2w3s s ALA 102 Ca 0.22 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2w3s s ALA 102 Cb -0.16 -1.12 -0.05 0.00 0.00 0.00 0.00 23.12 21.80 2w3s s ALA 102 CO 0.11 -0.60 0.12 0.00 0.00 0.00 0.00 175.76 175.39 2w3s s ALA 103 N 1.51 1.74 -0.92 0.00 0.00 -0.08 0.13 121.76 124.14 2w3s s ALA 103 Ca 0.02 -1.81 0.20 0.00 0.00 0.00 0.00 51.96 50.38 2w3s s ALA 103 Cb -0.14 1.12 0.85 0.00 0.00 0.00 0.00 23.12 24.95 2w3s s ALA 103 CO -0.09 -0.49 1.65 0.25 0.00 0.00 0.00 175.76 177.08 2w3s n THR 104 N -0.48 0.67 -3.80 0.00 -2.24 0.02 -0.88 114.28 107.57 2w3s n THR 104 Ca 0.01 0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.83 2w3s n THR 104 Cb 0.66 -0.85 -0.07 0.00 -2.10 0.00 0.00 70.33 67.97 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 -3.24 -0.01 0.14 3.42 1.04 -1.26 -4.82 113.70 108.98 2w3s s SER 105 Ca 0.09 -0.45 -0.24 0.00 0.48 0.00 0.00 55.95 55.84 2w3s s SER 105 Cb 0.12 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.61 2w3s s SER 105 CO 0.38 -0.70 1.63 -0.74 0.98 0.00 0.00 173.24 174.79 2w3s h HIS 106 N 2.91 -0.70 -0.40 5.02 2.76 -1.86 -1.90 115.15 120.98 2w3s h HIS 106 Ca -0.33 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 57.96 2w3s h HIS 106 Cb 1.21 0.34 -0.09 0.00 1.55 0.00 0.00 27.41 30.42 2w3s h HIS 106 CO 0.43 -0.34 -0.23 0.00 -1.30 0.00 0.00 177.93 176.48 2w3s h ARG 107 N -0.30 -0.16 -0.38 5.26 2.47 -1.98 0.18 114.38 119.48 2w3s h ARG 107 Ca 0.12 0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.93 2w3s h ARG 107 Cb 0.48 0.04 -0.08 0.00 -1.65 0.00 0.00 29.97 28.76 2w3s h ARG 107 CO -0.36 -0.11 -0.16 0.00 0.56 0.00 0.00 179.97 179.90 2w3s h ALA 108 N 1.03 0.14 -0.37 0.04 0.00 -1.82 0.18 119.26 118.47 2w3s h ALA 108 Ca 0.19 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.28 2w3s h ALA 108 Cb 0.46 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2w3s h ALA 108 CO -0.50 -0.53 0.14 0.00 0.00 0.00 0.00 179.25 178.37 2w3s h ALA 109 N 1.22 0.43 0.15 0.00 0.00 -0.45 0.53 119.26 121.14 2w3s h ALA 109 Ca 0.19 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2w3s h ALA 109 Cb 0.37 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2w3s h ALA 109 CO -0.43 -0.24 -0.13 0.00 0.00 0.00 0.00 179.25 178.44 2w3s h ARG 110 N 0.31 -0.30 -0.73 0.00 2.47 -0.58 0.67 114.38 116.23 2w3s h ARG 110 Ca 0.16 0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.90 2w3s h ARG 110 Cb 0.12 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.47 2w3s h ARG 110 CO -0.15 -0.20 0.43 0.82 0.56 0.00 0.00 179.97 181.43 2w3s h ILE 111 N -0.31 1.21 -0.18 2.04 2.04 -0.48 -1.89 117.51 119.94 2w3s h ILE 111 Ca -0.00 -0.48 -0.07 0.00 1.00 0.00 0.00 64.86 65.31 2w3s h ILE 111 Cb 0.28 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2w3s h ILE 111 CO -0.03 0.22 -0.18 0.00 0.00 0.00 0.00 178.15 178.17 2w3s h ALA 112 N 1.22 1.36 0.00 1.87 0.00 0.32 -2.80 119.26 121.23 2w3s h ALA 112 Ca 0.26 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2w3s h ALA 112 Cb -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2w3s h ALA 112 CO -0.05 0.44 -0.15 0.00 0.00 0.00 0.00 179.25 179.50 2w3s h ALA 113 N 1.53 1.44 0.00 0.00 0.00 -0.01 -2.55 119.26 119.68 2w3s h ALA 113 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2w3s h ALA 113 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2w3s h ALA 113 CO 0.03 0.18 0.00 0.54 0.00 0.00 0.00 179.25 180.00 2w3s n ARG 114 N -3.91 0.99 -0.13 0.00 1.74 -1.05 -4.19 116.66 110.11 2w3s n ARG 114 Ca -0.02 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.10 2w3s n ARG 114 Cb 0.24 -1.27 0.11 0.00 -1.02 0.00 0.00 32.46 30.52 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 -0.77 2.89 -2.40 5.56 5.02 -0.96 -5.00 118.16 122.50 2w3s n LYS 115 Ca 0.13 -1.93 -0.39 0.00 -2.02 0.00 0.00 58.31 54.10 2w3s n LYS 115 Cb 0.06 -1.21 -0.03 0.00 -0.02 0.00 0.00 35.03 33.82 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 -1.10 3.32 -0.34 7.82 0.00 -1.26 -4.30 121.76 125.90 2w3s s ALA 116 Ca 0.17 0.94 -0.20 0.00 0.00 0.00 0.00 51.96 52.87 2w3s s ALA 116 Cb 0.10 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.86 2w3s s ALA 116 CO 0.11 -0.31 0.61 1.03 0.00 0.00 0.00 175.76 177.20 2w3s s ARG 117 N -1.82 3.74 -0.09 0.00 0.52 -0.69 -5.00 118.95 115.61 2w3s s ARG 117 Ca 0.50 0.09 0.04 0.00 -0.52 0.00 0.00 55.73 55.84 2w3s s ARG 117 Cb -0.31 -3.78 -0.00 0.00 0.52 0.00 0.00 34.95 31.37 2w3s s ARG 117 CO 0.40 -0.67 -0.24 0.42 0.02 0.00 0.00 175.30 175.23 2w3s s ILE 118 N 2.62 2.06 -0.15 1.52 1.01 -1.26 -0.88 121.20 126.12 2w3s s ILE 118 Ca 0.24 -1.03 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 2w3s s ILE 118 Cb -0.15 -1.77 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 2w3s s ILE 118 CO 0.14 0.56 -0.05 0.42 0.00 0.00 0.00 174.94 176.00 2w3s s THR 119 N 0.23 3.76 0.27 2.92 -4.23 -0.59 -4.99 115.64 113.01 2w3s s THR 119 Ca -0.16 -0.41 0.09 0.00 -1.18 0.00 0.00 61.69 60.03 2w3s s THR 119 Cb -0.17 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 2w3s s THR 119 CO 0.08 0.50 0.07 -0.31 -0.54 0.00 0.00 174.62 174.42 2w3s s TYR 120 N 0.29 2.81 -0.63 3.99 1.51 -1.26 0.19 117.35 124.24 2w3s s TYR 120 Ca -0.04 -0.21 -0.02 0.00 -1.01 0.00 0.00 57.07 55.79 2w3s s TYR 120 Cb -0.14 -1.30 0.16 0.00 -0.11 0.00 0.00 41.96 40.57 2w3s s TYR 120 CO 0.03 0.56 0.44 0.00 -1.11 0.00 0.00 175.55 175.47 2w3s s ALA 121 N -2.29 3.59 0.52 3.71 0.00 0.32 -4.74 121.76 122.88 2w3s s ALA 121 Ca 0.33 -3.33 -0.21 0.00 0.00 0.00 0.00 51.96 48.75 2w3s s ALA 121 Cb -0.06 -2.59 -0.08 0.00 0.00 0.00 0.00 23.12 20.39 2w3s s ALA 121 CO 0.22 -2.10 0.95 -2.30 0.00 0.00 0.00 175.76 172.52 2w3s n PRO 122 N 3.30 1.08 -4.37 0.00 -0.02 -1.26 -1.59 135.00 132.14 2w3s n PRO 122 Ca 0.09 0.40 -0.20 0.00 -2.02 0.00 0.00 63.50 61.77 2w3s n PRO 122 Cb 0.37 -2.08 -0.10 0.00 -0.02 0.00 0.00 33.50 31.67 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 -2.37 1.41 0.13 -0.52 0.52 0.17 -4.85 118.95 113.44 2w3s s ARG 123 Ca 0.69 -1.63 -0.31 0.00 -0.52 0.00 0.00 55.73 53.96 2w3s s ARG 123 Cb -0.48 -1.28 -0.09 0.00 0.52 0.00 0.00 34.95 33.63 2w3s s ARG 123 CO 0.52 0.22 1.48 -1.25 0.02 0.00 0.00 175.30 176.29 2w3s s PRO 124 N -3.60 4.27 -0.10 3.54 0.04 -1.26 -4.61 135.00 133.29 2w3s s PRO 124 Ca 0.24 2.21 -0.09 0.00 0.04 0.00 0.00 61.00 63.40 2w3s s PRO 124 Cb -0.02 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 2w3s s PRO 124 CO 0.09 -0.53 0.21 0.00 0.04 0.00 0.00 177.00 176.81 2w3s s ALA 125 N 1.22 3.82 -0.44 8.56 0.00 -1.26 -4.94 121.76 128.72 2w3s s ALA 125 Ca 0.67 -0.54 -0.18 0.00 0.00 0.00 0.00 51.96 51.91 2w3s s ALA 125 Cb -0.40 -2.09 0.03 0.00 0.00 0.00 0.00 23.12 20.67 2w3s s ALA 125 CO 0.31 0.55 0.50 0.42 0.00 0.00 0.00 175.76 177.54 2w3s s ILE 126 N -0.93 5.02 -0.01 0.00 1.01 -1.26 -4.92 121.20 120.11 2w3s s ILE 126 Ca 0.17 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.50 2w3s s ILE 126 Cb -0.13 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.17 2w3s s ILE 126 CO 0.06 -0.53 0.06 0.18 0.00 0.00 0.00 174.94 174.71 2w3s n LEU 127 N 5.78 0.00 -4.64 2.97 4.77 -1.26 -1.21 117.00 123.41 2w3s n LEU 127 Ca -0.07 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.67 2w3s n LEU 127 Cb 0.47 0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2w3s n LEU 127 CO 0.49 0.01 -0.30 0.42 -1.33 0.00 0.00 177.39 176.68 2w3s s THR 128 N -2.21 2.81 0.13 -5.08 -4.23 -1.26 -4.90 115.64 100.90 2w3s s THR 128 Ca -0.01 -1.95 -0.21 0.00 -1.18 0.00 0.00 61.69 58.34 2w3s s THR 128 Cb 0.02 -2.80 -0.01 0.00 1.34 0.00 0.00 72.50 71.04 2w3s s THR 128 CO 0.14 -0.24 1.68 -0.07 -0.54 0.00 0.00 174.62 175.60 2w3s h LEU 129 N 1.81 -0.34 -0.09 4.79 3.38 -1.96 -1.19 115.31 121.71 2w3s h LEU 129 Ca -0.43 0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.65 2w3s h LEU 129 Cb 1.25 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.15 2w3s h LEU 129 CO 0.65 -0.14 -0.09 0.44 0.09 0.00 0.00 178.44 179.39 2w3s h ASP 130 N -0.09 -0.28 -0.79 -0.43 3.32 -1.97 0.59 116.42 116.77 2w3s h ASP 130 Ca 0.10 0.06 0.19 0.00 0.02 0.00 0.00 57.03 57.40 2w3s h ASP 130 Cb 0.24 0.14 -0.12 0.00 0.22 0.00 0.00 39.33 39.81 2w3s h ASP 130 CO -0.24 -0.13 0.16 1.56 -1.72 0.00 0.00 179.24 178.88 2w3s h GLN 131 N -0.12 0.21 -0.04 3.56 4.20 -1.87 1.26 115.11 122.32 2w3s h GLN 131 Ca 0.07 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2w3s h GLN 131 Cb 0.21 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2w3s h GLN 131 CO -0.16 0.14 -0.01 0.00 -0.67 0.00 0.00 178.83 178.13 2w3s h ALA 132 N 1.69 0.06 0.22 3.87 0.00 0.18 -0.28 119.26 125.00 2w3s h ALA 132 Ca 0.46 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2w3s h ALA 132 Cb 0.84 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 2w3s h ALA 132 CO -0.59 -0.23 -0.42 1.25 0.00 0.00 0.00 179.25 179.26 2w3s h LEU 133 N -0.29 -1.21 -0.85 0.00 5.85 0.12 0.24 115.31 119.17 2w3s h LEU 133 Ca 0.01 0.12 0.22 0.00 0.84 0.00 0.00 57.88 59.07 2w3s h LEU 133 Cb 0.42 0.44 -0.15 0.00 0.37 0.00 0.00 40.66 41.74 2w3s h LEU 133 CO 0.00 -0.52 0.10 0.00 -0.34 0.00 0.00 178.44 177.69 2w3s h ALA 134 N -0.30 1.05 -0.25 1.25 0.00 0.17 -1.39 119.26 119.79 2w3s h ALA 134 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2w3s h ALA 134 Cb 0.71 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2w3s h ALA 134 CO -0.18 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.60 2w3s n ALA 135 N -2.88 2.49 -4.10 0.00 0.00 -0.13 -4.91 120.51 110.97 2w3s n ALA 135 Ca 0.18 -0.63 -0.31 0.00 0.00 0.00 0.00 53.44 52.69 2w3s n ALA 135 Cb 0.61 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 2w3s n ALA 135 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2w3s n ASP 136 N 0.57 -1.50 -4.48 0.00 2.03 -0.51 -4.95 116.55 107.70 2w3s n ASP 136 Ca 0.16 -1.03 -0.43 0.00 0.52 0.00 0.00 54.79 54.01 2w3s n ASP 136 Cb 0.37 -2.80 -0.07 0.00 -0.72 0.00 0.00 41.12 37.90 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 -3.91 6.26 0.25 1.67 0.15 0.72 -5.00 113.70 113.84 2w3s s SER 137 Ca 0.32 -0.62 -0.07 0.00 0.70 0.00 0.00 55.95 56.28 2w3s s SER 137 Cb -0.17 -2.29 0.03 0.00 -1.71 0.00 0.00 66.02 61.87 2w3s s SER 137 CO 0.91 -0.79 0.46 -2.11 1.20 0.00 0.00 173.24 172.92 2w3s n ARG 138 N 6.12 0.67 -4.49 5.44 1.85 -1.26 -1.58 116.66 123.41 2w3s n ARG 138 Ca -0.04 -1.61 -0.25 0.00 -1.00 0.00 0.00 57.85 54.94 2w3s n ARG 138 Cb 0.47 1.84 -0.10 0.00 -1.05 0.00 0.00 32.46 33.62 2w3s n ARG 138 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2w3s s PHE 139 N -4.19 2.41 0.00 2.89 0.40 -0.19 -4.56 117.98 114.73 2w3s s PHE 139 Ca 0.13 -0.44 0.00 0.00 -0.60 0.00 0.00 56.93 56.02 2w3s s PHE 139 Cb -0.02 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.21 2w3s s PHE 139 CO 0.10 0.60 0.00 0.39 0.70 0.00 0.00 175.22 177.01 2w3s n GLU 140 N -0.78 0.00 -2.08 0.44 1.02 -1.26 -4.43 120.64 113.55 2w3s n GLU 140 Ca -0.05 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.08 2w3s n GLU 140 Cb 0.62 -2.56 -0.01 0.00 -0.02 0.00 0.00 31.44 29.47 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 -1.58 -4.89 0.50 0.62 0.00 -1.26 -4.99 105.19 93.59 2w3s n GLY 141 Ca 0.00 0.37 0.04 0.00 0.00 0.00 0.00 46.02 46.43 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 1.29 -2.99 3.68 -0.02 0.00 -1.26 -5.00 105.19 100.89 2w3s n GLY 142 Ca -0.11 -1.26 -0.30 0.00 0.00 0.00 0.00 46.02 44.35 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 -3.76 -0.45 -0.13 1.61 0.04 -1.26 -4.88 135.00 126.17 2w3s s PRO 143 Ca 0.00 -0.02 -0.02 0.00 0.04 0.00 0.00 61.00 61.00 2w3s s PRO 143 Cb 0.00 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.83 2w3s s PRO 143 CO 0.00 -3.21 -0.04 0.08 0.04 0.00 0.00 177.00 173.87 2w3s s VAL 144 N -3.18 3.86 -0.12 -0.36 1.01 -0.70 -4.89 120.40 116.01 2w3s s VAL 144 Ca 0.70 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2w3s s VAL 144 Cb -0.10 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.64 2w3s s VAL 144 CO 0.55 0.53 -0.13 -0.63 0.00 0.00 0.00 175.10 175.42 2w3s s ILE 145 N 0.01 1.40 0.10 2.22 1.01 -1.26 -0.14 121.20 124.54 2w3s s ILE 145 Ca 0.00 -0.56 0.09 0.00 0.00 0.00 0.00 60.65 60.18 2w3s s ILE 145 Cb -0.13 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 2w3s s ILE 145 CO 0.03 0.42 -0.18 0.26 0.00 0.00 0.00 174.94 175.47 2w3s s TRP 146 N 1.22 2.54 -0.10 3.97 0.51 -0.37 -4.93 118.94 121.78 2w3s s TRP 146 Ca -0.02 -0.26 -0.07 0.00 -2.12 0.00 0.00 56.10 53.62 2w3s s TRP 146 Cb -0.14 -1.37 0.03 0.00 -0.81 0.00 0.00 33.47 31.18 2w3s s TRP 146 CO -0.05 0.36 0.25 0.00 -0.51 0.00 0.00 176.95 177.00 2w3s s ALA 147 N -1.10 -0.60 -0.16 0.98 0.00 -1.26 -1.32 121.76 118.29 2w3s s ALA 147 Ca 0.17 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 52.94 2w3s s ALA 147 Cb -0.11 -0.49 0.04 0.00 0.00 0.00 0.00 23.12 22.57 2w3s s ALA 147 CO 0.09 -0.15 -0.03 0.50 0.00 0.00 0.00 175.76 176.18 2w3s s ARG 148 N 0.53 1.19 3.40 0.00 3.00 0.33 -4.98 118.95 122.42 2w3s s ARG 148 Ca -0.03 -0.45 0.00 0.00 -1.00 0.00 0.00 55.73 54.24 2w3s s ARG 148 Cb -0.05 -1.95 0.00 0.00 0.00 0.00 0.00 34.95 32.96 2w3s s ARG 148 CO -0.03 -0.47 0.00 0.41 0.00 0.00 0.00 175.30 175.21 2w3s n GLY 149 N 4.93 0.14 2.96 8.12 0.00 -1.26 -1.75 105.19 118.33 2w3s n GLY 149 Ca -0.11 -0.93 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 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 3.99 -0.01 1.61 2.15 -1.26 -4.92 116.67 114.22 2w3s s ASP 150 Ca 0.00 -1.25 -0.20 0.00 0.43 0.00 0.00 52.55 51.53 2w3s s ASP 150 Cb 0.00 -1.26 -0.26 0.00 -0.30 0.00 0.00 42.92 41.10 2w3s s ASP 150 CO 0.00 -0.23 1.03 -0.37 -0.17 0.00 0.00 175.17 175.43 2w3s h VAL 151 N 6.69 1.45 -0.44 1.11 -1.51 -1.89 -2.45 116.25 119.21 2w3s h VAL 151 Ca -0.18 -2.25 0.05 0.00 -1.23 0.00 0.00 66.70 63.09 2w3s h VAL 151 Cb 1.06 2.82 -0.08 0.00 -2.13 0.00 0.00 31.29 32.96 2w3s h VAL 151 CO 0.42 0.65 -0.51 -0.08 -1.23 0.00 0.00 177.57 176.83 2w3s h GLU 152 N -0.19 -0.30 0.01 5.19 4.57 -1.99 0.62 114.58 122.49 2w3s h GLU 152 Ca -0.10 0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.11 2w3s h GLU 152 Cb 1.45 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 30.07 2w3s h GLU 152 CO 0.13 -0.20 -0.35 1.15 -1.18 0.00 0.00 179.01 178.57 2w3s h THR 153 N -0.31 0.00 -0.74 0.32 2.02 -1.99 -0.54 112.91 111.67 2w3s h THR 153 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.35 2w3s h THR 153 Cb 0.51 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.85 2w3s h THR 153 CO -0.58 0.00 0.39 0.00 0.37 0.00 0.00 175.52 175.70 2w3s h ALA 154 N -0.82 1.04 -0.04 6.16 0.00 -0.83 -2.35 119.26 122.42 2w3s h ALA 154 Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2w3s h ALA 154 Cb 0.47 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2w3s h ALA 154 CO -0.23 -0.01 -0.01 -0.07 0.00 0.00 0.00 179.25 178.94 2w3s h LEU 155 N 0.66 0.07 -1.66 0.00 3.38 0.28 -3.10 115.31 114.93 2w3s h LEU 155 Ca 0.36 -0.35 0.36 0.00 0.09 0.00 0.00 57.88 58.34 2w3s h LEU 155 Cb 0.37 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 2w3s h LEU 155 CO -0.26 0.41 0.85 0.00 0.09 0.00 0.00 178.44 179.53 2w3s h ALA 156 N 0.66 2.82 -0.44 1.53 0.00 -0.58 -0.14 119.26 123.11 2w3s h ALA 156 Ca 0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2w3s h ALA 156 Cb 0.38 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 2w3s h ALA 156 CO 0.00 -1.27 0.07 0.41 0.00 0.00 0.00 179.25 178.46 2w3s n GLY 157 N -1.63 4.02 3.78 0.00 0.00 -0.97 -5.02 105.19 105.37 2w3s n GLY 157 Ca 0.30 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.96 3.57 0.31 4.61 0.00 -0.07 -4.99 121.76 122.24 2w3s s ALA 158 Ca 0.47 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.30 2w3s s ALA 158 Cb 0.39 -2.57 0.50 0.00 0.00 0.00 0.00 23.12 21.44 2w3s s ALA 158 CO 0.09 0.24 1.95 0.00 0.00 0.00 0.00 175.76 178.04 2w3s h ALA 159 N 5.57 1.41 -3.72 0.00 0.00 -1.81 -3.43 119.26 117.29 2w3s h ALA 159 Ca -0.46 -0.09 -0.35 0.00 0.00 0.00 0.00 54.91 54.00 2w3s h ALA 159 Cb 1.20 -0.27 -0.26 0.00 0.00 0.00 0.00 17.79 18.46 2w3s h ALA 159 CO 0.68 0.50 -0.76 -1.01 0.00 0.00 0.00 179.25 178.66 2w3s s HIS 160 N -5.66 0.75 -0.03 0.00 3.76 -0.82 -4.93 115.29 108.35 2w3s s HIS 160 Ca -0.10 -0.26 -0.08 0.00 -0.15 0.00 0.00 55.06 54.47 2w3s s HIS 160 Cb 0.17 -0.46 0.01 0.00 1.11 0.00 0.00 32.58 33.41 2w3s s HIS 160 CO 0.78 -0.02 0.17 -1.17 -0.85 0.00 0.00 174.74 173.66 2w3s s LEU 161 N -0.72 1.39 -0.04 0.89 0.20 -1.26 -1.41 118.68 117.73 2w3s s LEU 161 Ca -0.01 0.06 0.02 0.00 0.69 0.00 0.00 54.13 54.89 2w3s s LEU 161 Cb -0.06 0.71 0.01 0.00 -0.43 0.00 0.00 46.19 46.43 2w3s s LEU 161 CO 0.00 -0.25 -0.08 0.00 -0.29 0.00 0.00 176.35 175.73 2w3s s ALA 162 N -0.77 0.83 0.04 5.97 0.00 0.34 -4.95 121.76 123.22 2w3s s ALA 162 Ca -0.09 -0.23 0.06 0.00 0.00 0.00 0.00 51.96 51.70 2w3s s ALA 162 Cb -0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2w3s s ALA 162 CO 0.01 0.08 -0.14 -1.21 0.00 0.00 0.00 175.76 174.51 2w3s s GLU 163 N 0.50 2.21 -0.15 0.00 2.02 -1.26 -1.28 118.70 120.74 2w3s s GLU 163 Ca -0.08 -0.92 -0.34 0.00 0.02 0.00 0.00 54.97 53.65 2w3s s GLU 163 Cb -0.12 -2.29 0.14 0.00 0.10 0.00 0.00 34.13 31.96 2w3s s GLU 163 CO 0.01 0.55 1.28 0.20 0.02 0.00 0.00 175.26 177.32 2w3s s GLY 164 N -1.55 -0.33 0.28 -1.39 0.00 -0.96 -5.01 107.32 98.36 2w3s s GLY 164 Ca 0.16 1.33 0.02 0.00 0.00 0.00 0.00 44.72 46.24 2w3s s GLY 164 CO 0.07 0.40 0.15 0.00 0.00 0.00 0.00 173.10 173.72 2w3s s PHE 166 N -3.70 -0.44 0.36 0.00 -0.12 -0.56 -4.97 117.98 108.55 2w3s s PHE 166 Ca 0.37 0.78 -0.24 0.00 -0.05 0.00 0.00 56.93 57.78 2w3s s PHE 166 Cb 0.06 0.43 -0.10 0.00 -0.63 0.00 0.00 43.02 42.78 2w3s s PHE 166 CO 0.16 -0.39 0.95 -1.21 -0.05 0.00 0.00 175.22 174.69 2w3s s GLU 167 N -1.01 4.45 -0.06 1.99 0.41 -1.26 -2.23 118.70 120.98 2w3s s GLU 167 Ca -0.03 1.26 -0.01 0.00 -0.41 0.00 0.00 54.97 55.78 2w3s s GLU 167 Cb -0.01 -2.58 0.03 0.00 -1.78 0.00 0.00 34.13 29.79 2w3s s GLU 167 CO 0.03 0.16 0.00 0.42 -0.49 0.00 0.00 175.26 175.38 2w3s s ILE 168 N -1.81 0.35 0.64 -1.63 1.01 0.76 -2.03 121.20 118.49 2w3s s ILE 168 Ca 0.55 0.11 -0.09 0.00 0.00 0.00 0.00 60.65 61.22 2w3s s ILE 168 Cb -0.15 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 41.82 2w3s s ILE 168 CO 0.20 0.25 1.00 -0.83 0.00 0.00 0.00 174.94 175.56 2w3s s GLY 169 N 1.82 1.61 0.21 6.18 0.00 -1.22 -0.35 107.32 115.57 2w3s s GLY 169 Ca 0.02 -0.44 -0.03 0.00 0.00 0.00 0.00 44.72 44.27 2w3s s GLY 169 CO -0.04 -0.13 0.23 0.61 0.00 0.00 0.00 173.10 173.77 2w3s n GLY 170 N -2.78 -1.79 3.21 0.20 0.00 -1.26 -4.38 105.19 98.39 2w3s n GLY 170 Ca 0.06 -1.58 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 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 -3.52 0.37 -0.05 1.61 0.74 -1.25 -4.77 119.66 112.80 2w3s s GLN 171 Ca 0.14 0.52 -0.16 0.00 0.05 0.00 0.00 55.36 55.92 2w3s s GLN 171 Cb -0.01 0.12 -0.05 0.00 1.10 0.00 0.00 33.01 34.18 2w3s s GLN 171 CO 0.10 -0.08 0.41 -2.00 -0.55 0.00 0.00 175.29 173.18 2w3s s GLU 172 N 0.48 4.09 0.07 1.67 2.56 -1.26 -1.20 118.70 125.11 2w3s s GLU 172 Ca -0.02 0.38 -0.23 0.00 0.00 0.00 0.00 54.97 55.10 2w3s s GLU 172 Cb -0.04 -3.31 -0.14 0.00 2.00 0.00 0.00 34.13 32.63 2w3s s GLU 172 CO -0.03 0.48 1.65 0.45 -0.56 0.00 0.00 175.26 177.26 2w3s h HIS 173 N 5.54 0.06 -6.18 5.30 3.86 -1.95 -3.47 115.15 118.31 2w3s h HIS 173 Ca -0.47 -0.00 -0.45 0.00 -1.16 0.00 0.00 60.37 58.29 2w3s h HIS 173 Cb 1.20 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.67 2w3s h HIS 173 CO 0.67 0.13 -0.78 0.34 0.86 0.00 0.00 177.93 179.15 2w3s n PHE 174 N -5.01 -2.17 -1.68 2.45 7.35 -1.26 -4.97 117.46 112.17 2w3s n PHE 174 Ca -0.07 0.89 -0.45 0.00 -0.76 0.00 0.00 57.45 57.06 2w3s n PHE 174 Cb 0.08 -4.23 -0.03 0.00 0.35 0.00 0.00 39.48 35.65 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 -4.53 2.27 0.02 -5.13 0.18 -1.26 -4.92 117.16 103.80 2w3s n TYR 175 Ca -0.11 0.37 -0.02 0.00 1.88 0.00 0.00 57.90 60.02 2w3s n TYR 175 Cb 0.59 -2.50 0.23 0.00 -0.38 0.00 0.00 39.34 37.29 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 4.66 0.46 -9.27 -3.48 -0.00 -1.87 -3.38 115.31 102.43 2w3s h LEU 176 Ca -0.45 -0.14 -0.58 0.00 -0.00 0.00 0.00 57.88 56.71 2w3s h LEU 176 Cb 1.26 -0.12 -0.08 0.00 -0.00 0.00 0.00 40.66 41.72 2w3s h LEU 176 CO 0.79 0.68 0.01 -0.70 -0.00 0.00 0.00 178.44 179.22 2w3s s GLU 177 N -4.57 4.33 0.00 1.13 2.12 -0.94 -5.07 118.70 115.70 2w3s s GLU 177 Ca -0.07 0.63 0.00 0.00 0.36 0.00 0.00 54.97 55.89 2w3s s GLU 177 Cb 0.14 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 31.05 2w3s s GLU 177 CO 0.78 0.00 0.00 0.41 -0.54 0.00 0.00 175.26 175.91 2w3s n GLY 178 N 3.40 -1.67 3.72 -1.50 0.00 -1.26 -4.76 105.19 103.11 2w3s n GLY 178 Ca -0.03 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.61 4.38 -0.03 1.61 -1.52 -1.26 -4.94 119.66 115.28 2w3s s GLN 179 Ca 0.00 1.99 -0.17 0.00 -1.95 0.00 0.00 55.36 55.23 2w3s s GLN 179 Cb 0.00 -3.25 0.03 0.00 -0.22 0.00 0.00 33.01 29.57 2w3s s GLN 179 CO 0.00 -0.32 0.38 0.00 -0.25 0.00 0.00 175.29 175.10 2w3s s ALA 180 N 0.69 -0.97 0.08 6.09 0.00 -1.26 -1.26 121.76 125.13 2w3s s ALA 180 Ca 0.60 0.57 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 2w3s s ALA 180 Cb -0.35 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 22.77 2w3s s ALA 180 CO 0.33 -0.27 0.24 0.00 0.00 0.00 0.00 175.76 176.06 2w3s s ALA 181 N -1.16 -0.41 -0.18 0.00 0.00 0.37 -1.20 121.76 119.18 2w3s s ALA 181 Ca -0.12 -0.40 -0.06 0.00 0.00 0.00 0.00 51.96 51.38 2w3s s ALA 181 Cb -0.04 0.47 0.09 0.00 0.00 0.00 0.00 23.12 23.64 2w3s s ALA 181 CO 0.05 -0.50 0.37 -1.17 0.00 0.00 0.00 175.76 174.51 2w3s s LEU 182 N -2.65 -0.55 -0.16 0.00 2.96 0.42 -1.31 118.68 117.40 2w3s s LEU 182 Ca 0.02 0.84 -0.02 0.00 -0.22 0.00 0.00 54.13 54.75 2w3s s LEU 182 Cb 0.03 1.15 -0.02 0.00 0.50 0.00 0.00 46.19 47.85 2w3s s LEU 182 CO -0.09 -0.24 -0.08 0.00 -1.32 0.00 0.00 176.35 174.62 2w3s s ALA 183 N 2.56 2.80 -0.28 5.97 0.00 0.20 -1.50 121.76 131.51 2w3s s ALA 183 Ca -0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 51.04 2w3s s ALA 183 Cb -0.12 -1.44 0.05 0.00 0.00 0.00 0.00 