#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w3s n VAL 3 N 0.00 1.47 0.00 0.44 0.31 -1.25 -2.68 118.33 116.62 2w3s n VAL 3 Ca 0.00 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 2w3s n VAL 3 Cb 0.00 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 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 1.48 3.38 3.82 2.92 0.00 -0.14 -5.04 105.19 111.60 2w3s n GLY 4 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.97 4.22 -0.25 1.61 1.02 -1.09 -4.53 119.74 119.75 2w3s s LYS 5 Ca 0.00 0.83 -0.06 0.00 0.02 0.00 0.00 55.97 56.76 2w3s s LYS 5 Cb 0.00 -2.90 -0.22 0.00 -0.52 0.00 0.00 37.83 34.20 2w3s s LYS 5 CO 0.00 0.41 3.22 -0.35 -0.92 0.00 0.00 175.35 177.71 2w3s n PRO 6 N 0.77 2.05 -2.42 -1.68 -0.04 -1.26 -4.40 135.00 128.02 2w3s n PRO 6 Ca -0.03 -1.09 -0.39 0.00 -0.04 0.00 0.00 63.50 61.96 2w3s n PRO 6 Cb 0.51 -2.08 -0.03 0.00 -0.04 0.00 0.00 33.50 31.86 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 0.03 4.31 1.16 1.53 1.43 -1.26 -4.79 118.68 121.07 2w3s s LEU 7 Ca 0.61 2.25 -0.15 0.00 -1.03 0.00 0.00 54.13 55.81 2w3s s LEU 7 Cb 0.27 -3.92 0.27 0.00 0.03 0.00 0.00 46.19 42.84 2w3s s LEU 7 CO -0.01 -0.44 1.05 -2.16 0.23 0.00 0.00 176.35 175.02 2w3s s PRO 8 N -2.04 -0.83 0.38 1.29 0.04 -1.26 -4.67 135.00 127.91 2w3s s PRO 8 Ca 0.53 0.47 -0.27 0.00 0.04 0.00 0.00 61.00 61.76 2w3s s PRO 8 Cb -0.29 -1.59 -0.10 0.00 0.04 0.00 0.00 34.50 32.56 2w3s s PRO 8 CO 0.37 -3.57 1.37 -1.58 0.04 0.00 0.00 177.00 173.63 2w3s s HIS 9 N -2.70 2.77 0.51 0.56 2.46 -1.26 -4.89 115.29 112.74 2w3s s HIS 9 Ca 0.68 1.33 0.34 0.00 0.47 0.00 0.00 55.06 57.88 2w3s s HIS 9 Cb -0.19 -3.80 1.47 0.00 -0.13 0.00 0.00 32.58 29.94 2w3s s HIS 9 CO 0.60 -2.37 1.75 0.38 -2.47 0.00 0.00 174.74 172.63 2w3s h ASP 10 N 2.90 0.11 -0.16 9.88 2.03 -1.93 -1.68 116.42 127.58 2w3s h ASP 10 Ca -0.50 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.83 2w3s h ASP 10 Cb 1.24 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 2w3s h ASP 10 CO 0.64 -0.00 0.00 -1.20 -1.03 0.00 0.00 179.24 177.64 2w3s n SER 11 N -4.29 2.76 -0.38 4.15 7.64 -1.26 -4.79 113.62 117.45 2w3s n SER 11 Ca 0.29 -2.44 -0.02 0.00 1.01 0.00 0.00 58.87 57.71 2w3s n SER 11 Cb 1.28 -0.27 0.03 0.00 -1.01 0.00 0.00 64.21 64.24 2w3s n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w3s n ALA 12 N -0.39 -0.16 -0.12 -0.43 0.00 -0.63 -0.43 120.51 118.34 2w3s n ALA 12 Ca 0.11 0.96 -0.12 0.00 0.00 0.00 0.00 53.44 54.40 2w3s n ALA 12 Cb 0.52 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 2w3s n ALA 12 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2w3s h ARG 13 N 0.00 0.72 -0.75 0.00 2.43 -1.86 -1.34 114.38 113.58 2w3s h ARG 13 Ca 0.33 -0.29 0.12 0.00 -0.81 0.00 0.00 59.98 59.32 2w3s h ARG 13 Cb 0.57 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.01 2w3s h ARG 13 CO -0.97 0.89 0.35 0.00 -1.51 0.00 0.00 179.97 178.73 2w3s h ALA 14 N 0.80 1.05 0.97 2.80 0.00 -1.39 -0.19 119.26 123.30 2w3s h ALA 14 Ca 0.09 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2w3s h ALA 14 Cb 0.65 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.46 2w3s h ALA 14 CO 0.04 -0.11 -0.47 0.45 0.00 0.00 0.00 179.25 179.17 2w3s h HIS 15 N 0.55 -1.21 -0.19 0.00 3.86 -0.46 -0.09 115.15 117.60 2w3s h HIS 15 Ca 0.39 -0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.62 2w3s h HIS 15 Cb 0.50 0.40 -0.01 0.00 1.06 0.00 0.00 27.41 29.36 2w3s h HIS 15 CO -0.13 -0.75 0.18 -0.24 0.86 0.00 0.00 177.93 177.85 2w3s h VAL 16 N -1.31 0.60 0.00 2.45 3.04 -0.91 -0.70 116.25 119.41 2w3s h VAL 16 Ca -0.13 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 2w3s h VAL 16 Cb 1.00 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2w3s h VAL 16 CO 0.22 0.00 -1.17 0.35 -1.01 0.00 0.00 177.57 175.95 2w3s n THR 17 N -4.00 0.23 -1.37 3.17 -2.24 -0.11 -4.98 114.28 104.97 2w3s n THR 17 Ca 0.02 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2w3s n THR 17 Cb 0.30 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 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 1.32 0.52 0.00 3.38 0.00 -0.27 -4.94 105.19 105.21 2w3s n GLY 18 Ca 0.01 -0.86 0.09 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.82 0.84 -2.01 1.61 6.02 -0.18 -4.88 117.38 116.96 2w3s n GLN 19 Ca 0.00 -0.07 -0.43 0.00 -0.01 0.00 0.00 57.00 56.49 2w3s n GLN 19 Cb 0.25 -1.39 -0.03 0.00 1.02 0.00 0.00 30.24 30.09 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 -2.96 3.39 0.11 -1.58 0.00 -0.78 -4.98 121.76 114.97 2w3s s ALA 20 Ca 0.01 0.73 -0.24 0.00 0.00 0.00 0.00 51.96 52.46 2w3s s ALA 20 Cb 0.13 -3.82 -0.07 0.00 0.00 0.00 0.00 23.12 19.36 2w3s s ALA 20 CO 0.75 -1.76 0.72 1.03 0.00 0.00 0.00 175.76 176.51 2w3s s ARG 21 N 4.52 4.47 0.51 0.00 0.52 -1.26 -4.94 118.95 122.76 2w3s s ARG 21 Ca 0.75 1.04 0.06 0.00 -0.52 0.00 0.00 55.73 57.06 2w3s s ARG 21 Cb -0.30 -3.28 0.02 0.00 0.52 0.00 0.00 34.95 31.91 2w3s s ARG 21 CO 0.30 0.51 0.42 0.71 0.02 0.00 0.00 175.30 177.26 2w3s s TYR 22 N -0.85 1.93 0.21 -0.53 1.51 -1.26 -4.83 117.35 113.53 2w3s s TYR 22 Ca 0.35 -0.73 -0.10 0.00 -1.01 0.00 0.00 57.07 55.58 2w3s s TYR 22 Cb -0.22 -2.00 0.30 0.00 -0.11 0.00 0.00 41.96 39.93 2w3s s TYR 22 CO 0.24 -0.40 1.70 1.25 -1.11 0.00 0.00 175.55 177.22 2w3s h LEU 23 N 0.81 -0.02 0.00 -1.29 6.46 -1.93 0.36 115.31 119.70 2w3s h LEU 23 Ca -0.38 0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 2w3s h LEU 23 Cb 1.29 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.38 2w3s h LEU 23 CO 0.57 -0.00 0.00 -0.67 -0.62 0.00 0.00 178.44 177.71 2w3s n ASP 24 N -5.14 0.00 0.05 1.25 4.64 -1.26 -2.58 116.55 113.51 2w3s n ASP 24 Ca 0.09 0.41 -0.02 0.00 -1.38 0.00 0.00 54.79 53.90 2w3s n ASP 24 Cb 0.33 -0.46 -0.07 0.00 -1.04 0.00 0.00 41.12 39.88 2w3s n ASP 24 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2w3s h ASP 25 N 0.00 0.00 -2.48 1.67 3.32 -0.66 -3.48 116.42 114.78 2w3s h ASP 25 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2w3s h ASP 25 Cb 0.23 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.85 2w3s h ASP 25 CO 0.00 0.69 0.68 0.18 -1.72 0.00 0.00 179.24 179.07 2w3s n LEU 26 N -3.06 3.04 -4.45 1.55 4.77 -1.07 -4.93 117.00 112.86 2w3s n LEU 26 Ca -0.07 1.12 -0.32 0.00 -0.03 0.00 0.00 56.01 56.71 2w3s n LEU 26 Cb 0.87 -1.42 0.14 0.00 -2.33 0.00 0.00 43.42 40.68 2w3s n LEU 26 CO 0.43 -0.44 0.02 -2.65 -1.33 0.00 0.00 177.39 173.42 2w3s n PRO 27 N 2.57 -0.52 -3.57 3.23 -0.02 -1.26 -5.03 135.00 130.40 2w3s n PRO 27 Ca 0.14 -0.11 -0.06 0.00 -2.02 0.00 0.00 63.50 61.45 2w3s n PRO 27 Cb 0.30 -1.94 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 2w3s n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s n PRO 29 N -0.06 2.25 -0.46 0.00 -0.02 -1.26 -4.86 135.00 130.60 2w3s n PRO 29 Ca -0.02 0.81 0.38 0.00 -2.02 0.00 0.00 63.50 62.64 2w3s n PRO 29 Cb 0.59 -2.53 0.63 0.00 -0.02 0.00 0.00 33.50 32.17 2w3s n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w3s n ALA 30 N 2.54 1.31 1.55 3.55 0.00 -1.26 -0.59 120.51 127.61 2w3s n ALA 30 Ca 0.13 0.76 0.04 0.00 0.00 0.00 0.00 53.44 54.37 2w3s n ALA 30 Cb 0.32 -0.97 0.21 0.00 0.00 0.00 0.00 19.45 19.01 2w3s n ALA 30 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2w3s n ASN 31 N -4.42 0.00 -4.73 0.00 6.94 -1.26 -4.87 115.26 106.92 2w3s n ASN 31 Ca 0.37 -1.33 -0.42 0.00 -0.02 0.00 0.00 54.58 53.19 2w3s n ASN 31 Cb 1.48 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 38.88 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 -2.00 2.33 0.65 5.53 2.01 0.24 -4.58 115.64 119.82 2w3s s THR 32 Ca 0.11 0.25 -0.02 0.00 0.31 0.00 0.00 61.69 62.34 2w3s s THR 32 Cb 0.05 -3.16 0.07 0.00 0.01 0.00 0.00 72.50 69.47 2w3s s THR 32 CO 0.08 0.03 