23.12 21.61 2w3s s ALA 183 CO -0.12 0.10 -0.05 -0.51 0.00 0.00 0.00 175.76 175.19 2w3s s LEU 184 N 0.58 3.61 0.14 0.00 1.43 0.35 -2.19 118.68 122.59 2w3s s LEU 184 Ca -0.05 -1.23 -0.31 0.00 -1.03 0.00 0.00 54.13 51.51 2w3s s LEU 184 Cb -0.15 -1.65 -0.09 0.00 0.03 0.00 0.00 46.19 44.33 2w3s s LEU 184 CO 0.03 -0.21 1.45 -2.16 0.23 0.00 0.00 176.35 175.69 2w3s s PRO 185 N 1.22 4.29 -0.35 1.29 0.04 -1.26 -0.86 135.00 139.36 2w3s s PRO 185 Ca -0.05 2.18 -0.00 0.00 0.04 0.00 0.00 61.00 63.16 2w3s s PRO 185 Cb -0.19 -3.21 0.13 0.00 0.04 0.00 0.00 34.50 31.27 2w3s s PRO 185 CO -0.03 -0.48 0.20 0.00 0.04 0.00 0.00 177.00 176.72 2w3s s ALA 186 N 1.02 1.02 -0.63 8.56 0.00 -0.69 -4.93 121.76 126.11 2w3s s ALA 186 Ca 0.66 -1.81 -0.17 0.00 0.00 0.00 0.00 51.96 50.63 2w3s s ALA 186 Cb -0.39 -1.60 0.03 0.00 0.00 0.00 0.00 23.12 21.15 2w3s s ALA 186 CO 0.31 -2.02 0.64 0.39 0.00 0.00 0.00 175.76 175.08 2w3s n GLU 187 N 4.20 -1.76 0.00 0.00 1.02 -1.26 -1.38 120.64 121.46 2w3s n GLU 187 Ca 0.08 1.23 0.00 0.00 -0.02 0.00 0.00 57.16 58.46 2w3s n GLU 187 Cb 0.38 -2.89 0.00 0.00 -0.02 0.00 0.00 31.44 28.91 2w3s n GLU 187 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3s n GLY 188 N -0.95 2.85 0.00 0.62 0.00 -1.26 -4.98 105.19 101.47 2w3s n GLY 188 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 4.65 3.17 -0.02 0.00 -0.48 -5.04 105.19 105.47 2w3s n GLY 189 Ca 0.00 -2.03 -0.15 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.98 0.96 -0.14 1.61 -7.23 -0.60 -1.70 120.40 112.32 2w3s s VAL 190 Ca 0.00 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2w3s s VAL 190 Cb 0.00 -1.30 -0.01 0.00 0.56 0.00 0.00 36.38 35.64 2w3s s VAL 190 CO 0.00 -0.51 -0.15 -0.69 -0.31 0.00 0.00 175.10 173.45 2w3s s VAL 191 N -2.24 2.80 -0.25 1.32 1.01 -0.04 -1.80 120.40 121.20 2w3s s VAL 191 Ca 0.04 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 2w3s s VAL 191 Cb -0.04 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 2w3s s VAL 191 CO 0.00 0.52 0.02 -0.63 0.00 0.00 0.00 175.10 175.02 2w3s s ILE 192 N 0.56 3.78 -0.14 2.22 -1.09 0.11 -0.50 121.20 126.14 2w3s s ILE 192 Ca -0.09 -0.47 -0.06 0.00 -2.23 0.00 0.00 60.65 57.79 2w3s s ILE 192 Cb -0.16 -2.80 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 2w3s s ILE 192 CO 0.04 0.30 0.08 -1.00 -1.23 0.00 0.00 174.94 173.13 2w3s s HIS 193 N 1.52 3.36 0.24 3.97 3.76 -0.56 -0.47 115.29 127.11 2w3s s HIS 193 Ca 0.05 0.28 -0.19 0.00 -0.15 0.00 0.00 55.06 55.05 2w3s s HIS 193 Cb -0.15 -1.97 0.02 0.00 1.11 0.00 0.00 32.58 31.59 2w3s s HIS 193 CO 0.00 0.44 0.62 0.00 -0.85 0.00 0.00 174.74 174.95 2w3s s SER 195 N -2.91 6.73 -0.02 0.00 0.15 -0.34 -4.71 113.70 112.61 2w3s s SER 195 Ca 0.12 -2.71 -0.04 0.00 0.70 0.00 0.00 55.95 54.01 2w3s s SER 195 Cb -0.03 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2w3s s SER 195 CO 0.03 -0.56 0.10 -0.55 1.20 0.00 0.00 173.24 173.45 2w3s s SER 196 N 2.10 -0.02 0.00 5.45 0.15 -1.26 -4.61 113.70 115.51 2w3s s SER 196 Ca 0.18 -0.02 0.29 0.00 0.70 0.00 0.00 55.95 57.10 2w3s s SER 196 Cb -0.10 0.20 1.27 0.00 -1.71 0.00 0.00 66.02 65.67 2w3s s SER 196 CO -0.09 -0.18 1.89 0.00 1.20 0.00 0.00 173.24 176.06 2w3s n GLN 197 N 2.34 0.61 -3.15 5.44 6.02 -0.92 -4.60 117.38 123.13 2w3s n GLN 197 Ca -0.17 -0.18 -0.21 0.00 -0.01 0.00 0.00 57.00 56.43 2w3s n GLN 197 Cb 0.57 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.28 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 -1.04 -1.36 -0.08 1.08 -0.00 -1.25 -1.15 115.22 111.43 2w3s n HIS 198 Ca 0.14 -2.98 -0.08 0.00 0.46 0.00 0.00 57.72 55.26 2w3s n HIS 198 Cb 0.27 0.32 -0.01 0.00 -0.12 0.00 0.00 29.99 30.46 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 4.65 0.25 -0.83 1.57 0.11 -1.91 -2.05 132.00 133.80 2w3s h PRO 199 Ca 0.10 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 66.32 2w3s h PRO 199 Cb 0.94 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 31.91 2w3s h PRO 199 CO 0.36 0.17 0.45 0.77 -0.21 0.00 0.00 178.00 179.54 2w3s h SER 200 N 0.26 0.59 -0.76 -2.05 0.02 -1.92 0.81 113.55 110.50 2w3s h SER 200 Ca 0.12 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 2w3s h SER 200 Cb 0.07 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 2w3s h SER 200 CO -0.11 0.30 0.29 -0.08 -1.14 0.00 0.00 176.83 176.09 2w3s h GLU 201 N 0.70 1.14 -0.08 3.45 4.81 -1.76 -1.79 114.58 121.04 2w3s h GLU 201 Ca 0.42 -0.21 0.04 0.00 -0.13 0.00 0.00 59.36 59.49 2w3s h GLU 201 Cb 0.50 -0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.64 2w3s h GLU 201 CO -0.30 0.93 -0.34 0.82 -0.73 0.00 0.00 179.01 179.39 2w3s h ILE 202 N 1.11 0.27 -0.42 2.32 1.08 -0.20 -0.96 117.51 120.72 2w3s h ILE 202 Ca 0.25 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.81 2w3s h ILE 202 Cb 0.23 0.27 -0.09 0.00 -3.07 0.00 0.00 36.82 34.16 2w3s h ILE 202 CO -0.02 0.00 -0.21 -0.61 -0.69 0.00 0.00 178.15 176.62 2w3s h GLN 203 N -0.44 -0.13 -0.32 2.37 4.15 -0.82 0.12 115.11 120.04 2w3s h GLN 203 Ca 0.08 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.58 2w3s h GLN 203 Cb 0.57 0.03 -0.08 0.00 0.21 0.00 0.00 27.48 28.21 2w3s h GLN 203 CO -0.33 -0.08 -0.23 1.25 -1.93 0.00 0.00 178.83 177.51 2w3s h HIS 204 N -0.13 -0.60 -0.12 3.99 2.76 -0.92 0.27 115.15 120.40 2w3s h HIS 204 Ca 0.20 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.35 2w3s h HIS 204 Cb 0.44 0.31 -0.00 0.00 1.55 0.00 0.00 27.41 29.72 2w3s h HIS 204 CO -0.45 -0.31 -0.17 0.87 -1.30 0.00 0.00 177.93 176.57 2w3s h LYS 205 N -0.20 0.33 -0.01 5.26 1.79 -0.39 -1.85 116.57 121.50 2w3s h LYS 205 Ca 0.16 -0.19 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2w3s h LYS 205 Cb 0.45 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.11 2w3s h LYS 205 CO -0.43 0.76 -0.00 0.28 -1.08 0.00 0.00 179.45 178.98 2w3s h VAL 206 N -0.08 0.99 -0.72 0.50 2.07 -0.64 -1.72 116.25 116.65 2w3s h VAL 206 Ca 0.01 -0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.68 2w3s h VAL 206 Cb 0.73 0.99 -0.14 0.00 -1.52 0.00 0.00 31.29 31.35 2w3s h VAL 206 CO 0.04 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 177.47 2w3s h ALA 207 N 1.01 0.50 0.00 1.67 0.00 -0.41 -0.77 119.26 121.26 2w3s h ALA 207 Ca 0.00 0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2w3s h ALA 207 Cb 0.01 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2w3s h ALA 207 CO -0.01 -0.42 -0.24 0.45 0.00 0.00 0.00 179.25 179.04 2w3s h HIS 208 N 0.01 0.00 0.01 0.00 -0.00 -0.97 0.26 115.15 114.45 2w3s h HIS 208 Ca 0.35 0.00 -0.22 0.00 -0.00 0.00 0.00 60.37 60.50 2w3s h HIS 208 Cb 0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.92 2w3s h HIS 208 CO -0.56 0.24 -1.03 0.00 -0.00 0.00 0.00 177.93 176.58 2w3s h ALA 209 N 1.76 0.35 0.00 2.45 0.00 -0.27 -2.92 119.26 120.62 2w3s h ALA 209 Ca -0.00 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 53.98 2w3s h ALA 209 Cb 0.76 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2w3s h ALA 209 CO 0.03 1.25 -0.82 1.28 0.00 0.00 0.00 179.25 180.99 2w3s n LEU 210 N -3.35 0.68 -0.82 0.00 4.77 -0.51 -3.52 117.00 114.25 2w3s n LEU 210 Ca -0.01 0.15 -0.05 0.00 -0.03 0.00 0.00 56.01 56.08 2w3s n LEU 210 Cb 0.95 -0.14 0.01 0.00 -2.33 0.00 0.00 43.42 41.91 2w3s n LEU 210 CO 0.47 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2w3s n GLY 211 N 1.33 0.44 3.67 -0.72 0.00 -0.38 -4.88 105.19 104.65 2w3s n GLY 211 Ca 0.02 -0.60 -0.25 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.77 3.32 0.63 0.99 1.43 -0.06 -5.04 118.68 118.18 2w3s s LEU 212 Ca 0.06 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 2w3s s LEU 212 Cb -0.03 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 2w3s s LEU 212 CO 0.08 0.05 1.03 0.00 0.23 0.00 0.00 176.35 177.74 2w3s s ALA 213 N -1.94 2.98 0.36 4.21 0.00 -1.26 -4.44 121.76 121.66 2w3s s ALA 213 Ca 0.29 0.00 0.04 0.00 0.00 0.00 0.00 51.96 52.30 2w3s s ALA 213 Cb -0.08 -3.11 0.71 0.00 0.00 0.00 0.00 23.12 20.63 2w3s s ALA 213 CO 0.19 -0.78 1.99 0.74 0.00 0.00 0.00 175.76 177.90 2w3s h PHE 214 N -0.27 0.75 0.00 0.00 -1.00 -1.94 -1.64 116.94 112.85 2w3s h PHE 214 Ca -0.44 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.36 2w3s h PHE 214 Cb 1.20 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 40.50 2w3s h PHE 214 CO 0.64 0.44 0.00 -2.39 -1.61 0.00 0.00 178.31 175.40 2w3s n HIS 215 N -4.46 0.00 0.41 -0.55 1.44 -1.26 -2.15 115.22 108.65 2w3s n HIS 215 Ca 0.08 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.87 2w3s n HIS 215 Cb 0.13 0.00 0.12 0.00 0.12 0.00 0.00 29.99 30.35 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 -0.97 2.67 -4.00 4.39 8.00 -0.62 -4.92 116.55 121.10 2w3s n ASP 216 Ca 0.10 -1.78 -0.28 0.00 0.71 0.00 0.00 54.79 53.54 2w3s n ASP 216 Cb 0.05 -0.10 -0.17 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.27 1.39 -0.09 2.53 1.01 -0.92 -1.56 120.40 121.50 2w3s s VAL 217 Ca 0.24 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.72 2w3s s VAL 217 Cb 0.15 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2w3s s VAL 217 CO 0.21 0.42 -0.22 -0.60 0.00 0.00 0.00 175.10 174.92 2w3s s ARG 218 N 1.34 2.72 -0.18 2.72 3.52 -0.74 -4.92 118.95 123.40 2w3s s ARG 218 Ca 0.00 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.82 2w3s s ARG 218 Cb -0.14 -2.10 0.03 0.00 -1.56 0.00 0.00 34.95 31.18 2w3s s ARG 218 CO -0.07 0.18 -0.16 0.08 -0.81 0.00 0.00 175.30 174.53 2w3s s VAL 219 N 0.32 1.84 -0.06 7.11 1.01 -1.26 0.07 120.40 129.43 2w3s s VAL 219 Ca -0.16 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 60.93 2w3s s VAL 219 Cb -0.17 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 2w3s s VAL 219 CO 0.07 0.39 -0.16 -1.61 0.00 0.00 0.00 175.10 173.79 2w3s s GLU 220 N 1.35 2.65 -0.35 2.72 2.02 0.38 -1.02 118.70 126.46 2w3s s GLU 220 Ca 0.03 -0.74 0.02 0.00 0.02 0.00 0.00 54.97 54.30 2w3s s GLU 220 Cb -0.14 -2.38 0.15 0.00 0.10 0.00 0.00 34.13 31.86 2w3s s GLU 220 CO -0.11 0.51 0.34 1.41 0.02 0.00 0.00 175.26 177.43 2w3s s MET 221 N -0.44 0.54 0.01 1.61 -2.45 0.92 -3.52 119.30 115.97 2w3s s MET 221 Ca 0.05 -0.72 -0.21 0.00 -1.25 0.00 0.00 55.69 53.56 2w3s s MET 221 Cb -0.12 -0.77 -0.19 0.00 1.25 0.00 0.00 34.83 35.00 2w3s s MET 221 CO 0.02 -1.15 1.19 -0.09 1.05 0.00 0.00 175.02 176.03 2w3s h ARG 222 N 7.38 0.35 -2.56 4.11 9.65 -1.85 -2.57 114.38 128.90 2w3s h ARG 222 Ca 0.00 -0.28 0.02 0.00 -1.10 0.00 0.00 59.98 58.62 2w3s h ARG 222 Cb 1.05 0.06 -0.15 0.00 -1.39 0.00 0.00 29.97 29.54 2w3s h ARG 222 CO 0.24 0.92 0.32 -0.98 2.80 0.00 0.00 179.97 183.28 2w3s s ARG 223 N -3.65 1.06 0.05 0.20 1.70 -1.26 -4.60 118.95 112.45 2w3s s ARG 223 Ca -0.14 -0.29 0.09 0.00 -0.47 0.00 0.00 55.73 54.92 2w3s s ARG 223 Cb 0.04 0.49 -0.03 0.00 -0.57 0.00 0.00 34.95 34.88 2w3s s ARG 223 CO 0.78 -0.44 -0.24 -1.64 -1.08 0.00 0.00 175.30 172.67 2w3s s MET 224 N -3.08 1.83 -1.51 3.89 -1.94 0.40 -4.76 119.30 114.13 2w3s s MET 224 Ca 0.01 -1.10 -0.11 0.00 -1.71 0.00 0.00 55.69 52.77 2w3s s MET 224 Cb -0.01 -2.03 -0.00 0.00 2.01 0.00 0.00 34.83 34.80 2w3s s MET 224 CO -0.08 0.51 2.56 0.41 -0.01 0.00 0.00 175.02 178.42 2w3s n GLY 225 N 1.61 4.44 0.00 -0.03 0.00 -1.26 -4.39 105.19 105.57 2w3s n GLY 225 Ca -0.17 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.22 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 3.53 -2.64 1.81 -0.02 0.00 -1.15 -2.21 105.19 104.51 2w3s n GLY 226 Ca 0.65 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.17 -0.16 2.52 -0.02 0.00 -1.26 -4.84 105.19 100.26 2w3s n GLY 227 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.13 -0.11 0.00 1.61 3.01 -1.26 -0.47 117.46 117.12 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 0.04 -2.43 0.00 0.00 -0.01 0.00 0.00 39.48 37.08 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 0.18 2.79 0.00 1.37 0.00 -1.26 -0.76 105.19 107.52 2w3s n GLY 229 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.20 -0.85 0.06 -0.02 0.00 0.38 -2.21 105.19 101.35 2w3s n GLY 230 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.12 2.35 -0.14 1.61 5.02 -1.25 -4.15 118.16 120.48 2w3s n LYS 231 Ca 0.14 -1.39 -0.01 0.00 -2.02 0.00 0.00 58.31 55.03 2w3s n LYS 231 Cb 0.12 -1.02 0.23 0.00 -0.02 0.00 0.00 35.03 34.33 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 0.19 0.84 0.00 1.97 4.81 -1.79 -2.44 114.58 118.17 2w3s h GLU 232 Ca 0.00 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2w3s h GLU 232 Cb 0.44 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2w3s h GLU 232 CO 0.00 0.69 0.00 -1.13 -0.73 0.00 0.00 179.01 177.84 2w3s n SER 233 N -4.33 0.00 0.10 1.04 3.41 -1.26 -4.62 113.62 107.96 2w3s n SER 233 Ca 0.05 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.76 2w3s n SER 233 Cb 0.16 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.55 2w3s n SER 233 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2w3s n GLN 234 N 0.00 0.14 0.24 4.33 1.13 -1.26 -2.24 117.38 119.72 2w3s n GLN 234 Ca 0.00 0.42 0.13 0.00 -1.94 0.00 0.00 57.00 55.61 2w3s n GLN 234 Cb 0.00 -1.79 0.44 0.00 0.11 0.00 0.00 30.24 29.00 2w3s n GLN 234 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2w3s h GLY 235 N 1.94 0.00 0.52 1.08 0.00 -1.82 -3.33 103.07 101.45 2w3s h GLY 235 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 2w3s h GLY 235 CO 0.00 0.00 0.53 3.43 0.00 0.00 0.00 176.54 180.50 2w3s h ASN 236 N 0.00 0.77 -0.43 0.19 -0.26 -1.77 -1.87 115.58 112.21 2w3s h ASN 236 Ca -0.00 0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.76 2w3s h ASN 236 Cb 0.76 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.90 2w3s h ASN 236 CO 0.01 0.43 0.18 0.45 -1.06 0.00 0.00 177.43 177.44 2w3s h HIS 237 N 0.87 0.65 -0.11 1.19 3.86 -1.80 -0.24 115.15 119.57 2w3s h HIS 237 Ca 0.43 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.55 2w3s h HIS 237 Cb 0.39 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 2w3s h HIS 237 CO -0.04 0.55 -0.11 -0.07 0.86 0.00 0.00 177.93 179.12 2w3s h LEU 238 N 0.55 0.29 -0.23 2.43 4.07 -1.73 -1.36 115.31 119.34 2w3s h LEU 238 Ca 0.14 -0.49 0.06 0.00 0.08 0.00 0.00 57.88 57.67 2w3s h LEU 238 Cb 0.17 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 41.77 2w3s h LEU 238 CO -0.01 0.72 -0.19 0.00 -1.08 0.00 0.00 178.44 177.88 2w3s h ALA 239 N 0.58 -0.04 -0.56 1.53 0.00 -1.24 0.77 119.26 120.29 2w3s h ALA 239 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2w3s h ALA 239 Cb 0.64 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2w3s h ALA 239 CO 0.03 -0.61 0.36 0.82 0.00 0.00 0.00 179.25 179.84 2w3s h ILE 240 N -0.19 1.16 -0.01 0.00 2.04 -1.00 -1.54 117.51 117.96 2w3s h ILE 240 Ca 0.13 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2w3s h ILE 240 Cb 0.39 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2w3s h ILE 240 CO -0.34 0.15 0.01 0.00 0.00 0.00 0.00 178.15 177.97 2w3s h ALA 241 N 1.19 0.01 -0.36 1.87 0.00 -0.70 -0.55 119.26 120.72 2w3s h ALA 241 Ca 0.20 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.15 2w3s h ALA 241 Cb -0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2w3s h ALA 241 CO -0.04 -0.47 0.10 0.00 0.00 0.00 0.00 179.25 178.83 2w3s h ALA 243 N 1.25 1.34 -0.04 0.00 0.00 -0.97 0.17 119.26 121.01 2w3s h ALA 243 Ca 0.17 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2w3s h ALA 243 Cb 0.17 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.71 2w3s h ALA 243 CO -0.19 0.51 -0.37 0.28 0.00 0.00 0.00 179.25 179.48 2w3s h VAL 244 N 0.86 1.45 -0.97 0.00 2.07 -0.73 -1.71 116.25 117.22 2w3s h VAL 244 Ca 0.21 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.88 2w3s h VAL 244 Cb 0.12 2.49 -0.05 0.00 -1.52 0.00 0.00 31.29 32.34 2w3s h VAL 244 CO -0.02 0.53 0.63 0.00 0.02 0.00 0.00 177.57 178.73 2w3s h ALA 245 N 0.36 1.24 -0.21 1.67 0.00 -1.17 -0.52 119.26 120.63 2w3s h ALA 245 Ca -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2w3s h ALA 245 Cb 1.06 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2w3s h ALA 245 CO 0.07 0.64 0.11 0.00 0.00 0.00 0.00 179.25 180.07 2w3s h ALA 246 N 1.35 0.27 -0.01 0.00 0.00 -0.63 0.11 119.26 120.35 2w3s h ALA 246 Ca 0.35 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.22 2w3s h ALA 246 Cb -0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2w3s h ALA 246 CO -0.07 -0.19 -0.14 -0.09 0.00 0.00 0.00 179.25 178.76 2w3s h ARG 247 N 0.22 -0.21 -0.49 0.00 2.43 -1.00 0.38 114.38 115.70 2w3s h ARG 247 Ca 0.07 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 2w3s h ARG 247 Cb 0.09 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 2w3s h ARG 247 CO -0.01 -0.14 0.25 0.00 -1.51 0.00 0.00 179.97 178.56 2w3s h ALA 248 N 0.74 0.63 0.00 2.80 0.00 -0.89 -3.11 119.26 119.43 2w3s h ALA 248 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2w3s h ALA 248 Cb 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2w3s h ALA 248 CO -0.14 -0.09 -0.95 0.25 0.00 0.00 0.00 179.25 178.32 2w3s n THR 249 N -4.88 0.04 -0.96 0.00 -2.24 0.37 -4.95 114.28 101.67 2w3s n THR 249 Ca 0.04 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2w3s n THR 249 Cb 0.12 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 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 1.45 0.31 3.50 3.38 0.00 0.13 -4.99 105.19 108.98 2w3s n GLY 250 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.85 1.81 0.32 1.61 0.52 -1.20 -4.94 118.95 116.22 2w3s s ARG 251 Ca 0.00 -1.48 -0.29 0.00 -0.52 0.00 0.00 55.73 53.44 2w3s s ARG 251 Cb 0.00 -1.97 -0.11 0.00 0.52 0.00 0.00 34.95 33.39 2w3s s ARG 251 CO 0.00 0.39 1.55 -2.14 0.02 0.00 0.00 175.30 175.12 2w3s s PRO 252 N -2.98 4.13 -0.02 3.54 0.02 -1.26 -4.28 135.00 134.15 2w3s s PRO 252 Ca 0.25 2.56 0.04 0.00 0.02 0.00 0.00 61.00 63.87 2w3s s PRO 252 Cb -0.07 -3.01 -0.01 0.00 0.02 0.00 0.00 34.50 31.43 2w3s s PRO 252 CO 0.14 -0.58 -0.15 0.00 -0.33 0.00 0.00 177.00 176.08 2w3s s LYS 254 N -0.18 1.16 -0.04 0.00 2.20 -0.40 -0.62 119.74 121.85 2w3s s LYS 254 Ca 0.02 -0.65 0.00 0.00 -0.36 0.00 0.00 55.97 54.98 2w3s s LYS 254 Cb -0.07 -1.15 0.03 0.00 -1.51 0.00 0.00 37.83 35.12 2w3s s LYS 254 CO 0.00 0.30 -0.01 1.41 -0.36 0.00 0.00 175.35 176.69 2w3s s MET 255 N -0.68 0.50 -0.03 4.03 -2.45 -0.42 -0.74 119.30 119.50 2w3s s MET 255 Ca 0.05 0.03 0.05 0.00 -1.25 0.00 0.00 55.69 54.58 2w3s s MET 255 Cb -0.07 -0.67 -0.01 0.00 1.25 0.00 0.00 34.83 35.33 2w3s s MET 255 CO 0.00 -0.15 -0.19 -0.98 1.05 0.00 0.00 175.02 174.75 2w3s s ARG 256 N 1.17 1.73 0.07 4.11 1.70 -1.26 -0.47 118.95 125.99 2w3s s ARG 256 Ca -0.08 -0.68 -0.31 0.00 -0.47 0.00 0.00 55.73 54.20 2w3s s ARG 256 Cb -0.14 -1.59 -0.06 0.00 -0.57 0.00 0.00 34.95 32.60 2w3s s ARG 256 CO -0.02 0.35 1.23 0.71 -1.08 0.00 0.00 175.30 176.50 2w3s s TYR 257 N -0.26 3.40 0.70 5.89 4.12 -0.39 -4.98 117.35 125.83 2w3s s TYR 257 Ca 0.03 1.25 -0.16 0.00 0.02 0.00 0.00 57.07 58.20 2w3s s TYR 257 Cb -0.09 -3.46 0.02 0.00 -1.52 0.00 0.00 41.96 36.91 2w3s s TYR 257 CO 0.01 -1.45 1.22 0.34 0.02 0.00 0.00 175.55 175.69 2w3s s ASP 258 N 1.08 4.38 0.23 2.29 -1.08 -1.26 -4.64 116.67 117.67 2w3s s ASP 258 Ca 0.60 2.40 -0.07 0.00 -0.52 0.00 0.00 52.55 54.95 2w3s s ASP 258 Cb -0.30 -2.59 0.38 0.00 -1.46 0.00 0.00 42.92 38.94 2w3s s ASP 258 CO 0.29 -2.14 1.70 -0.09 0.52 0.00 0.00 175.17 175.46 2w3s h ARG 259 N -0.02 0.29 0.02 4.34 9.65 -1.96 0.70 114.38 127.40 2w3s h ARG 259 Ca -0.48 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.38 2w3s h ARG 259 Cb 1.30 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 2w3s h ARG 259 CO 0.51 0.19 -0.01 -0.44 2.80 0.00 0.00 179.97 183.02 2w3s h ASP 260 N 0.30 -0.02 -0.63 -3.80 5.19 -1.93 0.37 116.42 115.89 2w3s h ASP 260 Ca 0.37 -0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.80 2w3s h ASP 260 Cb 0.58 0.01 -0.04 0.00 0.18 0.00 0.00 39.33 40.05 2w3s h ASP 260 CO -0.44 -0.00 0.38 0.44 -3.12 0.00 0.00 179.24 176.50 2w3s h ASP 261 N -0.04 0.62 0.03 6.45 3.32 -1.70 0.05 116.42 125.15 2w3s h ASP 261 Ca -0.00 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.08 2w3s h ASP 261 Cb 0.03 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 2w3s h ASP 261 CO 0.00 0.43 -0.26 -0.78 -1.72 0.00 0.00 179.24 176.91 2w3s h ASP 262 N 0.75 -0.76 1.00 6.45 3.58 0.10 0.28 116.42 127.83 2w3s h ASP 262 Ca 0.26 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.80 2w3s h ASP 262 Cb 0.04 0.30 -0.00 0.00 1.72 0.00 0.00 39.33 41.39 2w3s h ASP 262 CO -0.11 -0.33 -0.04 0.24 -2.88 0.00 0.00 179.24 176.12 2w3s h MET 263 N -0.41 0.00 0.11 0.28 2.86 -0.44 -1.26 114.93 116.06 2w3s h MET 263 Ca 0.05 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.33 2w3s h MET 263 Cb 0.48 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 2w3s h MET 263 CO -0.21 0.04 -2.04 0.28 1.06 0.00 0.00 176.91 176.03 2w3s n VAL 264 N -3.15 1.76 0.08 -2.22 0.31 -0.04 -4.49 118.33 110.57 2w3s n VAL 264 Ca 0.00 -0.65 -0.23 0.00 -0.01 0.00 0.00 64.34 63.46 2w3s n VAL 264 Cb 0.32 -1.70 -0.15 0.00 -0.91 0.00 0.00 33.84 31.40 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 0.07 1.09 -4.48 2.52 2.04 -0.92 -3.44 117.51 114.39 2w3s h ILE 265 Ca -0.44 -2.53 -0.47 0.00 1.00 0.00 0.00 64.86 62.41 2w3s h ILE 265 Cb 2.02 2.86 0.10 0.00 -0.74 0.00 0.00 36.82 41.07 2w3s h ILE 265 CO 0.07 0.80 0.38 0.42 0.00 0.00 0.00 178.15 179.83 2w3s s THR 266 N -2.55 2.44 0.69 -0.27 -4.23 -0.48 -4.77 115.64 106.47 2w3s s THR 266 Ca -0.15 0.14 -0.04 0.00 -1.18 0.00 0.00 61.69 60.46 2w3s s THR 266 Cb 0.04 -3.06 0.08 0.00 1.34 0.00 0.00 72.50 70.90 2w3s s THR 266 CO 0.86 -0.19 0.98 -0.83 -0.54 0.00 0.00 174.62 174.90 2w3s s GLY 267 N -4.35 1.74 0.35 3.99 0.00 -1.25 -4.72 107.32 103.08 2w3s s GLY 267 Ca 0.61 -1.20 0.04 0.00 0.00 0.00 0.00 44.72 44.17 2w3s s GLY 267 CO 0.51 -0.76 0.17 0.54 0.00 0.00 0.00 173.10 173.56 2w3s s LYS 268 N -5.17 1.76 0.56 2.90 1.02 -1.26 -4.78 119.74 114.78 2w3s s LYS 268 Ca 0.62 -2.04 -0.21 0.00 0.02 0.00 0.00 55.97 54.36 2w3s s LYS 268 Cb -0.09 -0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 36.95 2w3s s LYS 268 CO 0.44 -0.50 1.36 0.50 -0.92 0.00 0.00 175.35 176.23 2w3s s ARG 269 N -3.70 3.02 -0.24 1.68 3.52 -0.34 -1.35 118.95 121.55 2w3s s ARG 269 Ca 0.32 2.23 -0.29 0.00 -0.13 0.00 0.00 55.73 57.86 2w3s s ARG 269 Cb 0.04 -2.19 -0.02 0.00 -1.56 0.00 0.00 34.95 31.21 2w3s s ARG 269 CO 0.18 -1.28 1.61 -1.01 -0.81 0.00 0.00 175.30 173.99 2w3s s HIS 270 N -1.31 2.12 0.50 5.12 3.76 -1.26 -3.86 115.29 120.37 2w3s s HIS 270 Ca 0.74 0.57 -0.20 0.00 -0.15 0.00 0.00 55.06 56.01 2w3s s HIS 270 Cb -0.41 -4.00 -0.08 0.00 1.11 0.00 0.00 32.58 29.21 2w3s s HIS 270 CO 0.47 -2.85 1.06 0.16 -0.85 0.00 0.00 174.74 172.73 2w3s s ASP 271 N 4.27 6.16 0.07 1.40 -4.77 -1.26 -4.67 116.67 117.86 2w3s s ASP 271 Ca 0.71 1.99 0.05 0.00 -3.30 0.00 0.00 52.55 52.00 2w3s s ASP 271 Cb -0.24 -2.57 -0.03 0.00 -1.09 0.00 0.00 42.92 39.00 2w3s s ASP 271 CO 0.29 -0.91 -0.14 -0.36 0.70 0.00 0.00 175.17 174.75 2w3s s PHE 272 N -1.93 1.20 -0.16 2.11 0.08 0.52 -2.29 117.98 117.51 2w3s s PHE 272 Ca 0.69 -0.45 -0.02 0.00 0.12 0.00 0.00 56.93 57.27 2w3s s PHE 272 Cb -0.18 -0.68 -0.01 0.00 -0.57 0.00 0.00 43.02 41.57 2w3s s PHE 272 CO 0.22 0.05 -0.09 0.50 -0.10 0.00 0.00 175.22 175.80 2w3s s ARG 273 N -1.65 3.44 -0.14 0.44 3.52 0.67 -0.17 118.95 125.05 2w3s s ARG 273 Ca -0.02 -0.