0.92 -0.76 -0.69 0.00 0.00 174.62 174.20 2w3s s LEU 33 N 0.44 3.05 0.00 4.42 1.43 -0.27 -4.87 118.68 122.89 2w3s s LEU 33 Ca 0.68 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.83 2w3s s LEU 33 Cb -0.46 -2.68 -0.01 0.00 0.03 0.00 0.00 46.19 43.07 2w3s s LEU 33 CO 0.38 -1.51 -0.09 -1.00 0.23 0.00 0.00 176.35 174.35 2w3s s HIS 34 N -3.03 0.84 -0.06 0.29 3.76 0.36 -0.82 115.29 116.64 2w3s s HIS 34 Ca 0.61 -0.21 0.05 0.00 -0.15 0.00 0.00 55.06 55.36 2w3s s HIS 34 Cb -0.09 -0.53 -0.01 0.00 1.11 0.00 0.00 32.58 33.06 2w3s s HIS 34 CO 0.42 -0.01 -0.23 -0.51 -0.85 0.00 0.00 174.74 173.56 2w3s s LEU 35 N -0.47 2.03 0.01 0.89 1.43 -0.08 -0.89 118.68 121.60 2w3s s LEU 35 Ca 0.02 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2w3s s LEU 35 Cb -0.05 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.90 2w3s s LEU 35 CO -0.00 0.21 -0.08 0.00 0.23 0.00 0.00 176.35 176.71 2w3s s ALA 36 N -0.08 0.69 0.19 4.21 0.00 -0.62 -4.51 121.76 121.64 2w3s s ALA 36 Ca -0.05 -0.47 -0.20 0.00 0.00 0.00 0.00 51.96 51.24 2w3s s ALA 36 Cb -0.13 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.78 2w3s s ALA 36 CO 0.04 0.13 0.69 -0.06 0.00 0.00 0.00 175.76 176.56 2w3s s PHE 37 N -0.49 3.70 -0.11 0.00 2.99 -1.26 -0.70 117.98 122.10 2w3s s PHE 37 Ca 0.00 1.37 -0.22 0.00 0.00 0.00 0.00 56.93 58.08 2w3s s PHE 37 Cb -0.05 -2.59 -0.03 0.00 0.00 0.00 0.00 43.02 40.34 2w3s s PHE 37 CO 0.00 0.40 0.65 0.20 -0.00 0.00 0.00 175.22 176.47 2w3s s GLY 38 N -1.53 2.42 0.03 4.36 0.00 0.11 -4.85 107.32 107.87 2w3s s GLY 38 Ca 0.40 -0.02 0.03 0.00 0.00 0.00 0.00 44.72 45.12 2w3s s GLY 38 CO 0.21 1.16 -0.01 1.08 0.00 0.00 0.00 173.10 175.55 2w3s s LEU 39 N 1.09 3.46 0.36 0.66 1.43 -1.26 0.31 118.68 124.73 2w3s s LEU 39 Ca 0.33 -0.08 -0.28 0.00 -1.03 0.00 0.00 54.13 53.07 2w3s s LEU 39 Cb -0.17 -2.07 -0.11 0.00 0.03 0.00 0.00 46.19 43.88 2w3s s LEU 39 CO 0.15 0.24 1.41 -0.55 0.23 0.00 0.00 176.35 177.83 2w3s s SER 40 N -1.84 6.49 0.00 2.29 0.15 0.28 -4.80 113.70 116.27 2w3s s SER 40 Ca 0.22 2.90 0.18 0.00 0.70 0.00 0.00 55.95 59.94 2w3s s SER 40 Cb -0.12 -2.66 0.32 0.00 -1.71 0.00 0.00 66.02 61.85 2w3s s SER 40 CO 0.13 -0.76 1.24 0.35 1.20 0.00 0.00 173.24 175.40 2w3s n THR 41 N 0.55 0.49 -4.06 6.45 -2.24 -1.26 -1.56 114.28 112.65 2w3s n THR 41 Ca 0.01 -0.74 -0.22 0.00 -2.27 0.00 0.00 64.05 60.82 2w3s n THR 41 Cb 0.40 0.95 -0.05 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.26 2.52 -0.01 -0.78 0.41 -1.26 -4.94 118.70 113.38 2w3s s GLU 42 Ca 0.29 -1.40 0.22 0.00 -0.41 0.00 0.00 54.97 53.67 2w3s s GLU 42 Cb 0.17 -2.30 -0.29 0.00 -1.78 0.00 0.00 34.13 29.93 2w3s s GLU 42 CO 0.24 0.18 0.59 0.00 -0.49 0.00 0.00 175.26 175.78 2w3s n ALA 43 N -1.17 3.12 -2.74 5.21 0.00 -1.26 -2.87 120.51 120.79 2w3s n ALA 43 Ca -0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 53.44 52.85 2w3s n ALA 43 Cb 0.60 -0.78 0.02 0.00 0.00 0.00 0.00 19.45 19.29 2w3s n ALA 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3s n SER 44 N -2.15 -2.99 -4.22 0.00 2.88 -1.26 -2.61 113.62 103.27 2w3s n SER 44 Ca -0.02 -2.53 -0.13 0.00 -1.33 0.00 0.00 58.87 54.86 2w3s n SER 44 Cb 0.53 1.54 -0.10 0.00 -0.75 0.00 0.00 64.21 65.43 2w3s n SER 44 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2w3s s ALA 45 N 0.87 1.23 0.11 -1.46 0.00 -1.10 -0.82 121.76 120.59 2w3s s ALA 45 Ca 0.29 -1.55 -0.04 0.00 0.00 0.00 0.00 51.96 50.66 2w3s s ALA 45 Cb 0.04 0.58 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 2w3s s ALA 45 CO -0.07 -0.35 0.33 0.00 0.00 0.00 0.00 175.76 175.67 2w3s s ALA 46 N -3.73 3.84 -0.20 0.00 0.00 -1.19 -0.55 121.76 119.93 2w3s s ALA 46 Ca 0.23 -0.62 -0.13 0.00 0.00 0.00 0.00 51.96 51.44 2w3s s ALA 46 Cb 0.06 -2.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.07 2w3s s ALA 46 CO 0.03 0.70 0.27 0.42 0.00 0.00 0.00 175.76 177.18 2w3s s ILE 47 N -1.60 5.30 -0.06 0.00 1.01 -0.85 -1.37 121.20 123.64 2w3s s ILE 47 Ca 0.39 0.44 0.10 0.00 0.00 0.00 0.00 60.65 61.58 2w3s s ILE 47 Cb -0.12 -3.60 -0.15 0.00 0.01 0.00 0.00 42.46 38.60 2w3s s ILE 47 CO 0.25 0.34 0.14 0.41 0.00 0.00 0.00 174.94 176.07 2w3s n THR 48 N 4.03 0.33 -3.74 2.92 -1.04 -0.40 -4.85 114.28 111.54 2w3s n THR 48 Ca -0.12 -0.33 -0.17 0.00 -2.04 0.00 0.00 64.05 61.38 2w3s n THR 48 Cb 0.52 -0.23 -0.17 0.00 -1.82 0.00 0.00 70.33 68.63 2w3s n THR 48 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2w3s s GLY 49 N -3.72 0.16 -0.46 3.41 0.00 -0.58 -4.96 107.32 101.16 2w3s s GLY 49 Ca -0.04 0.24 0.03 0.00 0.00 0.00 0.00 44.72 44.95 2w3s s GLY 49 CO 0.43 0.98 0.28 -2.27 0.00 0.00 0.00 173.10 172.52 2w3s s LEU 50 N 1.54 2.71 -0.40 0.66 2.96 -1.26 0.32 118.68 125.21 2w3s s LEU 50 Ca -0.03 -2.81 -0.16 0.00 -0.22 0.00 0.00 54.13 50.90 2w3s s LEU 50 Cb -0.13 -1.00 0.01 0.00 0.50 0.00 0.00 46.19 45.57 2w3s s LEU 50 CO -0.03 -0.23 0.39 -0.62 -1.32 0.00 0.00 176.35 174.54 2w3s s ASP 51 N 0.13 6.18 0.00 3.68 2.15 0.42 -4.92 116.67 124.30 2w3s s ASP 51 Ca 0.20 -0.59 0.19 0.00 0.43 0.00 0.00 52.55 52.79 2w3s s ASP 51 Cb -0.18 -2.21 0.45 0.00 -0.30 0.00 0.00 42.92 40.68 2w3s s ASP 51 CO -0.04 -0.49 1.37 0.18 -0.17 0.00 