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.95 2w3s s ARG 273 Cb -0.10 -2.79 0.02 0.00 -1.56 0.00 0.00 34.95 30.52 2w3s s ARG 273 CO 0.02 0.10 -0.12 0.42 -0.81 0.00 0.00 175.30 174.91 2w3s s ILE 274 N 0.68 1.42 -0.09 4.11 1.01 -0.94 -0.82 121.20 126.55 2w3s s ILE 274 Ca -0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.05 2w3s s ILE 274 Cb -0.15 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 2w3s s ILE 274 CO 0.02 0.43 -0.01 -0.60 0.00 0.00 0.00 174.94 174.79 2w3s s ARG 275 N 1.55 3.06 0.02 2.79 3.52 -0.37 -1.50 118.95 128.02 2w3s s ARG 275 Ca 0.05 -0.43 -0.02 0.00 -0.13 0.00 0.00 55.73 55.20 2w3s s ARG 275 Cb -0.13 -2.79 -0.02 0.00 -1.56 0.00 0.00 34.95 30.45 2w3s s ARG 275 CO -0.10 0.64 0.01 1.52 -0.81 0.00 0.00 175.30 176.56 2w3s s TYR 276 N -0.71 0.25 -0.06 5.12 -0.85 0.43 -0.88 117.35 120.65 2w3s s TYR 276 Ca 0.11 -0.53 -0.00 0.00 -0.52 0.00 0.00 57.07 56.13 2w3s s TYR 276 Cb -0.12 -0.19 0.03 0.00 0.38 0.00 0.00 41.96 42.06 2w3s s TYR 276 CO 0.02 -0.25 -0.02 1.03 -1.52 0.00 0.00 175.55 174.81 2w3s s ARG 277 N -1.89 0.69 -0.01 -3.49 0.52 -0.12 -2.27 118.95 112.39 2w3s s ARG 277 Ca -0.12 0.02 0.00 0.00 -0.52 0.00 0.00 55.73 55.11 2w3s s ARG 277 Cb -0.06 -0.90 0.01 0.00 0.52 0.00 0.00 34.95 34.51 2w3s s ARG 277 CO -0.02 -0.21 0.00 -1.50 0.02 0.00 0.00 175.30 173.59 2w3s s ILE 278 N 1.50 0.04 0.01 1.52 2.07 -0.40 -0.14 121.20 125.80 2w3s s ILE 278 Ca -0.02 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.31 2w3s s ILE 278 Cb -0.13 -0.07 -0.02 0.00 0.13 0.00 0.00 42.46 42.37 2w3s s ILE 278 CO -0.03 0.04 -0.18 -0.83 -1.91 0.00 0.00 174.94 172.02 2w3s s GLY 279 N 0.27 0.95 0.32 1.50 0.00 -0.81 -0.50 107.32 109.05 2w3s s GLY 279 Ca -0.02 -0.89 0.10 0.00 0.00 0.00 0.00 44.72 43.91 2w3s s GLY 279 CO -0.01 -0.79 -0.04 0.00 0.00 0.00 0.00 173.10 172.26 2w3s s ALA 280 N -0.62 3.09 0.84 3.20 0.00 -0.50 -0.39 121.76 127.38 2w3s s ALA 280 Ca 0.06 -1.91 -0.09 0.00 0.00 0.00 0.00 51.96 50.02 2w3s s ALA 280 Cb -0.08 -0.38 0.15 0.00 0.00 0.00 0.00 23.12 22.81 2w3s s ALA 280 CO 0.00 0.14 1.16 0.16 0.00 0.00 0.00 175.76 177.22 2w3s s ASP 281 N -3.66 3.84 0.00 0.00 1.47 0.67 -1.95 116.67 117.03 2w3s s ASP 281 Ca 0.33 0.11 0.17 0.00 1.18 0.00 0.00 52.55 54.34 2w3s s ASP 281 Cb -0.02 -0.37 0.76 0.00 -0.34 0.00 0.00 42.92 42.95 2w3s s ASP 281 CO 0.18 -2.24 1.55 0.00 0.68 0.00 0.00 175.17 175.34 2w3s n ALA 282 N -3.31 1.81 0.85 2.11 0.00 -1.26 -0.61 120.51 120.09 2w3s n ALA 282 Ca 0.14 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.63 2w3s n ALA 282 Cb 0.60 -1.28 0.14 0.00 0.00 0.00 0.00 19.45 18.91 2w3s n ALA 282 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2w3s n SER 283 N -1.47 0.62 0.00 0.00 3.41 -1.26 -4.97 113.62 109.94 2w3s n SER 283 Ca 0.05 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 2w3s n SER 283 Cb 0.19 0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 2w3s n SER 283 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w3s n GLY 284 N 1.45 0.69 3.79 5.00 0.00 0.22 -5.09 105.19 111.25 2w3s n GLY 284 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.65 4.21 0.10 1.61 -0.14 -1.26 -4.72 119.74 118.90 2w3s s LYS 285 Ca 0.00 1.35 -0.30 0.00 -1.36 0.00 0.00 55.97 55.66 2w3s s LYS 285 Cb 0.00 -2.43 -0.06 0.00 -1.68 0.00 0.00 37.83 33.66 2w3s s LYS 285 CO 0.00 -0.07 1.17 -0.51 -0.76 0.00 0.00 175.35 175.17 2w3s s LEU 286 N -2.79 4.41 -0.20 3.17 1.43 -1.26 -0.24 118.68 123.20 2w3s s LEU 286 Ca 0.59 2.04 0.08 0.00 -1.03 0.00 0.00 54.13 55.81 2w3s s LEU 286 Cb -0.17 -3.59 -0.22 0.00 0.03 0.00 0.00 46.19 42.24 2w3s s LEU 286 CO 0.22 -0.39 0.06 0.18 0.23 0.00 0.00 176.35 176.64 2w3s n LEU 287 N 3.39 1.58 -3.65 1.79 4.77 0.48 -4.43 117.00 120.93 2w3s n LEU 287 Ca 0.07 0.02 -0.02 0.00 -0.03 0.00 0.00 56.01 56.05 2w3s n LEU 287 Cb 0.46 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2w3s n LEU 287 CO 0.55 0.70 1.18 -0.83 -1.33 0.00 0.00 177.39 177.66 2w3s s GLY 288 N -5.86 -0.07 -0.05 -0.72 0.00 -1.20 -3.29 107.32 96.13 2w3s s GLY 288 Ca -0.21 2.31 -0.02 0.00 0.00 0.00 0.00 44.72 46.80 2w3s s GLY 288 CO 0.73 0.83 0.09 0.00 0.00 0.00 0.00 173.10 174.76 2w3s s ALA 289 N -1.63 -0.04 -0.15 3.20 0.00 0.16 -1.92 121.76 121.39 2w3s s ALA 289 Ca 0.11 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.53 2w3s s ALA 289 Cb -0.01 -0.49 0.01 0.00 0.00 0.00 0.00 23.12 22.63 2w3s s ALA 289 CO -0.05 -0.29 -0.21 0.34 0.00 0.00 0.00 175.76 175.55 2w3s s ASP 290 N 1.56 3.11 -0.01 0.00 2.15 0.81 -0.48 116.67 123.81 2w3s s ASP 290 Ca -0.04 -0.62 0.06 0.00 0.43 0.00 0.00 52.55 52.39 2w3s s ASP 290 Cb -0.12 -1.45 -0.02 0.00 -0.30 0.00 0.00 42.92 41.03 2w3s s ASP 290 CO -0.04 0.06 -0.21 -0.36 -0.17 0.00 0.00 175.17 174.44 2w3s s PHE 291 N 0.96 1.87 -0.15 -5.34 0.40 0.12 -0.94 117.98 114.89 2w3s s PHE 291 Ca -0.03 -0.35 0.01 0.00 -0.60 0.00 0.00 56.93 55.95 2w3s s PHE 291 Cb -0.15 -1.20 0.02 0.00 0.51 0.00 0.00 43.02 42.21 2w3s s PHE 291 CO -0.05 -0.02 -0.17 0.08 0.70 0.00 0.00 175.22 175.75 2w3s s VAL 292 N -0.51 1.77 -0.24 -0.44 1.01 -0.06 -1.08 120.40 120.85 2w3s s VAL 292 Ca 0.08 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.21 2w3s s VAL 292 Cb -0.08 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2w3s s VAL 292 CO -0.01 0.49 0.09 -1.00 0.00 0.00 0.00 175.10 174.68 2w3s s HIS 293 N 1.27 3.15 -0.16 5.22 3.76 0.16 -1.24 115.29 127.46 2w3s s HIS 293 Ca 0.02 -0.18 -0.02 0.00 -0.15 0.00 0.00 55.06 54.72 2w3s s HIS 293 Cb -0.14 -2.22 -0.02 0.00 1.11 0.00 0.00 32.58 31.32 2w3s s HIS 293 CO -0.09 -0.18 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.02 2w3s s LEU 294 N 1.31 2.87 -0.06 0.89 1.43 -0.00 -0.03 118.68 125.08 2w3s s LEU 294 Ca 0.05 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2w3s s LEU 294 Cb -0.15 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.42 2w3s s LEU 294 CO 0.04 0.12 -0.08 0.00 0.23 0.00 0.00 176.35 176.66 2w3s s ALA 295 N 0.64 1.00 -0.32 4.21 0.00 -0.66 -0.24 121.76 126.40 2w3s s ALA 295 Ca -0.05 -0.27 -0.23 0.00 0.00 0.00 0.00 51.96 51.40 2w3s s ALA 295 Cb -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.41 2w3s s ALA 295 CO 0.03 -0.04 0.79 0.50 0.00 0.00 0.00 175.76 177.04 2w3s s ARG 296 N 0.98 3.92 0.00 0.00 3.52 -0.97 -1.60 118.95 124.79 2w3s s ARG 296 Ca -0.10 0.53 0.15 0.00 -0.13 0.00 0.00 55.73 56.18 2w3s s ARG 296 Cb -0.15 -3.75 -0.12 0.00 -1.56 0.00 0.00 34.95 29.37 2w3s s ARG 296 CO 0.00 -0.72 0.67 0.00 -0.81 0.00 0.00 175.30 174.44 2w3s n GLY 298 N 1.29 -1.37 0.00 0.00 0.00 -1.26 -1.96 105.19 101.90 2w3s n GLY 298 Ca 0.04 -1.22 0.11 0.00 0.00 0.00 0.00 46.02 44.94 2w3s n GLY 298 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2w3s n TRP 299 N -0.60 0.03 -3.77 1.61 4.27 0.56 -2.74 117.44 116.80 2w3s n TRP 299 Ca 0.00 0.01 -0.10 0.00 -3.89 0.00 0.00 57.50 53.52 2w3s n TRP 299 Cb 0.00 -0.52 -0.07 0.00 -1.36 0.00 0.00 31.31 29.37 2w3s n TRP 299 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 2w3s s SER 300 N -3.05 -0.05 0.16 -0.67 1.04 -1.26 -4.92 113.70 104.95 2w3s s SER 300 Ca 0.11 -0.42 -0.16 0.00 0.48 0.00 0.00 55.95 55.96 2w3s s SER 300 Cb 0.15 0.38 0.09 0.00 0.10 0.00 0.00 66.02 66.73 2w3s s SER 300 CO 0.42 -0.72 1.71 0.00 0.98 0.00 0.00 173.24 175.63 2w3s h ALA 301 N 2.82 0.35 -0.12 5.32 0.00 -1.87 -3.43 119.26 122.33 2w3s h ALA 301 Ca -0.33 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2w3s h ALA 301 Cb 1.21 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2w3s h ALA 301 CO 0.50 -0.38 0.00 -3.47 0.00 0.00 0.00 179.25 175.91 2w3s n ASP 302 N -5.16 0.00 -0.75 0.00 -0.08 -1.26 -1.38 116.55 107.93 2w3s n ASP 302 Ca 0.02 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.38 2w3s n ASP 302 Cb 0.19 0.00 0.22 0.00 2.34 0.00 0.00 41.12 43.87 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 3.52 -0.34 -2.67 4.77 -1.26 -4.10 117.00 116.93 2w3s n LEU 303 Ca 0.00 -2.82 -0.02 0.00 -0.03 0.00 0.00 56.01 53.15 2w3s n LEU 303 Cb 0.00 -0.46 0.11 0.00 -2.33 0.00 0.00 43.42 40.74 2w3s n LEU 303 CO 0.00 0.68 1.25 0.28 -1.33 0.00 0.00 177.39 178.27 2w3s h SER 304 N 1.62 1.01 0.30 -1.43 0.02 -1.46 -1.54 113.55 112.07 2w3s h SER 304 Ca 0.00 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2w3s h SER 304 Cb 1.25 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 2w3s h SER 304 CO 0.16 0.70 -0.25 0.25 -1.14 0.00 0.00 176.83 176.55 2w3s h LEU 305 N 1.18 -0.66 -0.57 5.07 6.46 -1.85 -1.00 115.31 123.93 2w3s h LEU 305 Ca 0.36 0.05 -0.12 0.00 -0.12 0.00 0.00 57.88 58.05 2w3s h LEU 305 Cb -0.04 0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.09 2w3s h LEU 305 CO -0.11 -0.38 -0.13 1.55 -0.62 0.00 0.00 178.44 178.76 2w3s h PRO 306 N -0.56 1.00 -0.35 5.25 0.13 -1.89 -1.24 132.00 134.33 2w3s h PRO 306 Ca -0.02 -0.38 0.08 0.00 -0.87 0.00 0.00 66.00 64.81 2w3s h PRO 306 Cb 0.50 -0.06 -0.08 0.00 0.13 0.00 0.00 31.00 31.50 2w3s h PRO 306 CO -0.02 1.06 -0.15 0.28 -0.23 0.00 0.00 178.00 178.94 2w3s h VAL 307 N 0.89 0.52 -0.74 1.56 2.07 -1.15 -1.33 116.25 118.07 2w3s h VAL 307 Ca 0.13 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.62 2w3s h VAL 307 Cb 0.69 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2w3s h VAL 307 CO 0.05 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.98 2w3s h ASP 309 N 1.04 0.74 0.32 0.00 3.32 -0.64 -2.43 116.42 118.76 2w3s h ASP 309 Ca 0.25 0.07 -0.19 0.00 0.02 0.00 0.00 57.03 57.18 2w3s h ASP 309 Cb 0.14 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2w3s h ASP 309 CO -0.03 0.36 -0.76 -0.09 -1.72 0.00 0.00 179.24 177.00 2w3s h ARG 310 N 0.81 0.36 -0.20 3.56 2.43 0.07 0.18 114.38 121.60 2w3s h ARG 310 Ca 0.48 -0.31 0.04 0.00 -0.81 0.00 0.00 59.98 59.38 2w3s h ARG 310 Cb 0.58 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 2w3s h ARG 310 CO -0.31 0.96 -0.07 0.00 -1.51 0.00 0.00 179.97 179.04 2w3s h ALA 311 N 0.94 0.10 -0.17 2.80 0.00 -1.07 -0.04 119.26 121.82 2w3s h ALA 311 Ca -0.04 0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2w3s h ALA 311 Cb 1.34 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 2w3s h ALA 311 CO 0.13 -0.50 -0.05 0.52 0.00 0.00 0.00 179.25 179.35 2w3s h MET 312 N -0.04 -0.01 -0.78 0.00 2.86 -1.04 -1.36 114.93 114.57 2w3s h MET 312 Ca 0.10 0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.92 2w3s h MET 312 Cb 0.19 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.80 2w3s h MET 312 CO -0.22 -0.01 0.53 -0.07 1.06 0.00 0.00 176.91 178.20 2w3s h LEU 313 N -0.01 0.29 -2.37 1.22 4.07 -0.29 -2.15 115.31 116.07 2w3s h LEU 313 Ca 0.08 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2w3s h LEU 313 Cb 0.14 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2w3s h LEU 313 CO -0.18 0.13 0.00 1.41 -1.08 0.00 0.00 178.44 178.72 2w3s n HIS 314 N -4.45 0.51 0.29 1.13 8.25 -0.06 -4.50 115.22 116.39 2w3s n HIS 314 Ca 0.16 -0.28 0.03 0.00 -0.26 0.00 0.00 57.72 57.36 2w3s n HIS 314 Cb 0.64 -0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.90 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 1.38 1.54 0.49 -1.41 0.00 -0.61 -0.89 120.51 121.01 2w3s n ALA 315 Ca 0.18 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.72 2w3s n ALA 315 Cb 0.58 -1.09 0.30 0.00 0.00 0.00 0.00 19.45 19.23 2w3s n ALA 315 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2w3s h ASP 316 N 0.00 0.00 0.00 0.00 2.03 -1.80 -3.41 116.42 113.23 2w3s h ASP 316 Ca 0.00 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.27 2w3s h ASP 316 Cb 0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 2w3s h ASP 316 CO 0.00 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.83 2w3s n GLY 317 N 1.25 3.33 1.39 7.15 0.00 -0.07 -1.67 105.19 116.58 2w3s n GLY 317 Ca 0.05 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.99 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 3.52 4.07 -4.29 1.61 7.64 -1.26 -4.63 113.62 120.28 2w3s n SER 318 Ca 0.00 -2.31 -0.32 0.00 1.01 0.00 0.00 58.87 57.26 2w3s n SER 318 Cb 0.00 -0.52 -0.16 0.00 -1.01 0.00 0.00 64.21 62.52 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 -1.67 2.50 -0.16 1.43 1.51 -0.67 -2.98 117.35 117.31 2w3s s TYR 319 Ca 0.45 -0.70 -0.29 0.00 -1.01 0.00 0.00 57.07 55.51 2w3s s TYR 319 Cb 0.28 -1.63 -0.02 0.00 -0.11 0.00 0.00 41.96 40.47 2w3s s TYR 319 CO 0.23 -0.20 1.39 0.12 -1.11 0.00 0.00 175.55 175.98 2w3s s PHE 320 N -0.12 2.55 -0.21 2.71 5.36 -0.50 -4.83 117.98 122.94 2w3s s PHE 320 Ca -0.04 0.75 0.01 0.00 -0.96 0.00 0.00 56.93 56.69 2w3s s PHE 320 Cb -0.14 -3.69 0.05 0.00 -0.34 0.00 0.00 43.02 38.90 2w3s s PHE 320 CO 0.04 -2.34 -0.09 0.08 -1.46 0.00 0.00 175.22 171.45 2w3s s VAL 321 N 3.88 1.60 -1.09 3.12 1.01 -1.26 -4.69 120.40 122.97 2w3s s VAL 321 Ca 0.61 -1.07 0.24 0.00 0.00 0.00 0.00 61.98 61.76 2w3s s VAL 321 Cb -0.24 -1.73 0.25 0.00 0.00 0.00 0.00 36.38 34.65 2w3s s VAL 321 CO 0.20 0.09 1.77 -2.65 0.00 0.00 0.00 175.10 174.51 2w3s n PRO 322 N 4.68 0.08 -3.69 2.72 -0.02 -1.26 -4.39 135.00 133.12 2w3s n PRO 322 Ca -0.14 0.09 -0.17 0.00 -2.02 0.00 0.00 63.50 61.26 2w3s n PRO 322 Cb 0.46 -1.50 -0.16 0.00 -0.02 0.00 0.00 33.50 32.28 2w3s n PRO 322 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s s ALA 323 N -2.91 -0.09 -0.10 3.55 0.00 -1.21 -4.54 121.76 116.47 2w3s s ALA 323 Ca 0.14 0.50 -0.10 0.00 0.00 0.00 0.00 51.96 52.50 2w3s s ALA 323 Cb 0.16 -0.69 0.03 0.00 0.00 0.00 0.00 23.12 22.62 2w3s s ALA 323 CO 0.42 -0.45 0.27 -1.17 0.00 0.00 0.00 175.76 174.82 2w3s s LEU 324 N 2.01 0.96 -0.05 0.00 0.20 -0.72 0.41 118.68 121.48 2w3s s LEU 324 Ca 0.01 0.54 -0.04 0.00 0.69 0.00 0.00 54.13 55.33 2w3s s LEU 324 Cb -0.12 0.94 0.02 0.00 -0.43 0.00 0.00 46.19 46.60 2w3s s LEU 324 CO -0.05 -0.10 0.13 -0.60 -0.29 0.00 0.00 176.35 175.44 2w3s s ARG 325 N 0.13 0.13 -0.04 1.98 3.52 0.37 -0.51 118.95 124.52 2w3s s ARG 325 Ca -0.00 0.24 0.06 0.00 -0.13 0.00 0.00 55.73 55.90 2w3s s ARG 325 Cb -0.02 -0.01 -0.02 0.00 -1.56 0.00 0.00 34.95 33.35 2w3s s ARG 325 CO 0.00 -0.06 -0.24 0.42 -0.81 0.00 0.00 175.30 174.61 2w3s s ILE 326 N 0.42 2.19 -0.16 4.11 1.09 -0.44 0.15 121.20 128.56 2w3s s ILE 326 Ca -0.03 -1.04 0.01 0.00 -1.10 0.00 0.00 60.65 58.49 2w3s s ILE 326 Cb -0.04 -1.79 0.02 0.00 -1.06 0.00 0.00 42.46 39.59 2w3s s ILE 326 CO -0.02 0.57 -0.15 -0.70 -0.10 0.00 0.00 174.94 174.54 2w3s s GLU 327 N -0.37 2.47 -0.28 2.79 2.12 -0.24 -1.24 118.70 123.94 2w3s s GLU 327 Ca 0.03 -0.65 0.03 0.00 0.36 0.00 0.00 54.97 54.74 2w3s s GLU 327 Cb -0.12 -2.24 0.07 0.00 0.26 0.00 0.00 34.13 32.09 2w3s s GLU 327 CO 0.02 -0.24 -0.07 0.45 -0.54 0.00 0.00 175.26 174.88 2w3s s SER 328 N 1.43 4.50 -0.27 -1.70 0.15 0.81 -0.66 113.70 117.96 2w3s s SER 328 Ca 0.05 -1.58 -0.15 0.00 0.70 0.00 0.00 55.95 54.96 2w3s s SER 328 Cb -0.13 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.59 2w3s s SER 328 CO -0.11 -0.24 0.39 -1.00 1.20 0.00 0.00 173.24 173.47 2w3s s HIS 329 N 1.07 3.25 -1.04 3.44 3.76 0.96 -1.73 115.29 125.00 2w3s s HIS 329 Ca -0.04 0.43 -0.09 0.00 -0.15 0.00 0.00 55.06 55.22 2w3s s HIS 329 Cb -0.20 -2.59 0.26 0.00 1.11 0.00 0.00 32.58 31.17 2w3s s HIS 329 CO -0.06 -0.23 1.02 -0.98 -0.85 0.00 0.00 174.74 173.63 2w3s s ARG 330 N 2.09 3.99 0.23 1.40 3.03 -1.26 -1.65 118.95 126.78 2w3s s ARG 330 Ca 0.16 -3.12 -0.30 0.00 2.03 0.00 0.00 55.73 54.50 2w3s s ARG 330 Cb -0.16 -4.45 -0.09 0.00 -1.03 0.00 0.00 34.95 29.22 2w3s s ARG 330 CO 0.10 -1.25 1.19 -0.51 -1.13 0.00 0.00 175.30 173.70 2w3s s LEU 331 N -1.08 4.48 -0.05 -1.89 1.43 -0.63 -1.02 118.68 119.92 2w3s s LEU 331 Ca 0.28 2.32 -0.18 0.00 -1.03 0.00 0.00 54.13 55.52 2w3s s LEU 331 Cb -0.10 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.45 2w3s s LEU 331 CO -0.09 -0.34 0.50 -0.60 0.23 0.00 0.00 176.35 176.06 2w3s s ARG 332 N -0.79 4.24 0.07 1.70 3.52 -0.61 -1.29 118.95 125.78 2w3s s ARG 332 Ca 0.50 0.54 0.01 0.00 -0.13 0.00 0.00 55.73 56.66 2w3s s ARG 332 Cb -0.34 -3.35 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 2w3s s ARG 332 CO 0.40 0.36 -0.06 0.95 -0.81 0.00 0.00 175.30 176.13 2w3s s THR 333 N -0.06 0.56 -1.42 4.11 -4.23 -1.11 -4.63 115.64 108.86 2w3s s THR 333 Ca 0.27 -1.57 -0.13 0.00 -1.18 0.00 0.00 61.69 59.09 2w3s s THR 333 Cb -0.17 -1.21 0.07 0.00 1.34 0.00 0.00 72.50 72.53 2w3s s THR 333 CO 0.13 -0.70 2.18 0.59 -0.54 0.00 0.00 174.62 176.29 2w3s n ASN 334 N 0.58 4.41 -3.94 3.99 4.13 -0.35 -0.33 115.26 123.76 2w3s n ASN 334 Ca -0.17 -2.90 -0.09 0.00 1.68 0.00 0.00 54.58 53.10 2w3s n ASN 334 Cb 0.58 -1.61 -0.05 0.00 -1.54 0.00 0.00 39.78 37.16 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 2.44 0.02 -0.15 3.41 -4.23 -1.26 -4.63 115.64 111.24 2w3s s THR 335 Ca 0.46 -1.29 -0.42 0.00 -1.18 0.00 0.00 61.69 59.27 2w3s s THR 335 Cb 0.13 -2.01 -0.20 0.00 1.34 0.00 0.00 72.50 71.76 2w3s s THR 335 CO -0.07 -0.09 1.24 0.00 -0.54 0.00 0.00 174.62 175.17 2w3s n GLN 336 N -0.34 0.06 -1.86 3.99 3.00 -1.26 -1.17 117.38 119.80 2w3s n GLN 336 Ca -0.04 0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 2w3s n GLN 336 Cb 0.62 -1.53 -0.03 0.00 0.00 0.00 0.00 30.24 29.31 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 0.95 5.38 0.72 1.08 0.15 -1.26 -4.13 113.70 116.59 2w3s s SER 337 Ca 0.95 1.11 -0.16 0.00 0.70 0.00 0.00 55.95 58.56 2w3s s SER 337 Cb -1.32 -2.52 0.01 0.00 -1.71 0.00 0.00 66.02 60.48 2w3s s SER 337 CO 0.64 -2.14 1.06 0.59 1.20 0.00 0.00 173.24 174.59 2w3s n ASN 338 N 12.22 0.84 -0.76 5.45 3.02 -0.83 -3.95 115.26 131.25 2w3s n ASN 338 Ca 0.26 0.69 0.00 0.00 -0.03 0.00 0.00 54.58 55.50 2w3s n ASN 338 Cb 0.49 -1.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.22 2w3s n ASN 338 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 2w3s n THR 339 N -2.51 0.00 -1.85 3.41 5.66 -0.46 -4.28 114.28 114.25 2w3s n THR 339 Ca 0.14 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.73 2w3s n THR 339 Cb 0.49 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.26 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 -1.89 3.62 -0.17 1.79 0.00 -1.26 -4.57 121.76 119.27 2w3s s ALA 340 Ca 0.00 1.52 -0.08 0.00 0.00 0.00 0.00 51.96 53.40 2w3s s ALA 340 Cb 0.00 -3.60 0.07 0.00 0.00 0.00 0.00 23.12 19.59 2w3s s ALA 340 CO 0.00 -0.97 0.39 0.12 0.00 0.00 0.00 175.76 175.31 2w3s s PHE 341 N -0.73 -0.63 0.00 0.00 5.99 -1.26 -3.65 117.98 117.70 2w3s s PHE 341 Ca 0.56 1.31 0.00 0.00 0.00 0.00 0.00 56.93 58.79 2w3s s PHE 341 Cb -0.46 0.25 0.00 0.00 0.00 0.00 0.00 43.02 42.81 2w3s s PHE 341 CO 0.56 -0.38 0.00 -2.13 -0.00 0.00 0.00 175.22 173.28 2w3s n ARG 342 N 4.63 0.00 0.00 10.12 0.63 0.06 0.97 116.66 133.07 2w3s n ARG 342 Ca -0.18 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.75 2w3s n ARG 342 Cb 0.53 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.44 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 0.00 2.48 3.64 5.14 0.00 -1.26 -4.91 105.19 110.27 2w3s n GLY 343 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 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 0.00 -1.96 0.00 1.61 7.35 0.27 -1.21 117.46 123.52 2w3s n PHE 344 Ca 0.00 0.50 0.00 0.00 -0.76 0.00 0.00 57.45 57.19 2w3s n PHE 344 Cb 0.00 -3.52 0.00 0.00 0.35 0.00 0.00 39.48 36.31 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 -1.64 2.75 0.25 7.13 0.00 -1.26 -4.48 105.19 107.95 2w3s n GLY 345 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.93 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 0.97 0.94 -0.02 0.00 -1.35 -2.06 103.07 101.56 2w3s h GLY 346 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2w3s h GLY 346 CO 0.00 0.04 0.16 -2.55 0.00 0.00 0.00 176.54 174.18 2w3s h PRO 347 N 0.53 0.58 -0.11 4.80 0.11 -1.90 -1.35 132.00 134.67 2w3s h PRO 347 Ca 0.33 -0.11 0.04 0.00 0.11 0.00 0.00 66.00 66.37 2w3s h PRO 347 Cb 0.36 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.33 2w3s h PRO 347 CO -0.27 0.55 -0.12 1.96 -0.21 0.00 0.00 178.00 179.91 2w3s h GLN 348 N 0.48 -0.15 -0.86 1.05 7.50 -1.88 0.39 115.11 121.64 2w3s h GLN 348 Ca 0.13 0.01 0.02 0.00 0.50 0.00 0.00 58.65 59.31 2w3s h GLN 348 Cb 0.19 0.03 -0.05 0.00 0.05 0.00 0.00 27.48 27.71 2w3s h GLN 348 CO -0.01 -0.10 0.57 0.78 -1.50 0.00 0.00 178.83 178.57 2w3s h GLY 349 N -0.16 1.22 1.85 3.46 0.00 -1.25 -1.14 103.07 107.05 2w3s h GLY 349 Ca 0.08 -0.44 -0.20 0.00 0.00 0.00 0.00 47.33 46.77 2w3s h GLY 349 CO -0.20 0.41 -0.90 0.00 0.00 0.00 0.00 176.54 175.85 2w3s h ALA 350 N 1.48 0.51 -0.42 3.60 0.00 -0.92 -3.19 119.26 120.31 2w3s h ALA 350 Ca 0.33 -0.76 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 2w3s h ALA 350 Cb -0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2w3s h ALA 350 CO -0.08 0.98 -0.14 1.25 0.00 0.00 0.00 179.25 181.26 2w3s h LEU 351 N 0.07 0.78 -0.37 0.00 5.85 0.40 -1.97 115.31 120.07 2w3s h LEU 351 Ca -0.04 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.51 2w3s h LEU 351 Cb 1.55 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 2w3s h LEU 351 CO 0.13 0.93 -0.07 1.23 -0.34 0.00 0.00 178.44 180.32 2w3s h GLY 352 N 0.97 0.29 1.31 3.75 0.00 -1.25 -0.99 103.07 107.15 2w3s h GLY 352 Ca 0.11 0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.47 2w3s h GLY 352 CO 0.04 -0.13 0.02 1.98 0.00 0.00 0.00 176.54 178.45 2w3s h MET 353 N 0.02 0.84 -0.21 4.80 1.85 -1.47 -2.78 114.93 117.99 2w3s h MET 353 Ca 0.18 -0.23 -0.17 0.00 -0.61 0.00 0.00 59.70 58.87 2w3s h MET 353 Cb 0.27 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 32.20 2w3s h MET 353 CO -0.36 0.83 -0.54 0.93 -0.40 0.00 0.00 176.91 177.38 2w3s h GLU 354 N 0.79 0.73 0.40 0.39 4.39 -0.90 0.22 114.58 120.60 2w3s h GLU 354 Ca 0.15 -0.51 -0.01 0.00 0.34 0.00 0.00 59.36 59.33 2w3s h GLU 354 Cb 0.45 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 2w3s h GLU 354 CO 0.02 1.13 -0.36 0.00 -1.16 0.00 0.00 179.01 178.64 2w3s h ARG 355 N 0.44 -0.72 -1.00 2.33 2.47 -1.22 -0.93 114.38 115.76 2w3s h ARG 355 Ca -0.01 0.05 0.16 0.00 -1.26 0.00 0.00 59.98 58.92 2w3s h ARG 355 Cb 1.16 0.16 -0.17 0.00 -1.65 0.00 0.00 29.97 29.47 2w3s h ARG 355 CO 0.12 -0.48 -0.36 0.00 0.56 0.00 0.00 179.97 179.81 2w3s n ALA 356 N -2.63 -0.04 0.11 0.04 0.00 -1.05 -0.01 120.51 116.93 2w3s n ALA 356 Ca -0.09 1.02 -0.02 0.00 0.00 0.00 0.00 53.44 54.34 2w3s n ALA 356 Cb 0.34 -0.49 0.20 0.00 0.00 0.00 0.00 19.45 19.49 2w3s n ALA 356 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2w3s h ILE 357 N 0.00 1.35 -0.02 0.00 2.10 -0.91 -0.13 117.51 119.89 2w3s h ILE 357 Ca 0.38 -1.73 -0.00 0.00 1.08 0.00 0.00 64.86 64.58 2w3s h ILE 357 Cb 0.63 1.86 -0.00 0.00 -1.09 0.00 0.00 36.82 38.21 2w3s h ILE 357 CO -1.00 0.51 0.00 -0.08 -1.08 0.00 0.00 178.15 176.51 2w3s h GLU 358 N 0.14 0.04 -0.57 2.19 4.57 0.49 -0.38 114.58 121.06 2w3s h GLU 358 Ca 0.00 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.23 2w3s h GLU 358 Cb 0.93 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.47 2w3s h GLU 358 CO 0.07 0.28 0.28 1.25 -1.18 0.00 0.00 179.01 179.71 2w3s h HIS 359 N -0.21 0.51 -0.12 0.92 2.76 -0.29 0.11 115.15 118.83 2w3s h HIS 359 Ca 0.01 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2w3s h HIS 359 Cb 0.26 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 2w3s h HIS 359 CO 0.01 0.23 0.07 1.25 -1.30 0.00 0.00 177.93 178.19 2w3s h LEU 360 N 0.53 0.12 0.06 0.26 5.85 -0.96 0.49 115.31 121.66 2w3s h LEU 360 Ca 0.26 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.00 2w3s h LEU 360 Cb 0.20 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 2w3s h LEU 360 CO -0.20 0.09 -0.17 0.00 -0.34 0.00 0.00 178.44 177.82 2w3s h ALA 361 N 1.05 -0.26 -0.64 1.25 0.00 -0.36 -0.56 119.26 119.74 2w3s h ALA 361 Ca 0.05 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.06 2w3s h ALA 361 Cb -0.01 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 2w3s h ALA 361 CO -0.02 -0.68 0.17 0.00 0.00 0.00 0.00 179.25 178.72 2w3s h ARG 362 N -0.31 0.29 0.06 0.00 2.47 -0.80 -1.14 114.38 114.95 2w3s h ARG 362 Ca 0.04 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2w3s h ARG 362 Cb 0.35 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 2w3s h ARG 362 CO -0.12 0.19 -0.31 0.78 0.56 0.00 0.00 179.97 181.07 2w3s h GLY 363 N 0.30 -1.20 -1.75 0.04 0.00 0.08 -2.72 103.07 97.83 2w3s h GLY 363 Ca 0.34 0.61 -0.02 0.00 0.00 0.00 0.00 47.33 48.25 2w3s h GLY 363 CO -0.41 -0.35 0.03 1.15 0.00 0.00 0.00 176.54 176.96 2w3s n MET 364 N -4.21 1.20 -1.85 4.80 0.00 -0.31 -4.80 117.12 111.95 2w3s n MET 364 Ca -0.05 -0.26 -0.14 0.00 0.00 0.00 0.00 57.70 57.25 2w3s n MET 364 Cb 0.24 -1.30 -0.04 0.00 0.00 0.00 0.00 33.22 32.12 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 0.23 0.52 3.86 3.17 0.00 -1.02 -4.94 105.19 107.00 2w3s n GLY 365 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.99 3.10 -0.25 1.61 6.06 -0.46 -5.02 118.95 120.00 2w3s s ARG 366 Ca 0.00 -0.80 -0.27 0.00 -2.50 0.00 0.00 55.73 52.16 2w3s s ARG 366 Cb 0.00 -2.75 0.00 0.00 0.06 0.00 0.00 34.95 32.26 2w3s s ARG 366 CO 0.00 0.49 0.95 0.34 -2.50 0.00 0.00 175.30 174.58 2w3s s ASP 367 N -3.26 6.96 0.25 -2.12 2.15 -1.26 -4.14 116.67 115.25 2w3s s ASP 367 Ca 0.32 1.19 -0.06 0.00 0.43 0.00 0.00 52.55 54.44 2w3s s ASP 367 Cb -0.10 -2.50 0.46 0.00 -0.30 0.00 0.00 42.92 40.49 2w3s s ASP 367 CO 0.25 -0.63 1.66 -0.65 -0.17 0.00 0.00 175.17 175.63 2w3s h PRO 368 N 7.62 0.17 -0.80 4.34 0.11 -1.93 0.52 132.00 142.02 2w3s h PRO 368 Ca -0.21 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.98 2w3s h PRO 368 Cb 1.07 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.09 2w3s h PRO 368 CO 0.94 0.11 0.52 0.00 -0.21 0.00 0.00 178.00 179.37 2w3s h ALA 369 N 1.67 1.73 0.23 -0.75 0.00 -1.92 0.65 119.26 120.87 2w3s h ALA 369 Ca 0.42 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 2w3s h ALA 369 Cb 0.75 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2w3s h ALA 369 CO -0.59 0.11 -0.11 1.49 0.00 0.00 0.00 179.25 180.15 2w3s h GLU 370 N 0.76 -0.30 -0.83 0.00 4.22 -1.32 -1.08 114.58 116.04 2w3s h GLU 370 Ca 0.37 0.02 0.20 0.00 0.08 0.00 0.00 59.36 60.03 2w3s h GLU 370 Cb 0.41 0.07 -0.14 0.00 0.50 0.00 0.00 28.75 29.59 2w3s h GLU 370 CO -0.14 -0.05 0.05 1.25 -2.18 0.00 0.00 179.01 177.94 2w3s h LEU 371 N -1.02 -0.32 0.01 1.64 5.85 -0.98 0.14 115.31 120.63 2w3s h LEU 371 Ca -0.03 0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2w3s h LEU 371 Cb 0.39 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 2w3s h LEU 371 CO 0.05 -0.21 -0.07 0.03 -0.34 0.00 0.00 178.44 177.91 2w3s h ARG 372 N 0.11 -0.12 -0.91 1.25 3.08 -0.91 -2.45 114.38 114.42 2w3s h ARG 372 Ca 0.47 0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.71 2w3s h ARG 372 Cb 0.88 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.85 2w3s h ARG 372 CO -0.72 -0.08 0.49 0.00 -1.07 0.00 0.00 179.97 178.59 2w3s h ALA 373 N 0.86 1.46 0.00 0.04 0.00 0.48 -0.78 119.26 121.31 2w3s h ALA 373 Ca 0.02 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2w3s h ALA 373 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2w3s h ALA 373 CO -0.06 -0.15 0.00 1.25 0.00 0.00 0.00 179.25 180.29 2w3s h LEU 374 N 0.61 0.00 -1.06 0.00 5.85 -0.37 -3.30 115.31 117.04 2w3s h LEU 374 Ca 0.53 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.25 2w3s h LEU 374 Cb 0.85 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.88 2w3s h LEU 374 CO -0.41 0.00 0.00 0.59 -0.34 0.00 0.00 178.44 178.28 2w3s n ASN 375 N -2.88 1.01 -4.69 1.25 3.02 -0.32 -4.94 115.26 107.71 2w3s n ASN 375 Ca -0.00 -1.05 -0.40 0.00 -0.03 0.00 0.00 54.58 53.10 2w3s n ASN 375 Cb 0.21 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.41 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 -0.03 1.82 -1.33 3.10 0.99 -1.06 -1.40 117.46 119.56 2w3s n PHE 376 Ca 0.00 0.48 -0.41 0.00 -0.00 0.00 0.00 57.45 57.51 2w3s n PHE 376 Cb 0.02 -2.31 0.00 0.00 -1.00 0.00 0.00 39.48 36.20 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 -0.75 -1.87 -1.93 1.38 4.02 -1.16 -4.62 117.16 112.23 2w3s n TYR 377 Ca 0.09 0.58 -0.37 0.00 -0.01 0.00 0.00 57.90 58.20 2w3s n TYR 377 Cb 0.42 -1.81 0.04 0.00 -0.02 0.00 0.00 39.34 37.97 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 -1.00 5.11 0.92 7.72 1.01 -1.26 -4.84 116.67 124.33 2w3s s ASP 378 Ca 0.60 2.50 -0.12 0.00 0.71 0.00 0.00 52.55 56.25 2w3s s ASP 378 Cb -0.60 -2.61 0.15 0.00 1.01 0.00 0.00 42.92 40.87 2w3s s ASP 378 CO 0.62 -1.65 1.09 -2.16 0.21 0.00 0.00 175.17 173.28 2w3s s PRO 379 N -3.24 1.03 0.29 8.23 0.04 -1.26 -4.52 135.00 135.57 2w3s s PRO 379 Ca 0.77 0.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.39 2w3s s PRO 379 Cb -0.34 -1.78 -0.13 0.00 0.04 0.00 0.00 34.50 32.30 2w3s s PRO 379 CO 0.37 -2.41 1.36 -2.30 0.04 0.00 0.00 177.00 174.05 2w3s n PRO 380 N -4.01 2.10 0.00 0.56 -0.02 -1.26 -4.94 135.00 127.43 2w3s n PRO 380 Ca 0.07 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2w3s n PRO 380 Cb 0.55 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 2w3s n PRO 380 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2w3s n GLU 381 N 1.37 0.00 -1.75 -0.52 4.71 -1.26 -5.11 120.64 118.08 2w3s n GLU 381 Ca 0.08 0.00 -0.40 0.00 -0.01 0.00 0.00 57.16 56.84 2w3s n GLU 381 Cb 0.34 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 30.79 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 -1.16 2.06 -3.03 3.49 4.01 -1.26 -5.17 118.16 117.09 2w3s n LYS 398 Ca 0.00 0.74 -0.00 0.00 -0.51 0.00 0.00 58.31 58.54 2w3s n LYS 398 Cb 0.00 -2.59 -0.00 0.00 -0.51 0.00 0.00 35.03 31.93 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 -0.42 -1.41 -2.99 1.97 0.00 -1.26 -4.95 118.16 109.11 2w3s n LYS 399 Ca 0.07 1.48 -0.40 0.00 -0.00 0.00 0.00 58.31 59.46 2w3s n LYS 399 Cb 0.42 -2.44 -0.06 0.00 -0.00 0.00 0.00 35.03 32.96 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 -1.15 4.50 0.37 0.58 2.01 -1.26 -5.00 115.64 115.68 2w3s s THR 400 Ca -0.01 1.67 -0.26 0.00 0.31 0.00 0.00 61.69 63.40 2w3s s THR 400 Cb 0.00 -4.13 -0.12 0.00 0.01 0.00 0.00 72.50 68.26 2w3s s THR 400 CO 0.26 0.47 1.13 0.00 -0.69 0.00 0.00 174.62 175.80 2w3s n GLN 401 N 2.02 1.67 -3.75 4.92 6.02 -1.26 -4.77 117.38 122.23 2w3s n GLN 401 Ca -0.05 0.59 -0.21 0.00 -0.01 0.00 0.00 57.00 57.33 2w3s n GLN 401 Cb 0.49 -2.13 -0.03 0.00 1.02 0.00 0.00 30.24 29.59 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 -1.16 3.48 0.97 5.09 -4.23 -1.26 -2.31 115.64 116.22 2w3s s THR 402 Ca 0.59 -1.33 -0.15 0.00 -1.18 0.00 0.00 61.69 59.62 2w3s s THR 402 Cb -0.59 -3.18 0.18 0.00 1.34 0.00 0.00 72.50 70.26 2w3s s THR 402 CO 0.59 -0.15 1.22 0.42 -0.54 0.00 0.00 174.62 176.16 2w3s s THR 403 N -2.31 1.92 -1.74 3.99 -4.23 0.64 -4.86 115.64 109.04 2w3s s THR 403 Ca 0.42 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 61.09 2w3s s THR 403 Cb -0.06 -2.85 0.38 0.00 1.34 0.00 0.00 72.50 71.32 2w3s s THR 403 CO 0.27 0.00 1.43 0.00 -0.54 0.00 0.00 174.62 175.78 2w3s n HIS 404 N -3.89 0.00 -0.30 3.99 1.44 -1.26 0.24 115.22 115.44 2w3s n HIS 404 Ca 0.12 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.89 2w3s n HIS 404 Cb 0.60 -0.13 0.17 0.00 0.12 0.00 0.00 29.99 30.75 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 -1.13 0.54 -1.32 -1.40 0.18 -1.26 -4.71 117.16 108.06 2w3s n TYR 405 Ca 0.10 -0.56 -0.02 0.00 1.88 0.00 0.00 57.90 59.30 2w3s n TYR 405 Cb 0.09 -0.07 -0.01 0.00 -0.38 0.00 0.00 39.34 38.97 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 0.35 0.47 3.64 -7.48 0.00 0.14 -2.09 105.19 100.22 2w3s n GLY 406 Ca 0.13 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.68 4.06 0.64 1.61 0.74 -1.23 -4.61 119.66 118.18 2w3s s GLN 407 Ca 0.00 -0.16 -0.18 0.00 0.05 0.00 0.00 55.36 55.07 2w3s s GLN 407 Cb 0.00 -3.57 -0.01 0.00 1.10 0.00 0.00 33.01 30.52 2w3s s GLN 407 CO 0.00 -0.04 1.24 -1.21 -0.55 0.00 0.00 175.29 174.73 2w3s s GLU 408 N 1.34 2.67 -0.50 1.67 2.02 -1.26 -0.26 118.70 124.37 2w3s s GLU 408 Ca 0.10 1.90 0.04 0.00 0.02 0.00 0.00 54.97 57.03 2w3s s GLU 408 Cb -0.14 -1.88 0.13 0.00 0.10 0.00 0.00 34.13 32.33 2w3s s GLU 408 CO 0.07 -1.46 0.24 0.08 0.02 0.00 0.00 175.26 174.21 2w3s s VAL 409 N -1.59 2.53 -2.95 2.63 1.01 -0.98 -4.86 120.40 116.20 2w3s s VAL 409 Ca 0.79 -3.23 0.24 0.00 0.00 0.00 0.00 61.98 59.78 2w3s s VAL 409 Cb -0.33 -2.77 0.19 0.00 0.00 0.00 0.00 36.38 33.48 2w3s s VAL 409 CO 0.38 -0.79 1.25 0.00 0.00 0.00 0.00 175.10 175.94 2w3s n ALA 410 N 3.21 2.46 -0.46 5.51 0.00 -1.26 -4.34 120.51 125.62 2w3s n ALA 410 Ca 0.05 -0.70 0.01 0.00 0.00 0.00 0.00 53.44 52.80 2w3s n ALA 410 Cb 0.33 -0.80 0.01 0.00 0.00 0.00 0.00 19.45 18.99 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 1.34 1.44 -4.65 0.00 5.75 -1.26 -4.35 116.55 114.82 2w3s n ASP 411 Ca 0.14 -1.86 -0.43 0.00 -0.01 0.00 0.00 54.79 52.63 2w3s n ASP 411 Cb 0.59 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.61 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 5.56 1.08 -0.29 0.00 0.24 -1.26 -4.11 118.33 119.55 2w3s n VAL 413 Ca 0.14 -1.08 0.05 0.00 -2.04 0.00 0.00 64.34 61.40 2w3s n VAL 413 Cb 0.45 0.44 0.19 0.00 -1.47 0.00 0.00 33.84 33.45 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 0.84 0.59 0.00 1.34 3.38 -1.91 -2.37 115.31 117.17 2w3s h LEU 414 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2w3s h LEU 414 Cb 0.64 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2w3s h LEU 414 CO 0.01 0.30 0.00 0.61 0.09 0.00 0.00 178.44 179.45 2w3s n GLY 415 N -1.32 -3.03 0.12 0.83 0.00 -1.26 0.08 105.19 100.61 2w3s n GLY 415 Ca 0.15 0.44 -0.08 0.00 0.00 0.00 0.00 46.02 46.53 2w3s n GLY 415 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2w3s h GLU 416 N 0.00 -0.01 -0.07 1.61 4.81 -1.91 -2.58 114.58 116.43 2w3s h GLU 416 Ca 0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2w3s h GLU 416 Cb 0.00 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2w3s h GLU 416 CO 0.00 -0.01 -0.09 1.25 -0.73 0.00 0.00 179.01 179.43 2w3s h LEU 417 N -0.01 -0.29 -1.33 1.64 6.46 -1.27 -0.36 115.31 120.15 2w3s h LEU 417 Ca 0.11 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.91 2w3s h LEU 417 Cb 0.18 0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.22 2w3s h LEU 417 CO -0.24 -0.13 0.24 0.58 -0.62 0.00 0.00 178.44 178.27 2w3s h VAL 418 N -0.13 1.17 -0.45 1.05 2.07 -0.18 0.17 116.25 119.95 2w3s h VAL 418 Ca 0.06 -0.47 -0.10 0.00 0.82 0.00 0.00 66.70 67.01 2w3s h VAL 418 Cb 0.21 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2w3s h VAL 418 CO -0.15 0.20 -0.11 0.74 0.02 0.00 0.00 177.57 178.27 2w3s h THR 419 N 0.69 1.27 -0.66 2.57 2.02 -1.05 -1.65 112.91 116.11 2w3s h THR 419 Ca 0.17 -1.23 -0.07 0.00 0.77 0.00 0.00 66.41 66.06 2w3s h THR 419 Cb 0.08 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 2w3s h THR 419 CO -0.02 0.42 0.15 -0.09 0.37 0.00 0.00 175.52 176.35 2w3s h ARG 420 N 0.71 1.04 -0.11 6.66 2.43 0.14 -2.63 114.38 122.63 2w3s h ARG 420 Ca 0.11 -0.24 -0.04 0.00 -0.81 0.00 0.00 59.98 59.00 2w3s h ARG 420 Cb 0.65 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.06 2w3s h ARG 420 CO 0.04 0.93 -0.09 1.25 -1.51 0.00 0.00 179.97 180.59 2w3s h LEU 421 N 0.99 0.26 -1.02 3.80 5.85 -0.60 -1.53 115.31 123.07 2w3s h LEU 421 Ca 0.21 -0.47 0.01 0.00 0.84 0.00 0.00 57.88 58.47 2w3s h LEU 421 Cb 0.36 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 2w3s h LEU 421 CO 0.00 0.68 0.66 1.56 -0.34 0.00 0.00 178.44 181.00 2w3s h GLN 422 N -0.15 1.31 0.01 1.25 4.20 -1.28 0.32 115.11 120.77 2w3s h GLN 422 Ca 0.02 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2w3s h GLN 422 Cb 0.60 -0.30 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2w3s h GLN 422 CO 0.02 0.87 -0.00 0.87 -0.67 0.00 0.00 178.83 179.92 2w3s h LYS 423 N 1.35 -0.01 -0.16 1.46 1.79 -1.46 0.22 116.57 119.76 2w3s h LYS 423 Ca 0.36 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.78 2w3s h LYS 423 Cb -0.15 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.49 2w3s h LYS 423 CO -0.08 0.45 -0.16 0.66 -1.08 0.00 0.00 179.45 179.25 2w3s h SER 424 N -0.47 0.24 0.17 0.86 4.64 -1.07 -2.20 113.55 115.72 2w3s h SER 424 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2w3s h SER 424 Cb 0.46 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2w3s h SER 424 CO 0.00 0.42 -0.02 0.00 -0.87 0.00 0.00 176.83 176.36 2w3s n ALA 425 N -2.49 2.65 -3.60 5.18 0.00 0.11 -4.91 120.51 117.45 2w3s n ALA 425 Ca -0.01 -0.24 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 2w3s n ALA 425 Cb 0.29 -1.43 0.06 0.00 0.00 0.00 0.00 19.45 18.38 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 -0.87 -2.76 0.37 0.00 4.05 -0.61 -4.93 115.26 110.51 2w3s n ASN 426 Ca 0.20 -0.69 -0.16 0.00 0.45 0.00 0.00 54.58 54.37 2w3s n ASN 426 Cb 0.20 -4.61 -0.08 0.00 1.23 0.00 0.00 39.78 36.52 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 -2.04 -0.89 -0.07 1.20 3.57 -0.86 -2.37 116.94 115.48 2w3s h PHE 427 Ca -0.59 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 60.90 2w3s h PHE 427 Cb 1.36 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 40.37 2w3s h PHE 427 CO 0.47 -0.53 -0.20 1.15 -2.23 0.00 0.00 178.31 176.97 2w3s h THR 428 N -1.17 0.00 -0.59 4.41 2.02 -1.92 0.24 112.91 115.90 2w3s h THR 428 Ca -0.10 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.20 2w3s h THR 428 Cb 0.76 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.06 2w3s h THR 428 CO 0.16 0.00 -0.14 0.74 0.37 0.00 0.00 175.52 176.65 2w3s h THR 429 N -0.20 0.42 -0.91 3.16 2.02 -1.97 -0.89 112.91 114.54 2w3s h THR 429 Ca 0.01 -0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.30 2w3s h THR 429 Cb 0.24 0.41 -0.08 0.00 -1.74 0.00 0.00 68.15 66.99 2w3s h THR 429 CO -0.17 0.00 0.55 0.03 0.37 0.00 0.00 175.52 176.30 2w3s h ARG 430 N 0.01 0.86 -0.53 6.66 3.08 -1.14 -0.99 114.38 122.33 2w3s h ARG 430 Ca 0.28 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.30 2w3s h ARG 430 Cb 0.43 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 2w3s h ARG 430 CO -0.60 0.57 0.33 -0.09 -1.07 0.00 0.00 179.97 179.11 2w3s h ARG 431 N 0.89 0.64 -0.01 0.04 2.43 0.45 -1.91 114.38 116.91 2w3s h ARG 431 Ca 0.45 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.58 2w3s h ARG 431 Cb 0.43 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2w3s h ARG 431 CO -0.26 0.42 0.00 0.00 -1.51 0.00 0.00 179.97 178.63 2w3s h ALA 432 N 1.22 0.01 -0.45 2.80 0.00 -0.81 -2.44 119.26 119.59 2w3s h ALA 432 Ca 0.20 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.17 2w3s h ALA 432 Cb -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2w3s h ALA 432 CO -0.08 -0.42 0.32 0.93 0.00 0.00 0.00 179.25 180.01 2w3s h GLU 433 N -0.12 0.04 0.05 0.00 5.08 -1.07 -1.59 114.58 116.97 2w3s h GLU 433 Ca 0.00 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2w3s h GLU 433 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2w3s h GLU 433 CO -0.00 0.03 -0.02 0.82 -1.00 0.00 0.00 179.01 178.83 2w3s h ILE 434 N 0.04 1.26 0.12 3.13 2.04 -0.88 -0.03 117.51 123.20 2w3s h ILE 434 Ca 0.21 -1.07 0.02 0.00 1.00 0.00 0.00 64.86 65.02 2w3s h ILE 434 Cb 0.80 1.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.80 2w3s h ILE 434 CO -0.01 0.27 -0.47 0.00 0.00 0.00 0.00 178.15 177.93 2w3s h ALA 435 N 0.37 -0.86 -0.76 1.87 0.00 -1.12 0.20 119.26 118.95 2w3s h ALA 435 Ca -0.01 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.89 2w3s h ALA 435 Cb 0.49 0.80 -0.10 0.00 0.00 0.00 0.00 17.79 18.97 2w3s h ALA 435 CO 0.01 -1.05 -0.57 0.00 0.00 0.00 0.00 179.25 177.64 2w3s h ALA 436 N -0.34 -0.63 -0.42 0.00 0.00 -1.32 -1.78 119.26 114.77 2w3s h ALA 436 Ca 0.01 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.07 2w3s h ALA 436 Cb 0.72 1.28 -0.07 0.00 0.00 0.00 0.00 17.79 19.73 2w3s h ALA 436 CO -0.27 -0.98 0.02 2.35 0.00 0.00 0.00 179.25 180.37 2w3s h TRP 437 N -0.14 0.02 -0.16 0.00 7.01 -0.09 -1.96 115.95 120.62 2w3s h TRP 437 Ca 0.12 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.16 2w3s h TRP 437 Cb 0.47 0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.58 2w3s h TRP 437 CO -0.92 -0.06 0.11 -0.91 -2.79 0.00 0.00 178.44 173.87 2w3s h ASN 438 N 0.13 0.19 0.25 2.65 2.35 0.11 -1.01 115.58 120.24 2w3s h ASN 438 Ca 0.21 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 2w3s h ASN 438 Cb 0.29 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 2w3s h ASN 438 CO -0.32 0.14 -0.15 0.77 -1.65 0.00 0.00 177.43 176.22 2w3s h SER 439 N 0.22 0.00 1.33 5.81 4.64 -0.54 -2.32 113.55 122.69 2w3s h SER 439 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2w3s h SER 439 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 2w3s h SER 439 CO -0.01 0.15 -0.47 0.74 -0.87 0.00 0.00 176.83 176.36 2w3s h THR 440 N 0.00 0.00 -2.19 2.95 2.02 -1.18 -3.47 112.91 111.03 2w3s h THR 440 Ca -0.00 -0.80 -0.55 0.00 0.77 0.00 0.00 66.41 65.83 2w3s h THR 440 Cb 0.31 1.54 -0.08 0.00 -1.74 0.00 0.00 68.15 68.18 2w3s h THR 440 CO 0.02 0.00 -0.62 0.20 0.37 0.00 0.00 175.52 175.49 2w3s s ASN 441 N -5.22 4.74 0.00 4.18 -0.87 -0.87 -5.01 114.94 111.89 2w3s s ASN 441 Ca 0.05 -0.57 0.00 0.00 -1.57 0.00 0.00 52.86 50.77 2w3s s ASN 441 Cb 0.10 -0.95 0.00 0.00 -0.02 0.00 0.00 41.25 40.37 2w3s s ASN 441 CO 0.71 -0.01 0.00 -2.11 -2.57 0.00 0.00 177.10 173.12 2w3s n ARG 442 N -0.96 0.58 -0.08 -0.60 1.85 -1.26 -4.80 116.66 111.39 2w3s n ARG 442 Ca -0.07 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.72 2w3s n ARG 442 Cb 0.59 -0.05 -0.14 0.00 -1.05 0.00 0.00 32.46 31.81 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 -0.05 1.06 -4.47 8.89 -1.04 -1.26 -4.87 114.28 112.54 2w3s n THR 443 Ca 0.00 -0.71 -0.29 0.00 -2.04 0.00 0.00 64.05 61.00 2w3s n THR 443 Cb 0.00 -0.45 -0.13 0.00 -1.82 0.00 0.00 70.33 67.93 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 -5.18 2.36 -0.01 -4.42 1.43 -1.26 0.36 118.68 111.97 2w3s s LEU 444 Ca -0.09 -0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 52.32 2w3s s LEU 444 Cb 0.06 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.99 2w3s s LEU 444 CO 0.74 0.20 0.02 0.00 0.23 0.00 0.00 176.35 177.54 2w3s s ALA 445 N -1.03 -0.06 0.29 4.21 0.00 -0.75 -4.69 121.76 119.74 2w3s s ALA 445 Ca 0.14 0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.16 2w3s s ALA 445 Cb -0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2w3s s ALA 445 CO 0.06 -0.02 0.46 1.03 0.00 0.00 0.00 175.76 177.29 2w3s s ARG 446 N -0.07 3.47 -0.12 0.00 1.81 -1.26 -0.75 118.95 122.03 2w3s s ARG 446 Ca -0.01 -0.49 -0.08 0.00 -1.72 0.00 0.00 55.73 53.43 2w3s s ARG 446 Cb -0.01 -2.76 0.04 0.00 -0.45 0.00 0.00 34.95 31.77 2w3s s ARG 446 CO -0.00 0.28 0.31 0.20 -0.68 0.00 0.00 175.30 175.41 2w3s s GLY 447 N -3.91 -0.22 0.16 -3.53 0.00 -0.58 -4.21 107.32 95.03 2w3s s GLY 447 Ca 0.38 1.08 0.11 0.00 0.00 0.00 0.00 44.72 46.29 2w3s s GLY 447 CO 0.33 1.17 -0.25 -1.50 0.00 0.00 0.00 173.10 172.85 2w3s s ILE 448 N 0.89 2.28 -0.14 0.90 2.07 -1.26 -0.53 121.20 125.41 2w3s s ILE 448 Ca -0.06 -1.90 -0.27 0.00 -1.41 0.00 0.00 60.65 57.01 2w3s s ILE 448 Cb -0.07 -2.05 0.07 0.00 0.13 0.00 0.00 42.46 40.54 2w3s s ILE 448 CO -0.06 -0.03 0.66 0.00 -1.91 0.00 0.00 174.94 173.59 2w3s s ALA 449 N -1.41 -1.67 -0.11 1.50 0.00 -0.50 -4.52 121.76 115.05 2w3s s ALA 449 Ca 0.17 1.52 -0.02 0.00 0.00 0.00 0.00 51.96 53.63 2w3s s ALA 449 Cb -0.09 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 2w3s s ALA 449 CO 0.08 -0.34 -0.02 -1.17 0.00 0.00 0.00 175.76 174.31 2w3s s LEU 450 N -0.52 3.41 0.05 0.00 0.20 -1.26 -1.40 118.68 119.15 2w3s s LEU 450 Ca -0.06 0.02 0.04 0.00 0.69 0.00 0.00 54.13 54.81 2w3s s LEU 450 Cb -0.02 -1.79 -0.02 0.00 -0.43 0.00 0.00 46.19 43.92 2w3s s LEU 450 CO 0.06 0.29 -0.11 -0.94 -0.29 0.00 0.00 176.35 175.36 2w3s s SER 451 N -0.39 1.34 0.23 3.68 1.04 -0.20 -4.91 113.70 114.50 2w3s s SER 451 Ca 0.07 -0.50 0.07 0.00 0.48 0.00 0.00 55.95 56.07 2w3s s SER 451 Cb -0.12 -0.04 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 2w3s s SER 451 CO 0.02 -0.07 0.11 -2.16 0.98 0.00 0.00 173.24 172.12 2w3s s PRO 452 N -1.37 2.69 -0.06 4.02 0.04 -1.26 -1.57 135.00 137.48 2w3s s PRO 452 Ca -0.03 -1.13 0.06 0.00 0.04 0.00 0.00 61.00 59.94 2w3s s PRO 452 Cb -0.09 -2.44 -0.01 0.00 0.04 0.00 0.00 34.50 32.00 2w3s s PRO 452 CO 0.01 0.41 -0.23 0.08 0.04 0.00 0.00 177.00 177.31 2w3s s VAL 453 N -2.07 1.92 -0.17 -0.36 1.01 0.14 -4.82 120.40 116.05 2w3s s VAL 453 Ca 0.31 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 2w3s s VAL 453 Cb -0.08 -1.63 0.05 0.00 0.00 0.00 0.00 36.38 34.72 2w3s s VAL 453 CO 0.22 0.54 0.01 -0.75 0.00 0.00 0.00 175.10 175.12 2w3s s LYS 454 N -0.09 0.79 -0.08 2.72 2.20 -1.26 -2.51 119.74 121.51 2w3s s LYS 454 Ca -0.04 -0.36 0.02 0.00 -0.36 0.00 0.00 55.97 55.23 2w3s s LYS 454 Cb -0.13 -1.91 0.01 0.00 -1.51 0.00 0.00 37.83 34.29 2w3s s LYS 454 CO 0.04 -0.55 -0.14 0.12 -0.36 0.00 0.00 175.35 174.45 2w3s s PHE 455 N 1.83 1.71 0.10 4.03 5.36 0.49 -4.87 117.98 126.62 2w3s s PHE 455 Ca 0.00 -0.68 -0.26 0.00 -0.96 0.00 0.00 56.93 55.03 2w3s s PHE 455 Cb -0.16 -1.23 -0.06 0.00 -0.34 0.00 0.00 43.02 41.23 2w3s s PHE 455 CO -0.07 -0.34 0.80 0.20 -1.46 0.00 0.00 175.22 174.34 2w3s s GLY 456 N 0.71 2.87 -0.23 13.12 0.00 -1.26 0.08 107.32 122.60 2w3s s GLY 456 Ca -0.13 0.35 -0.05 0.00 0.00 0.00 0.00 44.72 44.88 2w3s s GLY 456 CO 0.03 1.06 0.01 -0.42 0.00 0.00 0.00 173.10 173.78 2w3s s ILE 457 N -0.44 3.83 0.00 0.90 -1.09 -0.79 -4.97 121.20 118.64 2w3s s ILE 457 Ca 0.39 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.47 2w3s s ILE 457 Cb -0.22 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.90 2w3s s ILE 457 CO 0.25 0.39 0.00 -1.20 -1.23 0.00 0.00 174.94 173.15 2w3s n SER 458 N 4.79 0.00 -4.67 3.58 7.64 -1.26 -2.27 113.62 121.43 2w3s n SER 458 Ca -0.17 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.29 2w3s n SER 458 Cb 0.51 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 2w3s n SER 458 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2w3s s PHE 459 N -1.57 2.08 -1.23 1.43 0.40 -1.26 -4.84 117.98 112.99 2w3s s PHE 459 Ca 0.00 0.14 0.10 0.00 -0.60 0.00 0.00 56.93 56.57 2w3s s PHE 459 Cb 0.00 -4.00 0.49 0.00 0.51 0.00 0.00 43.02 40.02 2w3s s PHE 459 CO 0.00 -4.18 1.28 0.25 0.70 0.00 0.00 175.22 173.27 2w3s n THR 460 N 5.11 1.00 -3.27 0.64 -2.24 -1.26 -3.08 114.28 111.18 2w3s n THR 460 Ca 0.17 0.25 -0.46 0.00 -2.27 0.00 0.00 64.05 61.74 2w3s n THR 460 Cb 0.41 -1.07 -0.01 0.00 -2.10 0.00 0.00 70.33 67.56 2w3s n THR 460 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2w3s s LEU 461 N -2.77 6.35 0.18 3.22 2.96 -1.26 -4.97 118.68 122.38 2w3s s LEU 461 Ca 0.08 -3.00 -0.05 0.00 -0.22 0.00 0.00 54.13 50.94 2w3s s LEU 461 Cb 0.07 -2.24 0.29 0.00 0.50 0.00 0.00 46.19 44.81 2w3s s LEU 461 CO 0.17 -0.52 0.98 0.41 -1.32 0.00 0.00 176.35 176.08 2w3s n THR 462 N 3.67 -0.27 0.47 3.68 -1.04 -1.18 -1.14 114.28 118.48 2w3s n THR 462 Ca 0.20 1.45 0.05 0.00 -2.04 0.00 0.00 64.05 63.71 2w3s n THR 462 Cb 0.44 -2.00 0.26 0.00 -1.82 0.00 0.00 70.33 67.21 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 -5.03 0.00 0.35 -1.42 1.44 -1.26 -1.17 115.22 108.13 2w3s n HIS 463 Ca 0.10 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.95 2w3s n HIS 463 Cb 0.31 -0.33 0.47 0.00 0.12 0.00 0.00 29.99 30.56 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 -5.49 2.39 3.38 -1.45 -3.36 115.31 110.78 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 0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.88 2w3s h LEU 464 CO 0.00 0.00 3.30 0.59 0.09 0.00 0.00 178.44 182.42 2w3s n ASN 465 N -2.76 6.17 -3.94 -0.43 3.02 -0.32 -4.73 115.26 112.27 2w3s n ASN 465 Ca 0.03 -2.61 -0.13 0.00 -0.03 0.00 0.00 54.58 51.84 2w3s n ASN 465 Cb 0.37 -1.46 -0.13 0.00 -0.61 0.00 0.00 39.78 37.94 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 2.94 0.23 0.05 3.52 -2.07 -1.26 -1.68 119.66 121.40 2w3s s GLN 466 Ca 0.57 -0.25 -0.04 0.00 -1.82 0.00 0.00 55.36 53.82 2w3s s GLN 466 Cb 0.15 -0.12 -0.02 0.00 -1.09 0.00 0.00 33.01 31.93 2w3s s GLN 466 CO -0.05 0.03 0.06 0.00 -1.32 0.00 0.00 175.29 174.01 2w3s s ALA 467 N -0.46 0.11 0.12 2.60 0.00 0.22 -4.51 121.76 119.84 2w3s s ALA 467 Ca -0.04 -0.77 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 2w3s s ALA 467 Cb -0.04 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2w3s s ALA 467 CO -0.00 -0.35 0.05 0.20 0.00 0.00 0.00 175.76 175.65 2w3s s GLY 468 N -2.43 0.94 0.02 0.00 0.00 -1.26 -1.02 107.32 103.57 2w3s s GLY 468 Ca -0.01 -1.45 -0.20 0.00 0.00 0.00 0.00 44.72 43.07 2w3s s GLY 468 CO -0.07 -1.36 0.44 0.00 0.00 0.00 0.00 173.10 172.11 2w3s s ALA 469 N -4.03 -1.10 -0.07 3.20 0.00 0.58 -2.22 121.76 118.12 2w3s s ALA 469 Ca 0.23 0.47 -0.00 0.00 0.00 0.00 0.00 51.96 52.66 2w3s s ALA 469 Cb 0.07 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.47 2w3s s ALA 469 CO 0.01 -0.41 -0.03 -1.17 0.00 0.00 0.00 175.76 174.16 2w3s s LEU 470 N -1.76 0.96 -0.02 0.00 2.96 -0.06 0.34 118.68 121.11 2w3s s LEU 470 Ca -0.08 -0.14 0.06 0.00 -0.22 0.00 0.00 54.13 53.75 2w3s s LEU 470 Cb -0.02 -0.53 -0.01 0.00 0.50 0.00 0.00 46.19 46.13 2w3s s LEU 470 CO 0.01 -0.13 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.02 2w3s s VAL 471 N 1.55 1.58 -0.07 1.68 1.01 -0.19 -1.83 120.40 124.12 2w3s s VAL 471 Ca -0.01 -0.84 0.03 0.00 0.00 0.00 0.00 61.98 61.17 2w3s s VAL 471 Cb -0.13 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.94 2w3s s VAL 471 CO -0.04 0.45 -0.18 -1.10 0.00 0.00 0.00 175.10 174.23 2w3s s GLN 472 N -0.36 2.25 -0.25 2.72 -1.52 -0.12 -2.26 119.66 120.12 2w3s s GLN 472 Ca 0.05 -0.63 -0.04 0.00 -1.95 0.00 0.00 55.36 52.79 2w3s s GLN 472 Cb -0.09 -1.79 0.01 0.00 -0.22 0.00 0.00 33.01 30.92 2w3s s GLN 472 CO 0.00 0.13 -0.01 0.42 -0.25 0.00 0.00 175.29 175.57 2w3s s ILE 473 N 0.42 3.38 0.63 1.08 1.01 -0.38 -0.75 121.20 126.60 2w3s s ILE 473 Ca -0.14 -0.71 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 2w3s s ILE 473 Cb -0.16 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.65 2w3s s ILE 473 CO 0.05 0.26 1.00 -0.31 0.00 0.00 0.00 174.94 175.95 2w3s s TYR 474 N 1.44 3.46 -1.91 3.97 1.51 0.40 -4.82 117.35 121.40 2w3s s TYR 474 Ca 0.03 1.05 0.20 0.00 -1.01 0.00 0.00 57.07 57.34 2w3s s TYR 474 Cb -0.16 -2.79 1.19 0.00 -0.11 0.00 0.00 41.96 40.09 2w3s s TYR 474 CO -0.02 -0.83 1.62 0.25 -1.11 0.00 0.00 175.55 175.45 2w3s n THR 475 N -2.76 0.06 1.13 -0.71 -2.24 -1.26 -0.30 114.28 108.21 2w3s n THR 475 Ca 0.05 0.02 0.12 0.00 -2.27 0.00 0.00 64.05 61.97 2w3s n THR 475 Cb 0.56 -0.69 0.20 0.00 -2.10 0.00 0.00 70.33 68.29 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 -1.05 1.42 0.00 3.42 3.85 -1.26 -4.43 116.55 118.50 2w3s n ASP 476 Ca 0.14 -1.13 0.00 0.00 -0.71 0.00 0.00 54.79 53.10 2w3s n ASP 476 Cb 0.08 0.31 0.00 0.00 -1.35 0.00 0.00 41.12 40.17 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 1.38 0.69 3.85 6.12 0.00 0.59 -4.74 105.19 113.09 2w3s n GLY 477 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.65 6.17 -0.06 1.61 1.04 -1.25 -4.84 113.70 113.72 2w3s s SER 478 Ca 0.00 1.50 0.01 0.00 0.48 0.00 0.00 55.95 57.94 2w3s s SER 478 Cb 0.00 -2.48 0.02 0.00 0.10 0.00 0.00 66.02 63.65 2w3s s SER 478 CO 0.00 -0.91 -0.08 -0.69 0.98 0.00 0.00 173.24 172.54 2w3s s VAL 479 N -3.02 0.85 -0.23 5.02 1.01 0.01 -0.45 120.40 123.59 2w3s s VAL 479 Ca 0.57 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.13 2w3s s VAL 479 Cb -0.11 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.40 2w3s s VAL 479 CO 0.49 0.30 0.22 0.00 0.00 0.00 0.00 175.10 176.11 2w3s s ALA 480 N 0.88 3.60 -0.10 5.51 0.00 0.08 -0.12 121.76 131.60 2w3s s ALA 480 Ca -0.11 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 2w3s s ALA 480 Cb -0.15 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.53 2w3s s ALA 480 CO 0.01 -0.22 0.04 -1.17 0.00 0.00 0.00 175.76 174.42 2w3s s LEU 481 N 1.13 3.82 -0.08 0.00 2.96 0.94 -0.94 118.68 126.51 2w3s s LEU 481 Ca 0.10 0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 54.20 2w3s s LEU 481 Cb -0.14 -1.89 0.03 0.00 0.50 0.00 0.00 46.19 44.69 2w3s s LEU 481 CO 0.05 0.38 0.21 0.21 -1.32 0.00 0.00 176.35 175.88 2w3s s ASN 482 N -0.90 -0.21 0.20 3.68 3.84 -0.76 -0.65 114.94 120.14 2w3s s ASN 482 Ca 0.13 0.43 -0.04 0.00 0.21 0.00 0.00 52.86 53.59 2w3s s ASN 482 Cb -0.12 0.37 -0.03 0.00 -0.55 0.00 0.00 41.25 40.93 2w3s s ASN 482 CO 0.03 -0.12 0.21 -1.38 -2.79 0.00 0.00 177.10 173.05 2w3s s HIS 483 N 0.67 0.86 -0.86 0.43 -3.43 -1.26 -0.88 115.29 110.83 2w3s s HIS 483 Ca -0.05 -1.15 0.22 0.00 -0.80 0.00 0.00 55.06 53.29 2w3s s HIS 483 Cb -0.06 -0.33 0.90 0.00 -1.43 0.00 0.00 32.58 31.66 2w3s s HIS 483 CO -0.04 -0.71 1.70 0.41 -2.00 0.00 0.00 174.74 174.10 2w3s n GLY 484 N -0.26 -1.31 3.78 -1.38 0.00 -0.94 -4.67 105.19 100.41 2w3s n GLY 484 Ca -0.01 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.20 2.77 -0.08 -0.02 0.00 -1.26 -4.87 107.32 100.66 2w3s s GLY 485 Ca 0.09 0.79 -0.01 0.00 0.00 0.00 0.00 44.72 45.59 2w3s s GLY 485 CO 0.42 1.24 -0.03 -0.51 0.00 0.00 0.00 173.10 174.22 2w3s s THR 486 N -1.60 4.07 -0.23 0.90 -4.23 -1.26 -4.75 115.64 108.54 2w3s s THR 486 Ca 0.59 -0.34 -0.13 0.00 -1.18 0.00 0.00 61.69 60.63 2w3s s THR 486 Cb -0.25 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 2w3s s THR 486 CO 0.31 0.60 0.28 -0.70 -0.54 0.00 0.00 174.62 174.57 2w3s s GLU 487 N -0.84 4.09 0.00 3.99 2.56 -1.26 -4.92 118.70 122.33 2w3s s GLU 487 Ca 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.97 55.05 2w3s s GLU 487 Cb -0.11 -3.56 0.00 0.00 2.00 0.00 0.00 34.13 32.45 2w3s s GLU 487 CO 0.02 -0.04 0.65 0.00 -0.56 0.00 0.00 175.26 175.32 2w3s n MET 488 N 4.57 1.03 0.00 4.30 0.00 -1.26 -0.45 117.12 125.30 2w3s n MET 488 Ca -0.11 -0.83 0.00 0.00 0.00 0.00 0.00 57.70 56.76 2w3s n MET 488 Cb 0.51 -0.70 0.00 0.00 0.00 0.00 0.00 33.22 33.04 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 -0.18 1.18 0.00 3.17 0.00 -1.26 -2.94 105.19 105.16 2w3s n GLY 489 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2w3s n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w3s n GLN 490 N -0.19 0.24 -0.77 1.61 0.00 -1.26 -4.88 117.38 112.13 2w3s n GLN 490 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 57.00 57.04 2w3s n GLN 490 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.74 2w3s n GLN 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2w3s n GLY 491 N 1.10 0.63 0.32 2.61 0.00 -1.26 -4.95 105.19 103.64 2w3s n GLY 491 Ca 0.10 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.67 -1.35 0.99 5.85 -1.91 -2.81 115.31 115.40 2w3s h LEU 492 Ca 0.00 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.88 2w3s h LEU 492 Cb 0.10 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 2w3s h LEU 492 CO 0.00 -0.45 0.54 0.45 -0.34 0.00 0.00 178.44 178.65 2w3s h HIS 493 N -0.72 0.75 -0.44 1.25 3.86 -1.93 -1.56 115.15 116.36 2w3s h HIS 493 Ca -0.06 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.06 2w3s h HIS 493 Cb 0.57 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 2w3s h HIS 493 CO -0.07 0.31 -0.17 0.00 0.86 0.00 0.00 177.93 178.85 2w3s h ALA 494 N 1.61 0.62 -0.14 2.45 0.00 -1.86 -1.75 119.26 120.18 2w3s h ALA 494 Ca 0.41 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2w3s h ALA 494 Cb 0.65 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2w3s h ALA 494 CO -0.17 0.56 -0.01 0.87 0.00 0.00 0.00 179.25 180.51 2w3s h LYS 495 N 0.73 0.19 0.05 0.00 1.57 -1.15 0.13 116.57 118.08 2w3s h LYS 495 Ca 0.10 -0.02 -0.23 0.00 -1.87 0.00 0.00 60.65 58.63 2w3s h LYS 495 Cb 0.74 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 2w3s h LYS 495 CO 0.06 0.22 -1.03 0.52 -0.57 0.00 0.00 179.45 178.65 2w3s h MET 496 N 0.19 0.26 0.38 3.15 2.86 -0.96 -2.27 114.93 118.54 2w3s h MET 496 Ca 0.05 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 57.33 2w3s h MET 496 Cb 0.15 0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2w3s h MET 496 CO 0.00 1.09 -0.18 0.28 1.06 0.00 0.00 176.91 179.16 2w3s h VAL 497 N 0.12 0.64 -1.01 -2.22 2.07 -0.66 -2.05 116.25 113.13 2w3s h VAL 497 Ca -0.08 -0.25 0.21 0.00 0.82 0.00 0.00 66.70 67.40 2w3s h VAL 497 Cb 1.70 0.76 -0.11 0.00 -1.52 0.00 0.00 31.29 32.12 2w3s h VAL 497 CO 0.16 0.05 0.61 1.56 0.02 0.00 0.00 177.57 179.97 2w3s h GLN 498 N -0.64 0.68 0.77 1.57 4.20 -0.70 0.10 115.11 121.09 2w3s h GLN 498 Ca -0.05 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 2w3s h GLN 498 Cb 0.47 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 28.10 2w3s h GLN 498 CO 0.08 0.45 -0.37 0.28 -0.67 0.00 0.00 178.83 178.60 2w3s h VAL 499 N 0.70 0.00 -0.60 -0.54 2.07 -1.35 -1.92 116.25 114.60 2w3s h VAL 499 Ca 0.60 -0.07 0.12 0.00 0.82 0.00 0.00 66.70 68.17 2w3s h VAL 499 Cb 1.02 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.67 2w3s h VAL 499 CO -0.42 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 176.94 2w3s h ALA 500 N -1.45 0.22 -0.51 1.67 0.00 -0.60 0.30 119.26 118.88 2w3s h ALA 500 Ca -0.11 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2w3s h ALA 500 Cb 0.79 0.60 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 2w3s h ALA 500 CO 0.17 -0.53 0.33 0.00 0.00 0.00 0.00 179.25 179.23 2w3s h ALA 501 N 1.36 0.65 0.81 0.00 0.00 -0.90 -0.44 119.26 120.74 2w3s h ALA 501 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2w3s h ALA 501 Cb 0.51 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.10 2w3s h ALA 501 CO -0.66 0.11 -0.39 0.00 0.00 0.00 0.00 179.25 178.31 2w3s h ALA 502 N 1.18 -1.09 -0.75 0.00 0.00 -0.43 0.39 119.26 118.55 2w3s h ALA 502 Ca 0.19 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.96 2w3s h ALA 502 Cb -0.06 0.42 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 2w3s h ALA 502 CO -0.04 -1.11 0.50 0.28 0.00 0.00 0.00 179.25 178.88 2w3s h VAL 503 N -1.11 0.92 0.00 0.00 2.07 -0.26 -1.12 116.25 116.74 2w3s h VAL 503 Ca -0.11 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2w3s h VAL 503 Cb 0.84 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2w3s h VAL 503 CO 0.18 0.12 -0.68 0.18 0.02 0.00 0.00 177.57 177.39 2w3s n LEU 504 N -4.50 0.61 -1.13 2.57 4.77 -0.19 -4.87 117.00 114.26 2w3s n LEU 504 Ca 0.13 -0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.99 2w3s n LEU 504 Cb 0.36 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2w3s n LEU 504 CO 0.32 0.12 0.05 0.61 -1.33 0.00 0.00 177.39 177.16 2w3s n GLY 505 N 1.46 0.60 3.14 -0.72 0.00 0.13 -4.72 105.19 105.08 2w3s n GLY 505 Ca 0.04 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.01 0.46 0.23 -0.61 -4.36 -0.61 -1.38 121.20 111.92 2w3s s ILE 506 Ca 0.12 -1.89 -0.30 0.00 -0.26 0.00 0.00 60.65 58.32 2w3s s ILE 506 Cb -0.05 -1.68 -0.10 0.00 1.25 0.00 0.00 42.46 41.87 2w3s s ILE 506 CO 0.15 -0.86 1.44 -0.62 0.24 0.00 0.00 174.94 175.29 2w3s s ASP 507 N -3.01 6.67 0.57 4.36 -1.08 -1.26 -4.53 116.67 118.40 2w3s s ASP 507 Ca 0.12 2.63 0.32 0.00 -0.52 0.00 0.00 52.55 55.10 2w3s s ASP 507 Cb 0.07 -2.62 1.41 0.00 -1.46 0.00 0.00 42.92 40.32 2w3s s ASP 507 CO -0.06 -0.69 1.73 -0.65 0.52 0.00 0.00 175.17 176.02 2w3s h PRO 508 N 5.25 0.00 0.00 4.34 0.10 -1.92 -0.18 132.00 139.59 2w3s h PRO 508 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.65 2w3s h PRO 508 Cb 1.22 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.32 2w3s h PRO 508 CO 0.79 0.00 0.00 0.28 0.10 0.00 0.00 178.00 179.17 2w3s h VAL 509 N 0.00 0.00 0.00 3.15 2.07 -1.99 -1.37 116.25 118.11 2w3s h VAL 509 Ca 0.44 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.80 2w3s h VAL 509 Cb 2.06 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 2w3s h VAL 509 CO -0.00 0.00 0.00 1.56 0.02 0.00 0.00 177.57 179.15 2w3s h GLN 510 N 0.00 0.00 -5.26 1.57 1.08 -1.39 -3.45 115.11 107.66 2w3s h GLN 510 Ca 0.00 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.59 2w3s h GLN 510 Cb 0.19 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 27.49 2w3s h GLN 510 CO 0.00 0.00 -0.51 0.08 -0.95 0.00 0.00 178.83 177.45 2w3s s VAL 511 N -3.15 5.20 -0.14 -0.54 1.01 -0.52 -0.81 120.40 121.46 2w3s s VAL 511 Ca 0.09 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.21 2w3s s VAL 511 Cb 0.09 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2w3s s VAL 511 CO 0.62 0.44 -0.20 -0.60 0.00 0.00 0.00 175.10 175.36 2w3s s ARG 512 N 0.40 3.09 0.27 2.72 6.06 0.82 -4.96 118.95 127.36 2w3s s ARG 512 Ca 0.06 -0.82 -0.29 0.00 -2.50 0.00 0.00 55.73 52.18 2w3s s ARG 512 Cb -0.12 -2.47 -0.09 0.00 0.06 0.00 0.00 34.95 32.33 2w3s s ARG 512 CO -0.01 0.04 1.14 -1.50 -2.50 0.00 0.00 175.30 172.46 2w3s s ILE 513 N 0.72 3.40 0.21 4.11 1.10 -1.26 -0.04 121.20 129.44 2w3s s ILE 513 Ca -0.09 1.37 0.07 0.00 -0.51 0.00 0.00 60.65 61.50 2w3s s ILE 513 Cb -0.16 -3.88 -0.04 0.00 0.15 0.00 0.00 42.46 38.54 2w3s s ILE 513 CO 0.01 0.31 0.06 0.42 -2.11 0.00 0.00 174.94 173.63 2w3s s THR 514 N -1.01 3.93 0.59 4.00 -4.23 0.18 -4.89 115.64 114.21 2w3s s THR 514 Ca 0.46 -1.49 -0.20 0.00 -1.18 0.00 0.00 61.69 59.28 2w3s s THR 514 Cb -0.33 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.43 2w3s s THR 514 CO 0.42 -0.23 1.27 0.00 -0.54 0.00 0.00 174.62 175.54 2w3s n ALA 515 N -0.59 1.18 -1.82 3.99 0.00 -1.26 -4.77 120.51 117.25 2w3s n ALA 515 Ca -0.08 0.07 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 2w3s n ALA 515 Cb 0.57 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.69 2w3s n ALA 515 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2w3s s THR 516 N -1.35 2.29 -0.11 0.00 2.01 -0.97 -4.81 115.64 112.71 2w3s s THR 516 Ca 0.76 0.23 -0.04 0.00 0.31 0.00 0.00 61.69 62.94 2w3s s THR 516 Cb -0.41 -3.14 0.05 0.00 0.01 0.00 0.00 72.50 69.01 2w3s s THR 516 CO 0.46 0.03 0.21 -0.62 -0.69 0.00 0.00 174.62 174.01 2w3s s ASP 517 N 0.81 0.56 0.61 3.53 3.68 -1.26 -0.05 116.67 124.55 2w3s s ASP 517 Ca 0.67 0.46 0.35 0.00 2.13 0.00 0.00 52.55 56.16 2w3s s ASP 517 Cb -0.46 0.47 1.99 0.00 -1.45 0.00 0.00 42.92 43.47 2w3s s ASP 517 CO 0.39 -0.24 2.27 0.71 0.13 0.00 0.00 175.17 178.43 2w3s h THR 518 N 6.33 0.33 -0.16 1.71 1.35 -1.31 -0.03 112.91 121.12 2w3s h THR 518 Ca -0.14 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2w3s h THR 518 Cb 1.12 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2w3s h THR 518 CO 0.14 0.01 0.00 -1.54 -0.25 0.00 0.00 175.52 173.88 2w3s n SER 519 N -3.52 1.01 0.00 5.36 3.41 -1.26 -3.88 113.62 114.73 2w3s n SER 519 Ca -0.03 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.72 2w3s n SER 519 Cb 0.10 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.01 0.00 -3.91 4.33 5.02 -0.08 -4.96 118.16 118.55 2w3s n LYS 520 Ca 0.09 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.08 2w3s n LYS 520 Cb 0.18 -0.84 -0.16 0.00 -0.02 0.00 0.00 35.03 34.19 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 -1.96 1.40 0.41 -0.18 1.01 -0.89 -4.77 120.40 115.42 2w3s s VAL 521 Ca 0.00 -1.17 -0.14 0.00 0.00 0.00 0.00 61.98 60.67 2w3s s VAL 521 Cb 0.00 -1.72 -0.08 0.00 0.00 0.00 0.00 36.38 34.59 2w3s s VAL 521 CO 0.00 -0.14 0.82 -2.16 0.00 0.00 0.00 175.10 173.62 2w3s s PRO 522 N 1.45 3.91 -1.24 2.72 0.04 -1.25 -4.51 135.00 136.13 2w3s s PRO 522 Ca -0.04 0.68 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 2w3s s PRO 522 Cb -0.19 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.03 2w3s s PRO 522 CO -0.07 -0.03 0.97 0.09 0.04 0.00 0.00 177.00 178.00 2w3s n ASN 523 N -1.04 -2.32 -4.91 6.66 3.02 -1.26 -4.96 115.26 110.44 2w3s n ASN 523 Ca 0.04 -0.65 -0.27 0.00 -0.03 0.00 0.00 54.58 53.67 2w3s n ASN 523 Cb 0.54 -4.93 -0.01 0.00 -0.61 0.00 0.00 39.78 34.77 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 -3.41 4.93 0.56 3.41 -4.23 -1.26 -5.01 115.64 110.64 2w3s s THR 524 Ca 0.06 0.14 -0.04 0.00 -1.18 0.00 0.00 61.69 60.67 2w3s s THR 524 Cb -0.03 -3.84 0.01 0.00 1.34 0.00 0.00 72.50 69.98 2w3s s THR 524 CO 0.74 -0.73 0.85 -0.44 -0.54 0.00 0.00 174.62 174.51 2w3s s SER 525 N -3.91 5.62 0.71 3.99 0.01 -1.26 -4.58 113.70 114.27 2w3s s SER 525 Ca 0.46 0.61 -0.16 0.00 1.31 0.00 0.00 55.95 58.17 2w3s s SER 525 Cb -0.10 -1.64 0.03 0.00 0.21 0.00 0.00 66.02 64.51 2w3s s SER 525 CO 0.41 -1.00 1.27 0.00 0.41 0.00 0.00 173.24 174.32 2w3s s ALA 526 N -2.90 2.16 -0.49 1.44 0.00 -1.26 -4.90 121.76 115.81 2w3s s ALA 526 Ca 0.53 1.09 -0.29 0.00 0.00 0.00 0.00 51.96 53.29 2w3s s ALA 526 Cb -0.10 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.50 2w3s s ALA 526 CO 0.43 -1.88 1.25 0.99 0.00 0.00 0.00 175.76 176.55 2w3s s THR 527 N -1.66 4.05 0.07 0.00 2.01 -0.30 -4.88 115.64 114.93 2w3s s THR 527 Ca 0.79 1.03 -0.27 0.00 0.31 0.00 0.00 61.69 63.56 2w3s s THR 527 Cb -0.35 -4.51 0.09 0.00 0.01 0.00 0.00 72.50 67.74 2w3s s THR 527 CO 0.44 -1.03 1.15 0.00 -0.69 0.00 0.00 174.62 174.49 2w3s s ALA 528 N 4.97 -1.99 -0.75 7.40 0.00 -1.26 -4.93 121.76 125.21 2w3s s ALA 528 Ca 0.51 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.64 2w3s s ALA 528 Cb -0.09 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.66 2w3s s ALA 528 CO 0.30 -1.07 0.00 0.00 0.00 0.00 0.00 175.76 174.99 2w3s n ALA 529 N -0.62 -0.11 -2.09 0.00 0.00 -1.26 -1.59 120.51 114.84 2w3s n ALA 529 Ca -0.04 0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.34 2w3s n ALA 529 Cb 0.61 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.56 -4.95 0.07 0.00 7.64 -1.26 -4.24 113.62 110.33 2w3s n SER 530 Ca -0.07 0.20 0.11 0.00 1.01 0.00 0.00 58.87 60.12 2w3s n SER 530 Cb 0.42 -4.25 0.02 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 0.71 -0.29 6.43 3.41 -0.62 -4.53 113.62 117.13 2w3s n SER 531 Ca -0.20 0.16 -0.08 0.00 -0.26 0.00 0.00 58.87 58.50 2w3s n SER 531 Cb 0.63 0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 65.12 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 4.20 -0.50 0.88 5.00 0.00 -1.89 -1.58 103.07 109.18 2w3s h GLY 532 Ca 0.00 0.63 -0.13 0.00 0.00 0.00 0.00 47.33 47.83 2w3s h GLY 532 CO 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 176.54 176.01 2w3s h ALA 533 N 0.68 0.24 -0.26 3.60 0.00 -1.95 -2.77 119.26 118.81 2w3s h ALA 533 Ca 0.20 -0.47 0.06 0.00 0.00 0.00 0.00 54.91 54.70 2w3s h ALA 533 Cb 0.53 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 2w3s h ALA 533 CO -0.81 0.36 -0.18 -0.44 0.00 0.00 0.00 179.25 178.19 2w3s h ASP 534 N 0.17 -0.58 0.05 0.00 5.19 -1.63 0.34 116.42 119.96 2w3s h ASP 534 Ca -0.01 0.12 -0.29 0.00 -0.62 0.00 0.00 57.03 56.22 2w3s h ASP 534 Cb 1.04 0.30 -0.03 0.00 0.18 0.00 0.00 39.33 40.82 2w3s h ASP 534 CO 0.09 -0.22 -1.61 0.23 -3.12 0.00 0.00 179.24 174.61 2w3s n MET 535 N -5.34 0.65 -0.12 3.56 2.81 -0.66 -3.23 117.12 114.78 2w3s n MET 535 Ca -0.00 0.44 -0.09 0.00 -1.81 0.00 0.00 57.70 56.23 2w3s n MET 535 Cb 0.25 -1.72 -0.01 0.00 -0.71 0.00 0.00 33.22 31.02 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 -0.55 0.51 -0.98 7.83 2.35 -1.54 -0.86 115.58 122.35 2w3s h ASN 536 Ca -0.39 -0.17 0.20 0.00 -0.55 0.00 0.00 56.30 55.39 2w3s h ASN 536 Cb 1.62 -0.13 -0.19 0.00 0.05 0.00 0.00 38.32 39.67 2w3s h ASN 536 CO -0.09 0.54 -0.24 0.61 -1.65 0.00 0.00 177.43 176.60 2w3s n GLY 537 N -0.76 -1.63 0.16 2.83 0.00 0.12 -0.41 105.19 105.50 2w3s n GLY 537 Ca -0.01 1.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.92 2w3s n GLY 537 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2w3s h MET 538 N 0.00 0.48 -0.77 1.61 2.86 -1.41 -1.85 114.93 115.85 2w3s h MET 538 Ca 0.47 -0.27 0.02 0.00 -2.06 0.00 0.00 59.70 57.87 2w3s h MET 538 Cb 0.73 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.37 2w3s h MET 538 CO -1.00 0.86 0.51 0.00 1.06 0.00 0.00 176.91 178.34 2w3s h ALA 539 N 0.62 1.50 0.10 6.32 0.00 -0.15 0.10 119.26 127.75 2w3s h ALA 539 Ca 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2w3s h ALA 539 Cb 0.79 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2w3s h ALA 539 CO 0.06 0.43 -0.05 0.28 0.00 0.00 0.00 179.25 179.97 2w3s h VAL 540 N 0.99 1.10 -0.99 0.00 2.07 -0.65 -1.70 116.25 117.07 2w3s h VAL 540 Ca 0.30 -0.88 0.16 0.00 0.82 0.00 0.00 66.70 67.10 2w3s h VAL 540 Cb -0.01 1.65 -0.09 0.00 -1.52 0.00 0.00 31.29 31.31 2w3s h VAL 540 CO -0.08 0.21 0.62 0.50 0.02 0.00 0.00 177.57 178.84 2w3s h LYS 541 N -0.56 0.81 0.27 1.57 3.64 -1.13 0.16 116.57 121.34 2w3s h LYS 541 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2w3s h LYS 541 Cb 0.45 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2w3s h LYS 541 CO 0.02 0.54 -0.27 0.22 -2.27 0.00 0.00 179.45 177.69 2w3s h ASP 542 N 0.84 -0.72 0.13 4.20 3.58 -0.67 0.12 116.42 123.90 2w3s h ASP 542 Ca 0.53 0.07 0.00 0.00 0.42 0.00 0.00 57.03 58.05 2w3s h ASP 542 Cb 0.73 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 2w3s h ASP 542 CO -0.31 -0.39 -0.11 0.00 -2.88 0.00 0.00 179.24 175.55 2w3s h ALA 543 N 0.05 -0.23 -0.60 -0.78 0.00 -0.47 -2.37 119.26 114.85 2w3s h ALA 543 Ca -0.01 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.96 2w3s h ALA 543 Cb 0.53 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 2w3s h ALA 543 CO -0.06 -0.65 0.21 0.00 0.00 0.00 0.00 179.25 178.76 2w3s h GLU 545 N 0.38 0.21 -0.03 0.00 5.08 -0.68 0.58 114.58 120.12 2w3s h GLU 545 Ca 0.31 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2w3s h GLU 545 Cb 0.39 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 2w3s h GLU 545 CO -0.32 0.34 0.00 1.15 -1.00 0.00 0.00 179.01 179.18 2w3s h THR 546 N 0.20 1.22 0.41 1.13 2.02 -0.53 -0.88 112.91 116.48 2w3s h THR 546 Ca 0.04 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2w3s h THR 546 Cb 0.34 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2w3s h THR 546 CO 0.02 0.18 -0.20 -0.07 0.37 0.00 0.00 175.52 175.82 2w3s h LEU 547 N -0.21 -0.46 -1.74 2.58 3.38 -0.83 -1.98 115.31 116.05 2w3s h LEU 547 Ca 0.01 -0.02 0.27 0.00 0.09 0.00 0.00 57.88 58.23 2w3s h LEU 547 Cb 0.28 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 2w3s h LEU 547 CO 0.00 -0.28 0.70 -0.09 0.09 0.00 0.00 178.44 178.86 2w3s h ARG 548 N -0.61 0.17 -0.36 1.13 2.43 -0.89 -0.06 114.38 116.19 2w3s h ARG 548 Ca -0.06 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 58.96 2w3s h ARG 548 Cb 0.46 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2w3s h ARG 548 CO 0.09 0.11 -0.34 0.78 -1.51 0.00 0.00 179.97 179.10 2w3s h GLY 549 N 0.18 0.95 0.74 2.80 0.00 -0.51 -0.54 103.07 106.68 2w3s h GLY 549 Ca 0.51 -0.96 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2w3s h GLY 549 CO -0.11 0.87 -0.09 3.21 0.00 0.00 0.00 176.54 180.41 2w3s h ARG 550 N 0.67 -0.24 -0.95 4.80 3.08 -0.35 -1.48 114.38 119.91 2w3s h ARG 550 Ca 0.06 0.02 0.18 0.00 0.07 0.00 0.00 59.98 60.30 2w3s h ARG 550 Cb 0.93 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.95 2w3s h ARG 550 CO 0.09 0.04 0.60 -0.07 -1.07 0.00 0.00 179.97 179.56 2w3s h LEU 551 N -0.51 0.63 -0.02 3.04 3.38 -1.21 -0.38 115.31 120.23 2w3s h LEU 551 Ca -0.03 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2w3s h LEU 551 Cb 0.39 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.09 2w3s h LEU 551 CO 0.04 0.26 -0.51 0.00 0.09 0.00 0.00 178.44 178.33 2w3s h ALA 552 N 1.61 0.09 -0.72 1.53 0.00 -0.90 -2.15 119.26 118.73 2w3s h ALA 552 Ca 0.51 -0.53 0.09 0.00 0.00 0.00 0.00 54.91 54.97 2w3s h ALA 552 Cb 0.93 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 2w3s h ALA 552 CO -0.26 0.30 0.36 0.78 0.00 0.00 0.00 179.25 180.44 2w3s h GLY 553 N -0.13 1.07 0.70 0.00 0.00 -0.86 0.27 103.07 104.13 2w3s h GLY 553 Ca -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 2w3s h GLY 553 CO 0.10 0.07 -0.42 -2.75 0.00 0.00 0.00 176.54 173.54 2w3s h PHE 554 N 0.62 -1.13 -0.68 5.60 3.57 -0.99 -0.87 116.94 123.06 2w3s h PHE 554 Ca 0.35 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.90 2w3s h PHE 554 Cb 0.35 0.42 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2w3s h PHE 554 CO -0.10 -0.60 0.39 0.28 -2.23 0.00 0.00 178.31 176.05 2w3s h VAL 555 N -0.94 1.00 -0.20 1.41 2.07 -0.78 -1.45 116.25 117.35 2w3s h VAL 555 Ca -0.06 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.24 2w3s h VAL 555 Cb 0.80 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2w3s h VAL 555 CO 0.01 0.13 -0.00 0.00 0.02 0.00 0.00 177.57 177.73 2w3s h ALA 556 N 1.33 0.17 -0.37 1.67 0.00 -0.21 0.45 119.26 122.31 2w3s h ALA 556 Ca 0.29 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.27 2w3s h ALA 556 Cb 0.14 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2w3s h ALA 556 CO -0.16 -0.43 0.24 0.00 0.00 0.00 0.00 179.25 178.90 2w3s h ALA 557 N 1.17 0.47 -0.12 0.00 0.00 -0.78 0.97 119.26 120.97 2w3s h ALA 557 Ca 0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 2w3s h ALA 557 Cb 0.12 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.78 2w3s h ALA 557 CO -0.16 -0.08 -0.55 -0.09 0.00 0.00 0.00 179.25 178.37 2w3s h ARG 558 N 0.49 0.59 -0.17 0.00 1.12 -0.78 -2.70 114.38 112.93 2w3s h ARG 558 Ca 0.14 -0.47 0.00 0.00 -1.11 0.00 0.00 59.98 58.54 2w3s h ARG 558 Cb -0.04 0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.01 2w3s h ARG 558 CO -0.04 1.09 0.00 0.39 -3.11 0.00 0.00 179.97 178.31 2w3s n GLU 559 N -4.17 1.68 -3.07 0.20 -0.58 0.16 -5.00 120.64 109.86 2w3s n GLU 559 Ca -0.08 -1.02 -0.00 0.00 -0.42 0.00 0.00 57.16 55.64 2w3s n GLU 559 Cb 0.63 -1.37 -0.00 0.00 -0.57 0.00 0.00 31.44 30.12 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 1.09 -0.95 0.00 0.62 0.00 0.30 -4.96 105.19 101.29 2w3s n GLY 560 Ca 0.15 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 -2.00 2.12 0.15 0.00 0.00 -1.26 -4.37 121.76 116.40 2w3s s ALA 562 Ca 0.00 0.84 0.10 0.00 0.00 0.00 0.00 51.96 52.90 2w3s s ALA 562 Cb 0.00 -3.46 0.08 0.00 0.00 0.00 0.00 23.12 19.74 2w3s s ALA 562 CO 0.00 -1.87 1.45 0.00 0.00 0.00 0.00 175.76 175.33 2w3s h ALA 563 N -0.34 0.65 0.00 0.00 0.00 -1.94 -3.18 119.26 114.45 2w3s h ALA 563 Ca -0.47 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 53.74 2w3s h ALA 563 Cb 1.29 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2w3s h ALA 563 CO 0.50 0.96 0.00 2.89 0.00 0.00 0.00 179.25 183.60 2w3s n ARG 564 N -3.51 0.35 -0.22 0.00 1.85 -1.26 -1.94 116.66 111.94 2w3s n ARG 564 Ca -0.00 0.08 0.12 0.00 -1.00 0.00 0.00 57.85 57.05 2w3s n ARG 564 Cb 0.77 -1.50 0.24 0.00 -1.05 0.00 0.00 32.46 30.92 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 -1.22 3.48 -4.58 2.89 8.00 -1.20 -4.82 116.55 119.10 2w3s n ASP 565 Ca 0.10 -1.99 -0.41 0.00 0.71 0.00 0.00 54.79 53.21 2w3s n ASP 565 Cb 0.13 -0.29 -0.08 0.00 -0.02 0.00 0.00 41.12 40.86 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 -1.43 5.06 -0.15 2.53 1.01 -0.82 -4.18 120.40 122.43 2w3s s VAL 566 Ca 0.40 0.47 -0.06 0.00 0.00 0.00 0.00 61.98 62.80 2w3s s VAL 566 Cb 0.23 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2w3s s VAL 566 CO 0.32 -0.08 0.04 -0.63 0.00 0.00 0.00 175.10 174.75 2w3s s ILE 567 N 2.30 4.64 -0.27 2.22 1.01 0.13 -4.91 121.20 126.32 2w3s s ILE 567 Ca 0.18 -0.10 -0.03 0.00 0.00 0.00 0.00 60.65 60.70 2w3s s ILE 567 Cb -0.16 -3.04 0.02 0.00 0.01 0.00 0.00 42.46 39.29 2w3s s ILE 567 CO 0.12 0.52 -0.02 -0.36 0.00 0.00 0.00 174.94 175.20 2w3s s PHE 568 N -0.07 3.11 -0.26 3.97 0.40 -1.26 -0.02 117.98 123.84 2w3s s PHE 568 Ca 0.06 -1.43 -0.19 0.00 -0.60 0.00 0.00 56.93 54.77 2w3s s PHE 568 Cb -0.12 -2.12 0.07 0.00 0.51 0.00 0.00 43.02 41.36 2w3s s PHE 568 CO 0.01 -0.70 0.67 0.34 0.70 0.00 0.00 175.22 176.25 2w3s s ASP 569 N 1.36 -0.83 -1.47 1.36 -1.08 -0.88 -4.43 116.67 110.70 2w3s s ASP 569 Ca 0.00 1.42 -0.11 0.00 -0.52 0.00 0.00 52.55 53.35 2w3s s ASP 569 Cb -0.17 1.36 0.06 0.00 -1.46 0.00 0.00 42.92 42.70 2w3s s ASP 569 CO -0.02 -0.24 0.99 0.00 0.52 0.00 0.00 175.17 176.43 2w3s n ALA 570 N 3.66 -1.39 -0.90 3.66 0.00 -0.86 -1.81 120.51 122.87 2w3s n ALA 570 Ca -0.18 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2w3s n ALA 570 Cb 0.57 -4.37 0.00 0.00 0.00 0.00 0.00 19.45 15.66 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 -1.73 0.67 3.59 0.00 0.00 -0.48 -4.97 105.19 102.27 2w3s n GLY 571 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.30 2.13 -0.03 1.61 -1.52 -0.75 -1.34 119.66 119.46 2w3s s GLN 572 Ca 0.00 -1.26 0.07 0.00 -1.95 0.00 0.00 55.36 52.22 2w3s s GLN 572 Cb 0.00 -2.19 -0.01 0.00 -0.22 0.00 0.00 33.01 30.59 2w3s s GLN 572 CO 0.00 0.43 -0.23 0.08 -0.25 0.00 0.00 175.29 175.32 2w3s s VAL 573 N -1.77 1.85 0.02 1.09 1.01 0.24 -2.07 120.40 120.77 2w3s s VAL 573 Ca 0.26 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2w3s s VAL 573 Cb -0.09 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 2w3s s VAL 573 CO 0.16 0.52 -0.15 -1.10 0.00 0.00 0.00 175.10 174.53 2w3s s GLN 574 N -0.38 1.08 -0.19 2.72 -0.21 0.97 -1.97 119.66 121.68 2w3s s GLN 574 Ca 0.04 -0.69 -0.31 0.00 0.02 0.00 0.00 55.36 54.42 2w3s s GLN 574 Cb -0.11 -1.09 0.15 0.00 1.00 0.00 0.00 33.01 32.96 2w3s s GLN 574 CO 0.01 0.28 1.16 0.00 -2.12 0.00 0.00 175.29 174.62 2w3s s ALA 575 N -0.64 -2.02 -1.54 6.09 0.00 -0.93 0.18 121.76 122.90 2w3s s ALA 575 Ca 0.04 1.63 -0.18 0.00 0.00 0.00 0.00 51.96 53.45 2w3s s ALA 575 Cb -0.07 -0.64 0.17 0.00 0.00 0.00 0.00 23.12 22.58 2w3s s ALA 575 CO 0.01 -0.42 0.57 0.43 0.00 0.00 0.00 175.76 176.35 2w3s n SER 576 N 0.32 -2.40 -2.07 0.00 7.64 -1.26 -0.15 113.62 115.70 2w3s n SER 576 Ca -0.04 -0.87 -0.20 0.00 1.01 0.00 0.00 58.87 58.77 2w3s n SER 576 Cb 0.59 -2.04 -0.04 0.00 -1.01 0.00 0.00 64.21 61.71 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 -1.10 0.37 3.29 0.23 0.00 -1.26 -5.00 105.19 101.72 2w3s n GLY 577 Ca 0.08 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.57 1.15 0.34 1.61 1.02 0.79 -5.17 119.74 114.91 2w3s s LYS 578 Ca 0.00 -1.26 0.06 0.00 0.02 0.00 0.00 55.97 54.78 2w3s s LYS 578 Cb 0.00 -1.23 -0.07 0.00 -0.52 0.00 0.00 37.83 36.01 2w3s s LYS 578 CO 0.00 0.26 0.02 -1.54 -0.92 0.00 0.00 175.35 173.17 2w3s s SER 579 N -2.31 2.97 0.14 2.83 1.04 -1.26 -2.19 113.70 114.91 2w3s s SER 579 Ca 0.10 -1.33 -0.19 0.00 0.48 0.00 0.00 55.95 55.00 2w3s s SER 579 Cb -0.07 -0.21 0.05 0.00 0.10 0.00 0.00 66.02 65.89 2w3s s SER 579 CO 0.05 -0.49 0.50 0.26 0.98 0.00 0.00 173.24 174.53 2w3s s TRP 580 N -3.03 -0.37 0.35 5.02 0.51 -0.83 -4.95 118.94 115.63 2w3s s TRP 580 Ca 0.35 0.12 -0.27 0.00 -2.12 0.00 0.00 56.10 54.18 2w3s s TRP 580 Cb 0.08 0.40 -0.09 0.00 -0.81 0.00 0.00 33.47 33.05 2w3s s TRP 580 CO 0.16 -0.77 1.09 1.03 -0.51 0.00 0.00 176.95 177.95 2w3s s ARG 581 N -3.71 4.35 0.29 4.98 0.52 -1.26 -0.59 118.95 123.52 2w3s s ARG 581 Ca 0.02 1.69 -0.00 0.00 -0.52 0.00 0.00 55.73 56.92 2w3s s ARG 581 Cb 0.00 -2.84 0.68 0.00 0.52 0.00 0.00 34.95 33.31 2w3s s ARG 581 CO -0.12 -0.02 1.60 0.35 0.02 0.00 0.00 175.30 177.13 2w3s h PHE 582 N 3.08 0.02 -0.26 -0.53 3.57 -1.50 0.29 116.94 121.62 2w3s h PHE 582 Ca -0.48 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.07 2w3s h PHE 582 Cb 1.22 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.08 2w3s h PHE 582 CO 0.58 -0.35 0.09 0.00 -2.23 0.00 0.00 178.31 176.39 2w3s h ALA 583 N 1.89 1.67 -0.31 2.41 0.00 -1.85 -0.45 119.26 122.61 2w3s h ALA 583 Ca 0.55 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 55.19 2w3s h ALA 583 Cb 1.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2w3s h ALA 583 CO -0.82 0.26 -0.51 0.93 0.00 0.00 0.00 179.25 179.11 2w3s h GLU 584 N 0.36 0.90 -0.57 0.00 5.08 -0.82 -0.68 114.58 118.86 2w3s h GLU 584 Ca 0.09 -0.55 -0.08 0.00 -1.00 0.00 0.00 59.36 57.82 2w3s h GLU 584 Cb 0.11 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2w3s h GLU 584 CO -0.01 1.19 0.03 0.82 -1.00 0.00 0.00 179.01 180.05 2w3s h ILE 585 N 0.70 1.26 -0.69 3.13 1.08 -0.68 -0.72 117.51 121.59 2w3s h ILE 585 Ca 0.02 -1.08 -0.08 0.00 -0.39 0.00 0.00 64.86 63.34 2w3s h ILE 585 Cb 1.12 0.84 -0.03 0.00 -3.07 0.00 0.00 36.82 35.68 2w3s h ILE 585 CO 0.12 0.39 0.13 0.58 -0.69 0.00 0.00 178.15 178.68 2w3s h VAL 586 N 0.87 1.26 -0.31 1.67 2.07 -0.96 0.59 116.25 121.45 2w3s h VAL 586 Ca 0.17 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 2w3s h VAL 586 Cb 0.50 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2w3s h VAL 586 CO 0.02 0.39 0.14 0.00 0.02 0.00 0.00 177.57 178.14 2w3s h ALA 587 N 1.07 0.40 -0.75 1.67 0.00 -1.04 0.45 119.26 121.06 2w3s h ALA 587 Ca 0.21 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2w3s h ALA 587 Cb 0.42 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2w3s h ALA 587 CO 0.01 -0.02 0.28 0.00 0.00 0.00 0.00 179.25 179.52 2w3s h ALA 588 N 0.99 1.09 -0.63 0.00 0.00 -0.18 -2.38 119.26 118.14 2w3s h ALA 588 Ca 0.10 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2w3s h ALA 588 Cb 0.15 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2w3s h ALA 588 CO -0.01 0.64 0.10 0.00 0.00 0.00 0.00 179.25 179.98 2w3s h ALA 589 N 1.21 0.98 0.10 0.00 0.00 0.41 -0.91 119.26 121.06 2w3s h ALA 589 Ca 0.25 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2w3s h ALA 589 Cb 0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2w3s h ALA 589 CO -0.02 0.64 -0.24 -0.92 0.00 0.00 0.00 179.25 178.71 2w3s h TYR 590 N 0.97 -0.65 -0.11 0.00 3.20 -0.45 -1.73 116.97 118.20 2w3s h TYR 590 Ca 0.19 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.01 2w3s h TYR 590 Cb 0.42 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.96 2w3s h TYR 590 CO 0.03 -0.34 -0.26 0.52 -1.64 0.00 0.00 178.16 176.47 2w3s h MET 591 N -0.44 0.19 0.00 1.82 2.86 -1.34 0.85 114.93 118.87 2w3s h MET 591 Ca 0.03 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2w3s h MET 591 Cb 0.47 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2w3s h MET 591 CO -0.15 0.44 0.00 0.00 1.06 0.00 0.00 176.91 178.26 2w3s n ALA 592 N -2.48 2.15 -3.49 6.32 0.00 -0.35 -4.92 120.51 117.73 2w3s n ALA 592 Ca -0.01 -0.11 -0.20 0.00 0.00 0.00 0.00 53.44 53.12 2w3s n ALA 592 Cb 0.36 -1.30 0.06 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.05 -3.85 -4.09 0.00 1.74 0.29 -5.02 116.66 104.68 2w3s n ARG 593 Ca 0.13 0.72 -0.35 0.00 -0.77 0.00 0.00 57.85 57.59 2w3s n ARG 593 Cb 0.08 -5.37 -0.13 0.00 -1.02 0.00 0.00 32.46 26.01 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 -3.48 3.61 0.20 0.55 1.01 -0.72 -5.05 121.20 117.32 2w3s s ILE 594 Ca 0.22 -0.43 -0.32 0.00 0.00 0.00 0.00 60.65 60.12 2w3s s ILE 594 Cb -0.05 -2.62 -0.15 0.00 0.01 0.00 0.00 42.46 39.65 2w3s s ILE 594 CO 0.78 0.44 1.28 -0.24 0.00 0.00 0.00 174.94 177.20 2w3s n SER 595 N 4.37 1.98 -0.83 3.58 2.88 -1.26 -4.59 113.62 119.76 2w3s n SER 595 Ca -0.18 1.14 0.02 0.00 -1.33 0.00 0.00 58.87 58.52 2w3s n SER 595 Cb 0.51 -1.31 0.20 0.00 -0.75 0.00 0.00 64.21 62.87 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 2.13 3.36 -3.90 2.46 4.77 -1.26 -4.95 117.00 119.62 2w3s n LEU 596 Ca 0.14 -3.76 -0.25 0.00 -0.03 0.00 0.00 56.01 52.11 2w3s n LEU 596 Cb 0.27 -0.57 -0.17 0.00 -2.33 0.00 0.00 43.42 40.62 2w3s n LEU 596 CO 0.62 1.27 -0.43 -0.55 -1.33 0.00 0.00 177.39 176.96 2w3s s SER 597 N -2.85 1.85 -0.00 -1.43 0.15 -1.26 -1.25 113.70 108.91 2w3s s SER 597 Ca 0.41 -0.24 0.03 0.00 0.70 0.00 0.00 55.95 56.85 2w3s s SER 597 Cb 0.38 -0.71 -0.01 0.00 -1.71 0.00 0.00 66.02 63.97 2w3s s SER 597 CO -0.03 -0.10 -0.10 0.00 1.20 0.00 0.00 173.24 174.21 2w3s s ALA 598 N 1.51 0.83 0.60 5.45 0.00 -0.96 -5.02 121.76 124.18 2w3s s ALA 598 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 51.96 51.50 2w3s s ALA 598 Cb -0.13 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 22.84 2w3s s ALA 598 CO -0.05 0.20 0.85 0.95 0.00 0.00 0.00 175.76 177.71 2w3s s THR 599 N -0.30 2.51 0.06 0.00 -4.23 -1.26 -1.02 115.64 111.39 2w3s s THR 599 Ca 0.03 -0.60 -0.22 0.00 -1.18 0.00 0.00 61.69 59.73 2w3s s THR 599 Cb -0.04 -2.91 0.05 0.00 1.34 0.00 0.00 72.50 70.94 2w3s s THR 599 CO -0.00 0.00 0.52 -0.83 -0.54 0.00 0.00 174.62 173.77 2w3s s GLY 600 N -4.50 -0.43 -0.17 3.99 0.00 0.15 -3.99 107.32 102.37 2w3s s GLY 600 Ca 0.59 0.55 -0.28 0.00 0.00 0.00 0.00 44.72 45.58 2w3s s GLY 600 CO 0.40 0.25 0.74 -0.12 0.00 0.00 0.00 173.10 174.37 2w3s s PHE 601 N -2.63 -0.69 -0.05 1.90 5.36 -1.23 -0.31 117.98 120.33 2w3s s PHE 601 Ca -0.04 1.45 -0.10 0.00 -0.96 0.00 0.00 56.93 57.28 2w3s s PHE 601 Cb -0.00 0.35 0.02 0.00 -0.34 0.00 0.00 43.02 43.04 2w3s s PHE 601 CO -0.03 -0.47 0.25 -0.47 -1.46 0.00 0.00 175.22 173.04 2w3s s TYR 602 N -0.40 -0.17 -0.03 10.12 5.04 -0.19 -4.57 117.35 127.16 2w3s s TYR 602 Ca -0.05 0.36 0.01 0.00 -2.44 0.00 0.00 57.07 54.95 2w3s s TYR 602 Cb -0.03 0.06 0.02 0.00 0.35 0.00 0.00 41.96 42.37 2w3s s TYR 602 CO 0.04 -0.25 -0.01 0.00 -1.34 0.00 0.00 175.55 173.99 2w3s s ALA 603 N -0.70 0.33 0.06 3.97 0.00 -1.26 -0.61 121.76 123.55 2w3s s ALA 603 Ca -0.08 0.12 -0.31 0.00 0.00 0.00 0.00 51.96 51.69 2w3s s ALA 603 Cb -0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 23.12 22.73 2w3s s ALA 603 CO 0.02 -0.05 1.26 0.99 0.00 0.00 0.00 175.76 177.98 2w3s s THR 604 N 0.86 3.85 0.57 0.00 2.01 -0.67 -5.01 115.64 117.25 2w3s s THR 604 Ca -0.09 1.31 -0.08 0.00 0.31 0.00 0.00 61.69 63.14 2w3s s THR 604 Cb -0.12 -3.84 0.13 0.00 0.01 0.00 0.00 72.50 68.68 2w3s s THR 604 CO -0.01 0.09 0.78 -0.81 -0.69 0.00 0.00 174.62 173.97 2w3s n PRO 605 N 4.14 -0.60 -0.45 4.92 -0.04 -1.26 -4.51 135.00 137.20 2w3s n PRO 605 Ca 0.10 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.22 2w3s n PRO 605 Cb 0.45 -0.75 0.00 0.00 -0.04 0.00 0.00 33.50 33.16 2w3s n PRO 605 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2w3s n LYS 606 N -2.61 0.00 -3.17 0.54 5.02 -1.26 -4.86 118.16 111.82 2w3s n LYS 606 Ca 0.10 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 56.00 2w3s n LYS 606 Cb 0.36 -4.36 -0.05 0.00 -0.02 0.00 0.00 35.03 30.95 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 4.40 -0.30 -0.35 1.43 -1.26 -4.84 118.68 117.76 2w3s s LEU 607 Ca 0.00 1.16 -0.17 0.00 -1.03 0.00 0.00 54.13 54.10 2w3s s LEU 607 Cb 0.00 -2.95 0.19 0.00 0.03 0.00 0.00 46.19 43.46 2w3s s LEU 607 CO 0.00 0.06 1.18 -0.55 0.23 0.00 0.00 176.35 177.27 2w3s s SER 608 N 0.00 -0.20 0.08 2.29 0.15 0.12 -5.00 113.70 111.13 2w3s s SER 608 Ca 0.32 0.31 -0.26 0.00 0.70 0.00 0.00 55.95 57.02 2w3s s SER 608 Cb -0.18 1.13 0.08 0.00 -1.71 0.00 0.00 66.02 65.34 2w3s s SER 608 CO 0.17 -0.05 0.71 -1.66 1.20 0.00 0.00 173.24 173.62 2w3s s TRP 609 N 1.42 -0.49 -0.38 3.44 1.48 -1.26 0.12 118.94 123.28 2w3s s TRP 609 Ca -0.06 0.38 -0.00 0.00 -1.06 0.00 0.00 56.10 55.36 2w3s s TRP 609 Cb -0.03 0.53 0.10 0.00 -1.16 0.00 0.00 33.47 32.92 2w3s s TRP 609 CO -0.13 -0.71 0.14 0.34 -4.06 0.00 0.00 176.95 172.53 2w3s s ASP 610 N -2.46 5.07 0.28 -2.66 3.68 0.27 -4.96 116.67 115.91 2w3s s ASP 610 Ca 0.01 -2.04 -0.02 0.00 2.13 0.00 0.00 52.55 52.63 2w3s s ASP 610 Cb -0.01 -1.75 0.62 0.00 -1.45 0.00 0.00 42.92 40.33 2w3s s ASP 610 CO -0.09 -0.47 1.60 -0.09 0.13 0.00 0.00 175.17 176.24 2w3s h ARG 611 N 7.90 0.06 0.00 4.34 2.43 -1.95 0.87 114.38 128.02 2w3s h ARG 611 Ca -0.10 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.90 2w3s h ARG 611 Cb 1.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 2w3s h ARG 611 CO 0.63 0.04 -0.79 -0.07 -1.51 0.00 0.00 179.97 178.26 2w3s h LEU 612 N 0.06 0.00 -2.10 3.80 3.38 -1.96 -3.01 115.31 115.48 2w3s h LEU 612 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.49 2w3s h LEU 612 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2w3s h LEU 612 CO -0.82 0.79 0.00 0.54 0.09 0.00 0.00 178.44 179.04 2w3s n ARG 613 N -3.52 2.05 -3.61 1.13 1.74 -1.05 -4.93 116.66 108.47 2w3s n ARG 613 Ca -0.00 -1.92 -0.23 0.00 -0.77 0.00 0.00 57.85 54.93 2w3s n ARG 613 Cb 0.78 -1.40 0.04 0.00 -1.02 0.00 0.00 32.46 30.86 2w3s n ARG 613 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w3s n GLY 614 N 1.15 -0.62 2.86 -0.13 0.00 0.27 -4.88 105.19 103.84 2w3s n GLY 614 Ca 0.14 0.29 -0.15 0.00 0.00 0.00 0.00 46.02 46.30 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 -5.69 0.22 0.00 1.61 -1.52 -1.06 -4.41 119.66 108.81 2w3s s GLN 615 Ca 0.20 0.00 0.00 0.00 -1.95 0.00 0.00 55.36 53.61 2w3s s GLN 615 Cb -0.05 -0.31 0.00 0.00 -0.22 0.00 0.00 33.01 32.42 2w3s s GLN 615 CO 0.81 -0.04 0.00 0.41 -0.25 0.00 0.00 175.29 176.22 2w3s n GLY 616 N 3.57 0.86 3.13 3.09 0.00 -0.89 0.98 105.19 115.92 2w3s n GLY 616 Ca -0.20 -1.80 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.00 2.35 0.02 1.61 3.52 0.32 -3.56 118.95 121.20 2w3s s ARG 617 Ca 0.00 -2.13 0.26 0.00 -0.13 0.00 0.00 55.73 53.73 2w3s s ARG 617 Cb 0.00 -3.72 0.76 0.00 -1.56 0.00 0.00 34.95 30.43 2w3s s ARG 617 CO 0.00 -1.14 1.60 -0.35 -0.81 0.00 0.00 175.30 174.60 2w3s n PRO 618 N 4.15 0.03 -4.90 5.12 -0.04 -1.26 0.12 135.00 138.23 2w3s n PRO 618 Ca 0.02 0.01 -0.29 0.00 -0.04 0.00 0.00 63.50 63.21 2w3s n PRO 618 Cb 0.40 -1.53 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 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 -3.02 2.14 0.04 0.54 0.40 -1.26 -4.68 117.98 112.14 2w3s s PHE 619 Ca 0.12 -0.40 -0.19 0.00 -0.60 0.00 0.00 56.93 55.85 2w3s s PHE 619 Cb 0.17 -1.30 -0.16 0.00 0.51 0.00 0.00 43.02 42.24 2w3s s PHE 619 CO 0.64 0.08 1.28 1.25 0.70 0.00 0.00 175.22 179.17 2w3s h LEU 620 N 4.97 0.49 -8.26 -0.37 5.85 -1.79 -3.48 115.31 112.73 2w3s h LEU 620 Ca -0.44 -0.56 -0.10 0.00 0.84 0.00 0.00 57.88 57.61 2w3s h LEU 620 Cb 1.14 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.97 2w3s h LEU 620 CO 0.44 0.96 -0.03 -0.72 -0.34 0.00 0.00 178.44 178.75 2w3s s TYR 621 N -3.98 0.48 -0.07 1.25 -0.85 -1.26 -4.98 117.35 107.94 2w3s s TYR 621 Ca -0.14 -0.88 0.04 0.00 -0.52 0.00 0.00 57.07 55.57 2w3s s TYR 621 Cb 0.05 0.28 -0.02 0.00 0.38 0.00 0.00 41.96 42.66 2w3s s TYR 621 CO 0.78 -1.18 -0.17 -0.06 -1.52 0.00 0.00 175.55 173.41 2w3s s PHE 622 N -3.36 2.65 -0.03 -3.49 0.40 -1.26 -1.88 117.98 111.00 2w3s s PHE 622 Ca 0.23 -0.39 -0.16 0.00 -0.60 0.00 0.00 56.93 56.01 2w3s s PHE 622 Cb -0.02 -1.66 -0.05 0.00 0.51 0.00 0.00 43.02 41.80 2w3s s PHE 622 CO 0.13 0.01 0.43 0.00 0.70 0.00 0.00 175.22 176.48 2w3s s ALA 623 N -0.38 3.63 0.36 5.36 0.00 0.11 -4.89 121.76 125.95 2w3s s ALA 623 Ca 0.04 -0.21 0.07 0.00 0.00 0.00 0.00 51.96 51.86 2w3s s ALA 623 Cb -0.12 -2.47 -0.07 0.00 0.00 0.00 0.00 23.12 20.46 2w3s s ALA 623 CO 0.02 0.33 -0.01 0.71 0.00 0.00 0.00 175.76 176.81 2w3s s TYR 624 N -0.57 2.31 0.00 0.00 1.51 -1.26 -0.38 117.35 118.96 2w3s s TYR 624 Ca 0.24 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.61 2w3s s TYR 624 Cb -0.16 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.18 2w3s s TYR 624 CO 0.12 0.37 0.00 0.41 -1.11 0.00 0.00 175.55 175.34 2w3s n GLY 625 N -0.82 0.62 3.45 0.71 0.00 -1.04 -1.60 105.19 106.50 2w3s n GLY 625 Ca -0.05 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 44.72 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 -1.44 0.00 4.61 0.00 -0.33 0.28 121.76 122.88 2w3s s ALA 626 Ca 0.00 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.19 2w3s s ALA 626 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2w3s s ALA 626 CO 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 175.76 175.42 2w3s s ALA 627 N -0.69 0.20 -0.17 0.00 0.00 -0.61 -1.70 121.76 118.80 2w3s s ALA 627 Ca -0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 2w3s s ALA 627 Cb -0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2w3s s ALA 627 CO 0.05 0.02 -0.11 0.42 0.00 0.00 0.00 175.76 176.14 2w3s s ILE 628 N -0.31 3.04 -0.06 0.00 1.01 0.07 -1.03 121.20 123.91 2w3s s ILE 628 Ca -0.02 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.03 2w3s s ILE 628 Cb -0.03 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 40.11 2w3s s ILE 628 CO -0.00 0.49 -0.16 -0.89 0.00 0.00 0.00 174.94 174.38 2w3s s THR 629 N 0.84 2.90 -0.11 2.92 2.01 -0.50 -1.23 115.64 122.47 2w3s s THR 629 Ca -0.03 -0.77 0.02 0.00 0.31 0.00 0.00 61.69 61.22 2w3s s THR 629 Cb -0.15 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 2w3s s THR 629 CO 0.00 0.58 -0.20 -0.70 -0.69 0.00 0.00 174.62 173.61 2w3s s GLU 630 N -0.46 3.17 0.29 4.92 2.12 0.16 -1.41 118.70 127.49 2w3s s GLU 630 Ca 0.06 -0.80 0.06 0.00 0.36 0.00 0.00 54.97 54.64 2w3s s GLU 630 Cb -0.12 -2.43 -0.06 0.00 0.26 0.00 0.00 34.13 31.78 2w3s s GLU 630 CO 0.02 0.20 -0.03 0.14 -0.54 0.00 0.00 175.26 175.04 2w3s s VAL 631 N 0.33 1.54 0.00 3.70 -7.23 0.30 0.46 120.40 119.51 2w3s s VAL 631 Ca -0.16 -2.09 0.04 0.00 -1.81 0.00 0.00 61.98 57.96 2w3s s VAL 631 Cb -0.17 -2.52 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 2w3s s VAL 631 CO 0.08 -0.24 -0.12 0.68 -0.31 0.00 0.00 175.10 175.18 2w3s s VAL 632 N -3.08 0.95 0.01 1.32 -7.23 -0.85 -1.53 120.40 109.99 2w3s s VAL 632 Ca 0.31 -0.62 0.05 0.00 -1.81 0.00 0.00 61.98 59.91 2w3s s VAL 632 Cb 0.05 -0.81 -0.02 0.00 0.56 0.00 0.00 36.38 36.16 2w3s s VAL 632 CO 0.12 0.19 -0.16 0.27 -0.31 0.00 0.00 175.10 175.21 2w3s s ILE 633 N -0.43 1.25 -0.28 -0.62 -4.36 0.07 -2.02 121.20 114.82 2w3s s ILE 633 Ca 0.03 -0.80 -0.26 0.00 -0.26 0.00 0.00 60.65 59.36 2w3s s ILE 633 Cb -0.05 -1.07 0.01 0.00 1.25 0.00 0.00 42.46 42.60 2w3s s ILE 633 CO -0.00 0.25 0.92 -0.62 0.24 0.00 0.00 174.94 175.74 2w3s s ASP 634 N -0.63 6.86 0.54 4.36 2.15 0.70 -1.80 116.67 128.85 2w3s s ASP 634 Ca 0.05 1.00 0.32 0.00 0.43 0.00 0.00 52.55 54.36 2w3s s ASP 634 Cb -0.07 -2.48 1.37 0.00 -0.30 0.00 0.00 42.92 41.45 2w3s s ASP 634 CO 0.00 -0.67 1.99 0.03 -0.17 0.00 0.00 175.17 176.36 2w3s h ARG 635 N 7.86 0.00 0.23 4.34 3.08 -0.41 -1.55 114.38 127.93 2w3s h ARG 635 Ca -0.22 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.49 2w3s h ARG 635 Cb 1.08 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.16 2w3s h ARG 635 CO 0.94 0.06 -1.61 -0.07 -1.07 0.00 0.00 179.97 178.22 2w3s h LEU 636 N 0.00 0.76 0.00 3.04 3.38 -1.92 -3.43 115.31 117.14 2w3s h LEU 636 Ca -0.00 -0.93 -0.01 0.00 0.09 0.00 0.00 57.88 57.03 2w3s h LEU 636 Cb 0.50 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2w3s h LEU 636 CO 0.01 1.75 -1.10 0.35 0.09 0.00 0.00 178.44 179.54 2w3s n THR 637 N -3.66 0.03 0.00 0.22 -2.24 -1.21 -5.02 114.28 102.40 2w3s n THR 637 Ca -0.20 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2w3s n THR 637 Cb 1.10 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 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 2.49 2.97 3.43 3.38 0.00 -0.59 -4.46 105.19 112.42 2w3s n GLY 638 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.95 0.43 -3.83 1.61 1.02 -1.26 -4.48 120.64 113.18 2w3s n GLU 639 Ca 0.00 0.15 -0.09 0.00 -0.02 0.00 0.00 57.16 57.21 2w3s n GLU 639 Cb 0.00 -1.32 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 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 -0.90 -0.24 -0.10 1.62 2.20 -1.26 -0.21 114.94 116.04 2w3s s ASN 640 Ca 0.62 -0.61 -0.20 0.00 -0.94 0.00 0.00 52.86 51.73 2w3s s ASN 640 Cb -0.73 0.64 0.05 0.00 -2.00 0.00 0.00 41.25 39.21 2w3s s ASN 640 CO 0.59 -1.19 0.49 -0.60 -2.94 0.00 0.00 177.10 173.44 2w3s s ARG 641 N -3.92 0.72 -0.38 3.55 3.52 -0.86 -5.01 118.95 116.57 2w3s s ARG 641 Ca 0.13 0.32 -0.25 0.00 -0.13 0.00 0.00 55.73 55.79 2w3s s ARG 641 Cb -0.03 0.34 0.02 0.00 -1.56 0.00 0.00 34.95 33.72 2w3s s ARG 641 CO 0.03 -0.17 0.91 0.42 -0.81 0.00 0.00 175.30 175.69 2w3s s ILE 642 N -0.57 4.58 -0.02 4.11 1.01 -1.26 -2.00 121.20 127.05 2w3s s ILE 642 Ca -0.07 1.09 -0.18 0.00 0.00 0.00 0.00 60.65 61.49 2w3s s ILE 642 Cb -0.03 -4.34 -0.33 0.00 0.01 0.00 0.00 42.46 37.77 2w3s s ILE 642 CO 0.04 -0.57 0.88 -0.07 0.00 0.00 0.00 174.94 175.22 2w3s h LEU 643 N 10.12 0.64 -7.09 2.97 3.38 -0.32 -3.15 115.31 121.86 2w3s h LEU 643 Ca -0.23 -0.93 -0.04 0.00 0.09 0.00 0.00 57.88 56.77 2w3s h LEU 643 Cb 1.08 -0.21 -0.23 0.00 0.09 0.00 0.00 40.66 41.39 2w3s h LEU 643 CO 0.98 1.59 -0.09 -0.60 0.09 0.00 0.00 178.44 180.42 2w3s s ARG 644 N -2.52 0.61 -0.02 1.13 3.52 -0.94 -1.74 118.95 118.98 2w3s s ARG 644 Ca -0.12 1.01 0.06 0.00 -0.13 0.00 0.00 55.73 56.54 2w3s s ARG 644 Cb 0.03 0.13 -0.01 0.00 -1.56 0.00 0.00 34.95 33.54 2w3s s ARG 644 CO 0.88 -0.14 -0.19 0.99 -0.81 0.00 0.00 175.30 176.02 2w3s s THR 645 N 1.29 1.55 -0.11 4.11 2.01 -0.22 0.38 115.64 124.65 2w3s s THR 645 Ca -0.08 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.10 2w3s s THR 645 Cb -0.06 -1.29 0.02 0.00 0.01 0.00 0.00 72.50 71.18 2w3s s THR 645 CO -0.13 0.44 -0.10 -1.81 -0.69 0.00 0.00 174.62 172.33 2w3s s ASP 646 N -0.36 2.18 -0.10 3.53 1.01 -0.37 -1.24 116.67 121.32 2w3s s ASP 646 Ca 0.05 -0.33 0.03 0.00 0.71 0.00 0.00 52.55 53.01 2w3s s ASP 646 Cb -0.08 -0.89 0.01 0.00 1.01 0.00 0.00 42.92 42.96 2w3s s ASP 646 CO -0.00 -0.08 -0.20 -0.63 0.21 0.00 0.00 175.17 174.48 2w3s s ILE 647 N 1.46 1.76 -0.19 0.77 1.01 0.16 -0.75 121.20 125.42 2w3s s ILE 647 Ca 0.01 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.81 2w3s s ILE 647 Cb -0.13 -1.56 0.00 0.00 0.01 0.00 0.00 42.46 40.78 2w3s s ILE 647 CO -0.06 0.49 -0.11 -0.22 0.00 0.00 0.00 174.94 175.04 2w3s s LEU 648 N 0.60 2.60 0.03 2.97 2.96 -0.69 0.64 118.68 127.79 2w3s s LEU 648 Ca -0.14 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.33 2w3s s LEU 648 Cb -0.17 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 44.88 2w3s s LEU 648 CO 0.04 0.01 -0.10 -2.28 -1.32 0.00 0.00 176.35 172.71 2w3s s HIS 649 N 1.25 0.85 -0.37 5.38 5.65 0.19 -1.19 115.29 127.05 2w3s s HIS 649 Ca 0.03 -0.33 -0.15 0.00 0.25 0.00 0.00 55.06 54.85 2w3s s HIS 649 Cb -0.14 -0.51 -0.00 0.00 -1.18 0.00 0.00 32.58 30.75 2w3s s HIS 649 CO -0.05 -0.02 0.36 0.34 -0.65 0.00 0.00 174.74 174.73 2w3s s ASP 650 N -1.02 6.17 -0.16 9.88 2.15 -0.63 0.12 116.67 133.18 2w3s s ASP 650 Ca -0.02 -0.41 0.17 0.00 0.43 0.00 0.00 52.55 52.72 2w3s s ASP 650 Cb -0.07 -2.19 0.45 0.00 -0.30 0.00 0.00 42.92 40.80 2w3s s ASP 650 CO 0.01 -0.40 1.34 0.00 -0.17 0.00 0.00 175.17 175.95 2w3s n ALA 651 N 5.39 2.76 -0.98 3.66 0.00 -1.25 -4.33 120.51 125.76 2w3s n ALA 651 Ca -0.09 -2.33 0.00 0.00 0.00 0.00 0.00 53.44 51.02 2w3s n ALA 651 Cb 0.49 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 -0.72 3.02 3.45 0.00 0.00 -1.26 -1.31 105.19 108.37 2w3s n GLY 652 Ca 0.19 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.98 3.62 0.15 4.61 0.00 0.38 -3.00 121.76 125.54 2w3s s ALA 653 Ca 0.00 -3.00 -0.24 0.00 0.00 0.00 0.00 51.96 48.72 2w3s s ALA 653 Cb 0.00 -4.03 -0.14 0.00 0.00 0.00 0.00 23.12 18.94 2w3s s ALA 653 CO 0.00 -2.87 0.48 0.45 0.00 0.00 0.00 175.76 173.83 2w3s n SER 654 N 6.06 -0.92 0.22 0.00 2.88 -1.14 -3.34 113.62 117.38 2w3s n SER 654 Ca 0.27 0.94 0.11 0.00 -1.33 0.00 0.00 58.87 58.87 2w3s n SER 654 Cb 0.47 -0.79 0.38 0.00 -0.75 0.00 0.00 64.21 63.52 2w3s n SER 654 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2w3s h LEU 655 N 1.02 0.00 -5.80 2.46 3.38 -1.91 -3.38 115.31 111.08 2w3s h LEU 655 Ca -0.25 0.00 0.13 0.00 0.09 0.00 0.00 57.88 57.84 2w3s h LEU 655 Cb 1.19 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.76 2w3s h LEU 655 CO 0.48 0.15 -0.15 0.21 0.09 0.00 0.00 178.44 179.22 2w3s s ASN 656 N -6.10 -0.74 0.31 -0.43 3.84 -1.26 0.46 114.94 111.01 2w3s s ASN 656 Ca 0.03 -0.08 -0.01 0.00 0.21 0.00 0.00 52.86 53.01 2w3s s ASN 656 Cb 0.08 1.27 0.48 0.00 -0.55 0.00 0.00 41.25 42.53 2w3s s ASN 656 CO 0.64 -0.12 1.96 -0.65 -2.79 0.00 0.00 177.10 176.14 2w3s h PRO 657 N 6.90 1.04 -0.61 0.43 0.11 -1.79 -1.18 132.00 136.89 2w3s h PRO 657 Ca -0.05 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2w3s h PRO 657 Cb 1.19 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 2w3s h PRO 657 CO -0.02 0.69 0.40 0.00 -0.21 0.00 0.00 178.00 178.86 2w3s h ALA 658 N 1.50 0.78 0.00 -0.75 0.00 -1.86 -0.88 119.26 118.05 2w3s h ALA 658 Ca 0.31 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 2w3s h ALA 658 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2w3s h ALA 658 CO -0.08 0.22 -0.50 -0.07 0.00 0.00 0.00 179.25 178.83 2w3s h LEU 659 N 0.83 0.00 0.08 0.00 3.38 -1.54 -2.53 115.31 115.54 2w3s h LEU 659 Ca 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 2w3s h LEU 659 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2w3s h LEU 659 CO -0.05 0.50 -0.04 0.44 0.09 0.00 0.00 178.44 179.38 2w3s h ASP 660 N 0.00 -0.09 -1.03 -0.43 5.19 -0.96 -1.36 116.42 117.74 2w3s h ASP 660 Ca -0.00 -0.47 0.28 0.00 -0.62 0.00 0.00 57.03 56.21 2w3s h ASP 660 Cb 0.91 0.02 -0.12 0.00 0.18 0.00 0.00 39.33 40.32 2w3s h ASP 660 CO 0.06 0.58 0.62 0.40 -3.12 0.00 0.00 179.24 177.78 2w3s h ILE 661 N -0.91 0.46 -0.34 0.35 1.08 -1.23 0.44 117.51 117.35 2w3s h ILE 661 Ca -0.01 -0.16 -0.07 0.00 -0.39 0.00 0.00 64.86 64.23 2w3s h ILE 661 Cb 0.56 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 2w3s h ILE 661 CO 0.02 0.08 -0.05 1.23 -0.69 0.00 0.00 178.15 178.74 2w3s h GLY 662 N 0.46 0.69 1.34 5.37 0.00 -1.37 -0.26 103.07 109.30 2w3s h GLY 662 Ca 0.66 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 2w3s h GLY 662 CO -0.47 0.50 0.35 1.46 0.00 0.00 0.00 176.54 178.38 2w3s h GLN 663 N 0.43 0.87 0.14 4.80 1.08 0.12 -1.94 115.11 120.60 2w3s h GLN 663 Ca 0.09 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 2w3s h GLN 663 Cb 0.53 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2w3s h GLN 663 CO 0.03 0.64 -0.07 0.82 -0.95 0.00 0.00 178.83 179.30 2w3s h ILE 664 N 0.88 1.01 -0.71 2.54 2.04 -0.77 0.22 117.51 122.71 2w3s h ILE 664 Ca 0.22 -1.09 0.16 0.00 1.00 0.00 0.00 64.86 65.15 2w3s h ILE 664 Cb 0.02 1.64 -0.11 0.00 -0.74 0.00 0.00 36.82 37.63 2w3s h ILE 664 CO -0.04 0.24 0.10 -0.33 0.00 0.00 0.00 178.15 178.12 2w3s h GLU 665 N -0.75 0.19 -0.03 2.37 5.08 -0.99 0.16 114.58 120.61 2w3s h GLU 665 Ca -0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2w3s h GLU 665 Cb 0.53 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 2w3s h GLU 665 CO 0.03 0.13 -0.02 0.78 -1.00 0.00 0.00 179.01 178.93 2w3s h GLY 666 N 0.20 0.07 0.94 -3.84 0.00 -1.34 -2.59 103.07 96.51 2w3s h GLY 666 Ca 0.39 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.68 2w3s h GLY 666 CO -0.54 0.06 0.39 0.00 0.00 0.00 0.00 176.54 176.45 2w3s h ALA 667 N 0.59 0.79 -0.40 3.60 0.00 -0.38 -1.76 119.26 121.71 2w3s h ALA 667 Ca 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2w3s h ALA 667 Cb 0.45 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2w3s h ALA 667 CO 0.00 0.17 0.21 -0.92 0.00 0.00 0.00 179.25 178.71 2w3s h TYR 668 N 0.79 0.38 0.00 0.00 3.20 -0.66 0.25 116.97 120.93 2w3s h TYR 668 Ca 0.24 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 2w3s h TYR 668 Cb -0.04 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2w3s h TYR 668 CO -0.04 0.21 -0.20 0.28 -1.64 0.00 0.00 178.16 176.77 2w3s h VAL 669 N 0.42 0.89 0.18 1.81 2.07 -1.03 -1.01 116.25 119.58 2w3s h VAL 669 Ca 0.17 -0.74 -0.32 0.00 0.82 0.00 0.00 66.70 66.63 2w3s h VAL 669 Cb 0.06 1.43 0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2w3s h VAL 669 CO -0.11 0.19 -1.50 -0.61 0.02 0.00 0.00 177.57 175.56 2w3s h GLN 670 N 0.00 0.38 -0.35 1.57 4.15 -0.37 -2.05 115.11 118.44 2w3s h GLN 670 Ca -0.00 -0.66 -0.14 0.00 0.77 0.00 0.00 58.65 58.62 2w3s h GLN 670 Cb 0.41 0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 2w3s h GLN 670 CO 0.03 1.29 -0.32 0.78 -1.93 0.00 0.00 178.83 178.68 2w3s h GLY 671 N 0.95 0.92 1.02 2.39 0.00 -0.30 -2.01 103.07 106.03 2w3s h GLY 671 Ca -0.25 -0.92 -0.05 0.00 0.00 0.00 0.00 47.33 46.11 2w3s h GLY 671 CO 0.21 0.83 0.20 0.00 0.00 0.00 0.00 176.54 177.78 2w3s h ALA 672 N 0.75 0.83 -0.50 3.60 0.00 -1.30 -2.93 119.26 119.71 2w3s h ALA 672 Ca 0.06 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2w3s h ALA 672 Cb 0.90 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 2w3s h ALA 672 CO 0.08 0.50 0.21 0.78 0.00 0.00 0.00 179.25 180.82 2w3s h GLY 673 N 0.92 0.69 0.12 0.00 0.00 -1.19 -1.83 103.07 101.78 2w3s h GLY 673 Ca 0.20 -0.13 0.21 0.00 0.00 0.00 0.00 47.33 47.61 2w3s h GLY 673 CO -0.01 0.05 0.62 -0.25 0.00 0.00 0.00 176.54 176.95 2w3s h TRP 674 N 0.41 0.90 -0.56 5.60 7.01 -1.19 -1.72 115.95 126.41 2w3s h TRP 674 Ca 0.24 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.26 2w3s h TRP 674 Cb 0.21 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 27.00 2w3s h TRP 674 CO -0.14 0.19 0.00 1.28 -2.79 0.00 0.00 178.44 176.98 2w3s n LEU 675 N -4.70 3.70 0.00 0.65 4.77 -0.75 -4.60 117.00 116.07 2w3s n LEU 675 Ca 0.23 -1.77 0.00 0.00 -0.03 0.00 0.00 56.01 54.44 2w3s n LEU 675 Cb 0.65 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2w3s n LEU 675 CO 0.24 0.87 0.00 0.35 -1.33 0.00 0.00 177.39 177.51 2w3s n THR 676 N 1.54 0.00 0.88 -5.08 -2.24 -0.68 -0.57 114.28 108.13 2w3s n THR 676 Ca 0.22 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.10 2w3s n THR 676 Cb 0.61 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.56 2w3s n THR 676 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2w3s n THR 677 N -0.77 0.03 -2.89 4.28 -2.24 -1.06 -1.95 114.28 109.68 2w3s n THR 677 Ca 0.00 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.29 2w3s n THR 677 Cb 0.00 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 2w3s n THR 677 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2w3s s GLU 678 N -3.06 3.67 -0.04 -0.78 2.02 -0.99 -4.14 118.70 115.38 2w3s s GLU 678 Ca 0.07 0.28 0.01 0.00 0.02 0.00 0.00 54.97 55.35 2w3s s GLU 678 Cb 0.16 -3.85 0.02 0.00 0.10 0.00 0.00 34.13 30.56 2w3s s GLU 678 CO 0.82 -1.00 -0.03 -2.00 0.02 0.00 0.00 175.26 173.07 2w3s s GLU 679 N 3.36 0.65 -0.12 1.61 2.12 -1.26 -4.73 118.70 120.33 2w3s s GLU 679 Ca 0.34 -0.05 -0.12 0.00 0.36 0.00 0.00 54.97 55.51 2w3s s GLU 679 Cb -0.12 -0.71 -0.05 0.00 0.26 0.00 0.00 34.13 33.51 2w3s s GLU 679 CO 0.20 -0.10 0.26 -0.51 -0.54 0.00 0.00 175.26 174.57 2w3s s LEU 680 N 0.94 4.34 -0.06 2.70 1.43 -1.26 -4.85 118.68 121.92 2w3s s LEU 680 Ca -0.11 0.57 0.01 0.00 -1.03 0.00 0.00 54.13 53.57 2w3s s LEU 680 Cb -0.14 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.80 2w3s s LEU 680 CO -0.00 0.25 -0.06 -0.69 0.23 0.00 0.00 176.35 176.08 2w3s s VAL 681 N -0.34 0.68 0.02 -1.59 1.01 -1.26 -5.01 120.40 113.91 2w3s s VAL 681 Ca 0.17 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.00 2w3s s VAL 681 Cb -0.13 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 2w3s s VAL 681 CO 0.05 0.27 -0.03 0.26 0.00 0.00 0.00 175.10 175.65 2w3s s TRP 682 N 1.06 2.96 0.58 5.22 0.51 -1.26 0.90 118.94 128.90 2w3s s TRP 682 Ca -0.09 -0.00 -0.07 0.00 -2.12 0.00 0.00 56.10 53.82 2w3s s TRP 682 Cb -0.14 -1.60 0.13 0.00 -0.81 0.00 0.00 33.47 31.04 2w3s s TRP 682 CO -0.01 0.43 0.79 -0.40 -0.51 0.00 0.00 176.95 177.25 2w3s n ASP 683 N 1.27 0.37 -0.17 2.95 5.68 0.10 -4.88 116.55 121.86 2w3s n ASP 683 Ca -0.14 -1.47 0.22 0.00 -0.50 0.00 0.00 54.79 52.90 2w3s n ASP 683 Cb 0.52 -0.57 0.62 0.00 -1.14 0.00 0.00 41.12 40.55 2w3s n ASP 683 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2w3s h HIS 684 N -1.14 0.25 0.00 2.11 2.07 -2.01 -0.21 115.15 116.22 2w3s h HIS 684 Ca -0.26 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 2w3s h HIS 684 Cb 0.78 -0.08 0.00 0.00 2.57 0.00 0.00 27.41 30.68 2w3s h HIS 684 CO 0.00 0.07 -0.06 0.00 -3.07 0.00 0.00 177.93 174.87 2w3s n GLY 686 N 1.41 0.64 3.77 0.00 0.00 -0.09 -4.23 105.19 106.68 2w3s n GLY 686 Ca 0.06 -0.07 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.39 4.26 -0.32 1.61 0.52 -1.26 -4.57 118.95 118.79 2w3s s ARG 687 Ca 0.00 1.95 -0.23 0.00 -0.52 0.00 0.00 55.73 56.93 2w3s s ARG 687 Cb 0.00 -2.90 0.00 0.00 0.52 0.00 0.00 34.95 32.58 2w3s s ARG 687 CO 0.00 -0.18 0.78 -1.17 0.02 0.00 0.00 175.30 174.75 2w3s s LEU 688 N -2.08 4.10 0.22 2.53 2.96 -1.26 -0.72 118.68 124.43 2w3s s LEU 688 Ca 0.52 0.57 0.10 0.00 -0.22 0.00 0.00 54.13 55.10 2w3s s LEU 688 Cb -0.34 -3.05 0.16 0.00 0.50 0.00 0.00 46.19 43.46 2w3s s LEU 688 CO 0.43 -0.64 1.49 0.24 -1.32 0.00 0.00 176.35 176.56 2w3s h MET 689 N 8.22 0.00 -3.43 1.98 2.86 0.17 -3.38 114.93 121.35 2w3s h MET 689 Ca -0.25 0.00 -0.78 0.00 -2.06 0.00 0.00 59.70 56.61 2w3s h MET 689 Cb 1.10 0.00 -0.29 0.00 0.06 0.00 0.00 31.60 32.46 2w3s h MET 689 CO 0.89 0.74 0.39 0.25 1.06 0.00 0.00 176.91 180.24 2w3s n THR 690 N -3.62 4.37 -0.73 2.22 -2.24 -1.21 -4.80 114.28 108.27 2w3s n THR 690 Ca -0.01 -5.40 0.07 0.00 -2.27 0.00 0.00 64.05 56.45 2w3s n THR 690 Cb 0.73 -2.49 0.16 0.00 -2.10 0.00 0.00 70.33 66.63 2w3s n THR 690 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w3s n HIS 691 N 2.43 0.41 -3.71 4.78 1.44 -1.26 -4.76 115.22 114.54 2w3s n HIS 691 Ca 0.24 -0.80 -0.11 0.00 -2.01 0.00 0.00 57.72 55.04 2w3s n HIS 691 Cb 0.38 -0.17 -0.06 0.00 0.12 0.00 0.00 29.99 30.25 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 -2.26 -0.79 0.58 1.59 0.00 -1.26 -3.88 121.76 115.75 2w3s s ALA 692 Ca 0.29 0.03 0.28 0.00 0.00 0.00 0.00 51.96 52.56 2w3s s ALA 692 Cb 0.23 0.41 1.63 0.00 0.00 0.00 0.00 23.12 25.39 2w3s s ALA 692 CO 0.07 -0.48 2.10 -1.00 0.00 0.00 0.00 175.76 176.46 2w3s h PRO 693 N 2.96 0.00 -0.96 0.00 0.13 -1.97 0.26 132.00 132.43 2w3s h PRO 693 Ca -0.32 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 65.02 2w3s h PRO 693 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2w3s h PRO 693 CO 0.46 0.00 0.62 1.03 -0.23 0.00 0.00 178.00 179.88 2w3s h SER 694 N 0.00 0.52 0.00 1.44 0.87 -2.02 -3.32 113.55 111.04 2w3s h SER 694 Ca 0.09 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2w3s h SER 694 Cb 0.47 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2w3s h SER 694 CO -0.00 0.18 -0.06 0.35 -0.53 0.00 0.00 176.83 176.77 2w3s n THR 695 N -4.59 0.00 -3.80 2.23 -2.24 0.48 -4.94 114.28 101.41 2w3s n THR 695 Ca 0.21 -0.37 -0.37 0.00 -2.27 0.00 0.00 64.05 61.26 2w3s n THR 695 Cb 0.70 0.95 -0.13 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.85 3.13 -0.88 4.78 5.04 0.63 -4.84 117.35 124.35 2w3s s TYR 696 Ca 0.00 -1.08 -0.11 0.00 -2.44 0.00 0.00 57.07 53.44 2w3s s TYR 696 Cb 0.00 -2.22 0.23 0.00 0.35 0.00 0.00 41.96 40.32 2w3s s TYR 696 CO 0.00 -0.60 0.82 0.15 -1.34 0.00 0.00 175.55 174.58 2w3s s LYS 697 N 1.47 3.62 0.65 4.97 3.01 -1.26 -4.42 119.74 127.78 2w3s s LYS 697 Ca 0.02 -2.72 -0.12 0.00 -1.01 0.00 0.00 55.97 52.14 2w3s s LYS 697 Cb -0.17 -4.35 -0.02 0.00 -1.01 0.00 0.00 37.83 32.28 2w3s s LYS 697 CO 0.01 -1.26 1.04 0.96 0.51 0.00 0.00 175.35 176.61 2w3s s ILE 698 N -0.33 4.25 0.28 2.17 -4.36 -1.26 -3.38 121.20 118.56 2w3s s ILE 698 Ca 0.22 0.80 -0.30 0.00 -0.26 0.00 0.00 60.65 61.11 2w3s s ILE 698 Cb -0.11 -3.56 -0.13 0.00 1.25 0.00 0.00 42.46 39.91 2w3s s ILE 698 CO -0.08 -0.89 1.32 -2.65 0.24 0.00 0.00 174.94 172.87 2w3s n PRO 699 N -2.76 1.97 -3.31 0.37 -0.02 -1.26 -4.99 135.00 125.00 2w3s n PRO 699 Ca 0.07 0.70 -0.19 0.00 -2.02 0.00 0.00 63.50 62.05 2w3s n PRO 699 Cb 0.54 -2.29 -0.01 0.00 -0.02 0.00 0.00 33.50 31.72 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 -0.54 4.32 0.23 3.55 0.00 -1.26 -4.97 121.76 123.09 2w3s s ALA 700 Ca 0.63 -1.79 -0.14 0.00 0.00 0.00 0.00 51.96 50.66 2w3s s ALA 700 Cb -0.63 -1.29 0.29 0.00 0.00 0.00 0.00 23.12 21.49 2w3s s ALA 700 CO 0.55 -0.30 1.58 0.35 0.00 0.00 0.00 175.76 177.94 2w3s h PHE 701 N 0.79 -0.64 0.00 0.00 3.57 -2.00 0.12 116.94 118.78 2w3s h PHE 701 Ca -0.40 0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.18 2w3s h PHE 701 Cb 1.28 0.40 0.00 0.00 2.79 0.00 0.00 35.95 40.42 2w3s h PHE 701 CO 0.48 -0.37 0.00 -1.13 -2.23 0.00 0.00 178.31 175.06 2w3s n SER 702 N -5.51 0.05 0.17 0.41 3.41 -1.26 -3.18 113.62 107.71 2w3s n SER 702 Ca 0.10 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.35 2w3s n SER 702 Cb 0.40 -0.52 0.59 0.00 -0.26 0.00 0.00 64.21 64.42 2w3s n SER 702 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2w3s h ASP 703 N 0.00 0.00 -4.06 4.04 3.32 -1.12 -3.45 116.42 115.15 2w3s h ASP 703 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2w3s h ASP 703 Cb 0.45 0.00 0.14 0.00 0.22 0.00 0.00 39.33 40.14 2w3s h ASP 703 CO 0.00 0.00 0.58 0.00 -1.72 0.00 0.00 179.24 178.10 2w3s s ARG 704 N -3.47 3.06 0.14 3.56 1.70 -1.19 -4.69 118.95 118.06 2w3s s ARG 704 Ca 0.02 2.17 -0.35 0.00 -0.47 0.00 0.00 55.73 57.11 2w3s s ARG 704 Cb 0.09 -2.18 -0.15 0.00 -0.57 0.00 0.00 34.95 32.14 2w3s s ARG 704 CO 0.38 -1.23 1.47 -2.30 -1.08 0.00 0.00 175.30 172.54 2w3s n PRO 705 N -1.18 1.77 -0.28 3.89 -0.02 -1.26 -4.87 135.00 133.05 2w3s n PRO 705 Ca 0.11 0.64 -0.04 0.00 -2.02 0.00 0.00 63.50 62.19 2w3s n PRO 705 Cb 0.46 -2.34 0.07 0.00 -0.02 0.00 0.00 33.50 31.66 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 5.22 1.04 -5.13 -0.52 2.47 -1.42 -3.34 114.38 112.70 2w3s h ARG 706 Ca -0.46 -0.08 -0.66 0.00 -1.26 0.00 0.00 59.98 57.53 2w3s h ARG 706 Cb 1.29 -0.23 -0.28 0.00 -1.65 0.00 0.00 29.97 29.10 2w3s h ARG 706 CO 0.83 0.71 -0.75 0.42 0.56 0.00 0.00 179.97 181.74 2w3s s ILE 707 N -6.07 3.13 -0.38 2.04 1.01 -0.71 -5.02 121.20 115.21 2w3s s ILE 707 Ca -0.13 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 59.93 2w3s s ILE 707 Cb 0.15 -2.38 0.13 0.00 0.01 0.00 0.00 42.46 40.37 2w3s s ILE 707 CO 0.79 0.47 0.19 0.12 0.00 0.00 0.00 174.94 176.51 2w3s s PHE 708 N 1.02 1.52 -0.33 3.97 5.99 -1.26 -1.06 117.98 127.83 2w3s s PHE 708 Ca -0.01 -1.97 -0.10 0.00 0.00 0.00 0.00 56.93 54.86 2w3s s PHE 708 Cb -0.15 -1.56 0.01 0.00 0.00 0.00 0.00 43.02 41.33 2w3s s PHE 708 CO -0.01 -0.82 0.16 -0.80 -0.00 0.00 0.00 175.22 173.75 2w3s s ASN 709 N 0.95 5.57 -0.11 6.13 0.01 -0.37 -5.02 114.94 122.09 2w3s s ASN 709 Ca 0.15 -0.74 0.01 0.00 -0.71 0.00 0.00 52.86 51.57 2w3s s ASN 709 Cb -0.22 -1.99 -0.02 0.00 0.41 0.00 0.00 41.25 39.43 2w3s s ASN 709 CO -0.08 -0.27 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.41 2w3s s VAL 710 N 1.57 3.01 0.07 1.60 1.01 -1.26 0.40 120.40 126.80 2w3s s VAL 710 Ca 0.03 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.35 2w3s s VAL 710 Cb -0.18 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 2w3s s VAL 710 CO 0.06 0.54 -0.09 0.00 0.00 0.00 0.00 175.10 175.61 2w3s s ALA 711 N 0.16 0.82 -0.14 5.51 0.00 0.21 -4.95 121.76 123.36 2w3s s ALA 711 Ca -0.08 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 50.84 2w3s s ALA 711 Cb -0.15 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 2w3s s ALA 711 CO 0.05 -0.05 0.05 -0.51 0.00 0.00 0.00 175.76 175.31 2w3s s LEU 712 N -2.06 3.82 -0.47 0.00 1.43 -1.26 -0.64 118.68 119.51 2w3s s LEU 712 Ca -0.02 0.16 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 2w3s s LEU 712 Cb -0.06 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.26 2w3s s LEU 712 CO -0.01 0.27 1.17 0.86 0.23 0.00 0.00 176.35 178.87 2w3s s TRP 713 N -0.21 2.78 -0.91 0.29 -0.11 0.33 -4.84 118.94 116.26 2w3s s TRP 713 Ca 0.07 0.72 -0.12 0.00 1.22 0.00 0.00 56.10 57.99 2w3s s TRP 713 Cb -0.12 -4.42 0.24 0.00 -1.50 0.00 0.00 33.47 27.67 2w3s s TRP 713 CO 0.01 -1.34 0.86 0.34 -4.62 0.00 0.00 176.95 172.21 2w3s s ASP 714 N 2.60 6.86 -0.14 5.86 2.15 -1.26 -3.85 116.67 128.88 2w3s s ASP 714 Ca 0.49 -3.01 -0.06 0.00 0.43 0.00 0.00 52.55 50.40 2w3s s ASP 714 Cb -0.08 -2.19 0.07 0.00 -0.30 0.00 0.00 42.92 40.42 2w3s s ASP 714 CO 0.32 -0.46 0.31 -1.58 -0.17 0.00 0.00 175.17 173.58 2w3s s GLN 715 N -0.34 0.22 0.56 4.34 0.74 -1.16 -4.98 119.66 119.04 2w3s s GLN 715 Ca 0.22 0.78 -0.20 0.00 0.05 0.00 0.00 55.36 56.21 2w3s s GLN 715 Cb -0.10 0.03 -0.05 0.00 1.10 0.00 0.00 33.01 33.99 2w3s s GLN 715 CO -0.09 -0.24 1.18 -0.35 -0.55 0.00 0.00 175.29 175.24 2w3s n PRO 716 N 5.05 1.31 -2.08 1.67 -0.04 -1.26 -3.56 135.00 136.09 2w3s n PRO 716 Ca -0.12 0.49 -0.41 0.00 -0.04 0.00 0.00 63.50 63.42 2w3s n PRO 716 Cb 0.51 -2.37 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 2w3s n PRO 716 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2w3s s ASN 717 N -1.06 6.73 0.49 3.54 3.84 -0.98 -4.81 114.94 122.69 2w3s s ASN 717 Ca 0.73 2.70 0.14 0.00 0.21 0.00 0.00 52.86 56.65 2w3s s ASN 717 Cb -0.43 -2.65 1.17 0.00 -0.55 0.00 0.00 41.25 38.80 2w3s s ASN 717 CO 0.48 -0.58 2.12 0.03 -2.79 0.00 0.00 177.10 176.37 2w3s h ARG 718 N 3.64 0.10 -6.95 0.43 3.08 -1.92 -3.44 114.38 109.31 2w3s h ARG 718 Ca -0.49 -0.01 -0.48 0.00 0.07 0.00 0.00 59.98 59.08 2w3s h ARG 718 Cb 1.23 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 2w3s h ARG 718 CO 0.67 0.08 0.23 -1.21 -1.07 0.00 0.00 179.97 178.67 2w3s s GLU 719 N -5.12 3.99 -1.07 0.04 0.41 -1.26 -4.95 118.70 110.73 2w3s s GLU 719 Ca -0.06 0.80 -0.06 0.00 -0.41 0.00 0.00 54.97 55.24 2w3s s GLU 719 Cb 0.17 -2.29 0.02 0.00 -1.78 0.00 0.00 34.13 30.25 2w3s s GLU 719 CO 0.68 -0.05 2.73 0.39 -0.49 0.00 0.00 175.26 178.53 2w3s n GLU 720 N -0.98 3.67 -1.41 1.61 1.02 -1.26 -4.72 120.64 118.58 2w3s n GLU 720 Ca 0.05 -2.69 -0.30 0.00 -0.02 0.00 0.00 57.16 54.21 2w3s n GLU 720 Cb 0.54 -2.50 0.12 0.00 -0.02 0.00 0.00 31.44 29.58 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 -0.41 2.68 -0.28 2.62 -4.23 -1.26 -4.90 115.64 109.85 2w3s s THR 721 Ca 0.60 0.22 -0.35 0.00 -1.18 0.00 0.00 61.69 60.98 2w3s s THR 721 Cb 0.24 -2.86 -0.11 0.00 1.34 0.00 0.00 72.50 71.11 2w3s s THR 721 CO -0.10 -0.29 2.11 0.00 -0.54 0.00 0.00 174.62 175.80 2w3s n ILE 722 N -3.69 0.28 -2.61 2.99 0.13 -1.26 -1.20 119.36 114.00 2w3s n ILE 722 Ca 0.07 -0.24 -0.11 0.00 -1.10 0.00 0.00 62.75 61.36 2w3s n ILE 722 Cb 0.56 -1.77 -0.01 0.00 -0.84 0.00 0.00 39.64 37.59 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 9.21 -1.61 -2.13 9.51 3.01 -1.26 -1.78 117.46 132.40 2w3s n PHE 723 Ca 0.35 0.08 -0.21 0.00 1.01 0.00 0.00 57.45 58.68 2w3s n PHE 723 Cb 0.26 -2.32 -0.04 0.00 -0.01 0.00 0.00 39.48 37.37 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 -2.87 -1.61 -1.73 -1.08 5.12 -0.34 -4.66 116.66 109.50 2w3s n ARG 724 Ca -0.09 1.09 -0.29 0.00 -1.93 0.00 0.00 57.85 56.63 2w3s n ARG 724 Cb 0.57 -5.66 0.11 0.00 -1.16 0.00 0.00 32.46 26.32 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 -2.29 4.02 0.13 0.55 1.04 -0.73 -0.47 113.70 115.94 2w3s s SER 725 Ca 0.00 0.87 0.08 0.00 0.48 0.00 0.00 55.95 57.37 2w3s s SER 725 Cb 0.00 -1.39 -0.04 0.00 0.10 0.00 0.00 66.02 64.69 2w3s s SER 725 CO 0.00 -2.22 -0.18 -0.54 0.98 0.00 0.00 173.24 171.28 2w3s s LYS 726 N -5.44 1.15 0.52 4.02 1.02 -0.43 -4.71 119.74 115.88 2w3s s LYS 726 Ca 0.63 -1.28 -0.22 0.00 0.02 0.00 0.00 55.97 55.11 2w3s s LYS 726 Cb -0.13 -1.22 -0.06 0.00 -0.52 0.00 0.00 37.83 35.91 2w3s s LYS 726 CO 0.51 0.26 1.32 0.00 -0.92 0.00 0.00 175.35 176.52 2w3s s ALA 727 N -1.81 2.88 0.00 5.17 0.00 -1.26 -4.65 121.76 122.08 2w3s s ALA 727 Ca 0.11 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2w3s s ALA 727 Cb -0.07 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2w3s s ALA 727 CO 0.05 -1.21 0.15 1.55 0.00 0.00 0.00 175.76 176.30 2w3s n VAL 728 N -0.86 0.01 -0.08 0.00 3.14 -1.26 -4.84 118.33 114.44 2w3s n VAL 728 Ca 0.09 -0.02 -0.12 0.00 -2.96 0.00 0.00 64.34 61.33 2w3s n VAL 728 Cb 0.45 1.70 -0.05 0.00 -1.06 0.00 0.00 33.84 34.89 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 0.48 0.00 7.55 0.00 -1.93 -3.40 103.07 105.77 2w3s h GLY 729 Ca 0.00 -0.41 -0.24 0.00 0.00 0.00 0.00 47.33 46.69 2w3s h GLY 729 CO 0.00 0.37 -1.90 1.18 0.00 0.00 0.00 176.54 176.19 2w3s n GLU 730 N -4.57 0.74 -0.20 4.80 1.02 -1.26 -4.70 120.64 116.47 2w3s n GLU 730 Ca -0.04 0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.18 2w3s n GLU 730 Cb 0.31 -1.32 0.11 0.00 -0.02 0.00 0.00 31.44 30.52 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 0.00 0.18 0.00 3.49 0.11 -1.89 -1.50 132.00 132.40 2w3s h PRO 731 Ca -0.35 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2w3s h PRO 731 Cb 1.60 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.67 2w3s h PRO 731 CO -0.04 0.12 0.00 -2.30 -0.21 0.00 0.00 178.00 175.57 2w3s n PRO 732 N -5.20 0.18 -0.17 1.05 -0.02 -1.26 -1.47 135.00 128.10 2w3s n PRO 732 Ca 0.09 0.50 0.16 0.00 -2.02 0.00 0.00 63.50 62.24 2w3s n PRO 732 Cb 0.35 -1.91 0.51 0.00 -0.02 0.00 0.00 33.50 32.43 2w3s n PRO 732 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2w3s h PHE 733 N 0.00 0.48 0.00 6.00 3.57 -1.47 -2.09 116.94 123.42 2w3s h PHE 733 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2w3s h PHE 733 Cb 0.24 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2w3s h PHE 733 CO 0.00 0.18 0.00 -0.07 -2.23 0.00 0.00 178.31 176.19 2w3s h LEU 734 N 0.40 0.00 -2.34 0.59 4.07 -1.41 -2.64 115.31 113.98 2w3s h LEU 734 Ca 0.38 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.35 2w3s h LEU 734 Cb 0.88 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.62 2w3s h LEU 734 CO -0.12 0.00 0.05 -0.07 -1.08 0.00 0.00 178.44 177.22 2w3s h LEU 735 N 0.00 0.00 -0.83 1.67 3.38 -1.54 -1.90 115.31 116.09 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 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2w3s h LEU 735 CO 0.00 0.00 0.04 0.61 0.09 0.00 0.00 178.44 179.18 2w3s n GLY 736 N -1.38 -0.69 0.20 0.83 0.00 -0.99 -1.64 105.19 101.52 2w3s n GLY 736 Ca -0.02 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.17 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 1.08 0.00 -0.61 2.04 -1.58 -2.23 117.51 116.21 2w3s h ILE 737 Ca 0.00 -1.15 -0.03 0.00 1.00 0.00 0.00 64.86 64.67 2w3s h ILE 737 Cb 0.09 1.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2w3s h ILE 737 CO 0.00 0.31 -0.15 0.77 0.00 0.00 0.00 178.15 179.08 2w3s h SER 738 N 0.00 0.00 -0.20 1.72 4.64 -1.55 -1.17 113.55 116.99 2w3s h SER 738 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2w3s h SER 738 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 2w3s h SER 738 CO 0.04 0.15 -0.00 0.00 -0.87 0.00 0.00 176.83 176.16 2w3s h ALA 739 N 1.85 0.27 -0.12 5.18 0.00 -1.58 -2.11 119.26 122.75 2w3s h ALA 739 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2w3s h ALA 739 Cb 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2w3s h ALA 739 CO 0.02 -0.01 0.08 0.35 0.00 0.00 0.00 179.25 179.68 2w3s h PHE 740 N 0.11 0.15 -0.11 0.00 3.57 -1.35 -2.30 116.94 117.02 2w3s h PHE 740 Ca 0.06 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.57 2w3s h PHE 740 Cb 0.39 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2w3s h PHE 740 CO 0.03 0.12 0.02 -0.07 -2.23 0.00 0.00 178.31 176.18 2w3s h LEU 741 N 0.14 0.00 -1.36 0.59 4.07 -1.26 -0.91 115.31 116.60 2w3s h LEU 741 Ca 0.04 0.02 0.04 0.00 0.08 0.00 0.00 57.88 58.06 2w3s h LEU 741 Cb 0.00 0.02 -0.04 0.00 1.08 0.00 0.00 40.66 41.73 2w3s h LEU 741 CO -0.01 0.02 0.46 0.00 -1.08 0.00 0.00 178.44 177.84 2w3s h ALA 742 N 1.08 1.62 -0.21 1.53 0.00 -1.32 0.19 119.26 122.15 2w3s h ALA 742 Ca 0.05 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2w3s h ALA 742 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2w3s h ALA 742 CO -0.07 0.31 -0.38 1.25 0.00 0.00 0.00 179.25 180.36 2w3s h LEU 743 N 0.83 0.51 -0.79 0.00 5.85 -1.08 0.13 115.31 120.75 2w3s h LEU 743 Ca 0.28 -0.21 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 2w3s h LEU 743 Cb 0.09 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2w3s h LEU 743 CO -0.08 0.84 -0.22 -0.74 -0.34 0.00 0.00 178.44 177.90 2w3s h HIS 744 N 0.40 0.75 -0.15 1.25 -0.00 0.43 -2.82 115.15 115.01 2w3s h HIS 744 Ca 0.04 -0.16 -0.16 0.00 -0.00 0.00 0.00 60.37 60.08 2w3s h HIS 744 Cb 0.85 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 28.07 2w3s h HIS 744 CO 0.03 0.83 -0.59 0.22 -0.00 0.00 0.00 177.93 178.42 2w3s h ASP 745 N 0.59 0.57 0.36 3.26 3.58 -0.38 -0.72 116.42 123.68 2w3s h ASP 745 Ca 0.09 -0.32 -0.05 0.00 0.42 0.00 0.00 57.03 57.17 2w3s h ASP 745 Cb 0.69 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 2w3s h ASP 745 CO 0.05 1.03 -0.24 0.00 -2.88 0.00 0.00 179.24 177.20 2w3s h ALA 746 N 0.98 1.41 -0.07 -0.78 0.00 -0.71 -2.64 119.26 117.44 2w3s h ALA 746 Ca -0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2w3s h ALA 746 Cb 1.13 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2w3s h ALA 746 CO 0.11 0.29 -0.08 0.00 0.00 0.00 0.00 179.25 179.57 2w3s h ALA 748 N 0.54 1.75 0.00 0.00 0.00 -0.80 0.56 119.26 121.31 2w3s h ALA 748 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2w3s h ALA 748 Cb 0.61 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2w3s h ALA 748 CO 0.02 -0.55 -0.26 0.00 0.00 0.00 0.00 179.25 178.46 2w3s h ALA 749 N 1.31 0.87 -0.00 0.00 0.00 -1.48 -3.30 119.26 116.66 2w3s h ALA 749 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2w3s h ALA 749 Cb 0.98 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2w3s h ALA 749 CO -0.00 0.32 -0.08 0.00 0.00 0.00 0.00 179.25 179.49 2w3s n GLY 751 N 1.44 0.57 0.02 0.00 0.00 -1.24 -4.32 105.19 101.67 2w3s n GLY 751 Ca 0.09 -0.79 0.11 0.00 0.00 0.00 0.00 46.02 45.43 2w3s n GLY 751 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2w3s n PRO 752 N -0.08 0.05 -2.95 1.61 -0.04 -1.18 -4.75 135.00 127.66 2w3s n PRO 752 Ca 0.00 0.17 -0.29 0.00 -0.04 0.00 0.00 63.50 63.34 2w3s n PRO 752 Cb 0.00 -1.57 -0.02 0.00 -0.04 0.00 0.00 33.50 31.86 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 -3.04 3.49 -0.20 0.54 3.76 -1.07 -5.02 115.29 113.75 2w3s s HIS 753 Ca 0.10 0.86 -0.29 0.00 -0.15 0.00 0.00 55.06 55.58 2w3s s HIS 753 Cb 0.14 -2.30 -0.02 0.00 1.11 0.00 0.00 32.58 31.50 2w3s s HIS 753 CO 0.42 -0.07 1.44 -0.46 -0.85 0.00 0.00 174.74 175.22 2w3s s TRP 754 N -2.38 2.45 0.41 1.40 -0.11 -1.26 -4.36 118.94 115.09 2w3s s TRP 754 Ca 0.48 0.71 0.13 0.00 1.22 0.00 0.00 56.10 58.64 2w3s s TRP 754 Cb -0.10 -3.81 0.87 0.00 -1.50 0.00 0.00 33.47 28.93 2w3s s TRP 754 CO 0.34 -2.40 1.92 -1.35 -4.62 0.00 0.00 176.95 170.84 2w3s h PRO 755 N 9.42 0.02 -6.69 5.86 0.11 -1.88 -3.40 132.00 135.44 2w3s h PRO 755 Ca -0.30 -0.01 -0.53 0.00 0.11 0.00 0.00 66.00 65.27 2w3s h PRO 755 Cb 1.13 -0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.25 2w3s h PRO 755 CO 0.99 0.28 -0.98 -3.47 -0.21 0.00 0.00 178.00 174.61 2w3s n ASP 756 N -4.23 -4.63 -4.74 -2.05 2.03 -1.26 -4.47 116.55 97.19 2w3s n ASP 756 Ca -0.02 -1.17 -0.41 0.00 0.52 0.00 0.00 54.79 53.71 2w3s n ASP 756 Cb 0.31 -2.22 -0.04 0.00 -0.72 0.00 0.00 41.12 38.45 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 -6.88 4.50 0.24 -2.67 2.96 -1.26 -4.84 118.68 110.72 2w3s s LEU 757 Ca 0.43 2.17 0.06 0.00 -0.22 0.00 0.00 54.13 56.57 2w3s s LEU 757 Cb -0.21 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 42.83 2w3s s LEU 757 CO 0.93 -0.23 0.30 -1.10 -1.32 0.00 0.00 176.35 174.92 2w3s s GLN 758 N -0.63 3.26 -0.11 1.98 -1.52 -1.26 -4.95 119.66 116.43 2w3s s GLN 758 Ca 0.49 -0.85 -0.05 0.00 -1.95 0.00 0.00 55.36 53.00 2w3s s GLN 758 Cb -0.31 -2.78 -0.04 0.00 -0.22 0.00 0.00 33.01 29.66 2w3s s GLN 758 CO 0.37 0.43 0.08 0.00 -0.25 0.00 0.00 175.29 175.92 2w3s s ALA 759 N -2.01 3.61 0.20 6.09 0.00 -0.86 -2.67 121.76 126.13 2w3s s ALA 759 Ca 0.34 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 51.29 2w3s s ALA 759 Cb -0.09 -1.78 -0.08 0.00 0.00 0.00 0.00 23.12 21.17 2w3s s ALA 759 CO 0.27 0.57 1.15 -1.25 0.00 0.00 0.00 175.76 176.51 2w3s s PRO 760 N -0.87 4.55 -0.78 0.00 0.04 -1.26 -3.41 135.00 133.27 2w3s s PRO 760 Ca 0.13 1.82 -0.14 0.00 0.04 0.00 0.00 61.00 62.85 2w3s s PRO 760 Cb -0.12 -3.24 -0.11 0.00 0.04 0.00 0.00 34.50 31.07 2w3s s PRO 760 CO 0.03 0.02 1.96 0.00 0.04 0.00 0.00 177.00 179.04 2w3s n ALA 761 N 2.17 3.75 -0.95 8.56 0.00 0.26 -4.75 120.51 129.56 2w3s n ALA 761 Ca 0.03 -2.59 -0.29 0.00 0.00 0.00 0.00 53.44 50.59 2w3s n ALA 761 Cb 0.45 -3.32 0.19 0.00 0.00 0.00 0.00 19.45 16.78 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 4.36 2.21 0.47 0.00 -4.23 -0.82 -4.49 115.64 113.13 2w3s s THR 762 Ca 0.47 0.07 0.14 0.00 -1.18 0.00 0.00 61.69 61.19 2w3s s THR 762 Cb 0.12 -2.39 0.30 0.00 1.34 0.00 0.00 72.50 71.87 2w3s s THR 762 CO 0.05 -0.09 2.06 -0.65 -0.54 0.00 0.00 174.62 175.45 2w3s h PRO 763 N -2.04 0.26 -0.30 3.99 0.11 -1.85 0.41 132.00 132.57 2w3s h PRO 763 Ca -0.55 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.53 2w3s h PRO 763 Cb 1.31 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2w3s h PRO 763 CO 0.53 0.17 0.11 1.49 -0.21 0.00 0.00 178.00 180.10 2w3s h GLU 764 N 0.26 0.46 -0.08 1.05 4.81 -1.88 -1.31 114.58 117.90 2w3s h GLU 764 Ca 0.15 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2w3s h GLU 764 Cb 0.26 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 2w3s h GLU 764 CO -0.03 0.48 0.03 0.00 -0.73 0.00 0.00 179.01 178.77 2w3s h ALA 765 N 0.95 0.10 -0.61 2.92 0.00 -1.56 -1.24 119.26 119.82 2w3s h ALA 765 Ca 0.10 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2w3s h ALA 765 Cb 0.20 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 2w3s h ALA 765 CO -0.01 -0.33 0.29 0.28 0.00 0.00 0.00 179.25 179.48 2w3s h VAL 766 N -0.01 0.88 0.02 0.00 2.07 -0.20 -1.56 116.25 117.45 2w3s h VAL 766 Ca 0.03 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2w3s h VAL 766 Cb 0.14 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2w3s h VAL 766 CO -0.00 0.10 -0.01 0.25 0.02 0.00 0.00 177.57 177.92 2w3s h LEU 767 N 0.52 -0.02 -0.85 2.57 5.85 -1.11 -0.07 115.31 122.21 2w3s h LEU 767 Ca 0.29 -0.06 0.19 0.00 0.84 0.00 0.00 57.88 59.13 2w3s h LEU 767 Cb 0.26 0.01 -0.11 0.00 0.37 0.00 0.00 40.66 41.18 2w3s h LEU 767 CO -0.23 0.05 0.36 0.00 -0.34 0.00 0.00 178.44 178.28 2w3s h ALA 768 N 0.90 1.29 -0.11 1.25 0.00 -0.88 -0.80 119.26 120.90 2w3s h ALA 768 Ca -0.00 0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 2w3s h ALA 768 Cb 0.08 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w3s h ALA 768 CO 0.00 -0.26 -0.65 0.00 0.00 0.00 0.00 179.25 178.34 2w3s h ALA 769 N 1.64 0.67 -0.51 0.00 0.00 -0.94 -2.41 119.26 117.71 2w3s h ALA 769 Ca 0.50 -0.56 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2w3s h ALA 769 Cb 0.87 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2w3s h ALA 769 CO -0.47 0.73 0.33 0.28 0.00 0.00 0.00 179.25 180.12 2w3s h VAL 770 N 0.31 1.11 -0.01 0.00 2.07 0.09 -1.49 116.25 118.34 2w3s h VAL 770 Ca -0.01 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 2w3s h VAL 770 Cb 1.20 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2w3s h VAL 770 CO 0.11 0.12 -0.49 0.03 0.02 0.00 0.00 177.57 177.37 2w3s h ARG 771 N 0.67 0.02 -0.10 1.57 3.08 -1.11 0.11 114.38 118.61 2w3s h ARG 771 Ca 0.19 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2w3s h ARG 771 Cb -0.06 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 2w3s h ARG 771 CO -0.05 0.51 0.02 0.00 -1.07 0.00 0.00 179.97 179.38 2w3s h ARG 772 N 0.02 0.17 -0.88 0.04 3.08 -1.21 0.58 114.38 116.18 2w3s h ARG 772 Ca -0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2w3s h ARG 772 Cb 0.87 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.86 2w3s h ARG 772 CO 0.06 0.36 0.56 0.00 -1.07 0.00 0.00 179.97 179.89 2w3s h ALA 773 N 0.80 1.12 0.00 0.04 0.00 -0.68 -1.09 119.26 119.46 2w3s h ALA 773 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2w3s h ALA 773 Cb 0.27 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2w3s h ALA 773 CO 0.00 0.54 0.00 0.39 0.00 0.00 0.00 179.25 180.19 2w3s n GLU 774 N -4.45 0.78 -0.76 0.00 1.02 0.31 -2.59 120.64 114.96 2w3s n GLU 774 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2w3s n GLU 774 Cb 0.03 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 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 0.55 0.56 3.62 0.62 0.00 -0.41 -4.99 105.19 105.13 2w3s n GLY 775 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.45 0.12 0.00 1.61 0.52 0.09 -4.98 118.95 115.87 2w3s s ARG 776 Ca 0.00 0.76 0.04 0.00 -0.52 0.00 0.00 55.73 56.01 2w3s s ARG 776 Cb 0.00 -1.68 0.25 0.00 0.52 0.00 0.00 34.95 34.04 2w3s s ARG 776 CO 0.00 -3.00 0.72 0.00 0.02 0.00 0.00 175.30 173.04