0.00 175.17 176.02 2w3s n LEU 52 N 5.47 3.41 -0.12 -1.34 4.77 -1.26 -1.37 117.00 126.55 2w3s n LEU 52 Ca -0.08 -1.75 -0.04 0.00 -0.03 0.00 0.00 56.01 54.10 2w3s n LEU 52 Cb 0.48 -0.31 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 2w3s n LEU 52 CO 0.44 0.80 0.90 -0.08 -1.33 0.00 0.00 177.39 178.12 2w3s h GLU 53 N 3.69 0.20 0.00 3.23 4.57 -1.91 0.14 114.58 124.49 2w3s h GLU 53 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2w3s h GLU 53 Cb 0.89 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 2w3s h GLU 53 CO 0.00 0.13 0.00 -1.35 -1.18 0.00 0.00 179.01 176.61 2w3s h PRO 54 N 0.20 0.00 0.02 0.92 0.11 -1.83 -2.57 132.00 128.86 2w3s h PRO 54 Ca 0.20 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 2w3s h PRO 54 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2w3s h PRO 54 CO -0.27 0.00 -0.01 0.28 -0.21 0.00 0.00 178.00 177.79 2w3s h VAL 55 N 0.00 1.45 -0.14 3.15 2.07 -0.92 -2.84 116.25 119.01 2w3s h VAL 55 Ca 0.00 -1.89 0.04 0.00 0.82 0.00 0.00 66.70 65.67 2w3s h VAL 55 Cb 0.11 2.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2w3s h VAL 55 CO 0.00 0.46 0.22 0.03 0.02 0.00 0.00 177.57 178.30 2w3s h ARG 56 N -0.91 0.00 0.00 1.57 3.08 -1.21 -2.45 114.38 114.46 2w3s h ARG 56 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2w3s h ARG 56 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 2w3s h ARG 56 CO 0.00 0.00 -1.23 0.39 -1.07 0.00 0.00 179.97 178.06 2w3s n GLU 57 N -3.50 0.16 -1.84 0.04 1.02 -0.98 -4.81 120.64 110.74 2w3s n GLU 57 Ca 0.01 -0.05 -0.41 0.00 -0.02 0.00 0.00 57.16 56.69 2w3s n GLU 57 Cb 0.33 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 2w3s n GLU 57 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2w3s s SER 58 N -3.38 6.24 0.52 1.62 0.15 -0.92 -4.92 113.70 113.00 2w3s s SER 58 Ca 0.04 2.97 -0.22 0.00 0.70 0.00 0.00 55.95 59.44 2w3s s SER 58 Cb 0.16 -2.66 -0.06 0.00 -1.71 0.00 0.00 66.02 61.74 2w3s s SER 58 CO 0.88 -0.93 1.21 -0.81 1.20 0.00 0.00 173.24 174.79 2w3s n PRO 59 N 0.29 1.52 -0.17 5.44 -0.04 -1.26 -2.99 135.00 137.79 2w3s n PRO 59 Ca 0.02 0.56 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 2w3s n PRO 59 Cb 0.40 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 2w3s n PRO 59 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2w3s n GLY 60 N 0.93 2.28 3.66 0.55 0.00 -1.26 -4.85 105.19 106.50 2w3s n GLY 60 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.89 4.41 -0.17 1.61 1.01 -1.16 -0.01 120.40 123.20 2w3s s VAL 61 Ca 0.00 1.69 -0.02 0.00 0.00 0.00 0.00 61.98 63.65 2w3s s VAL 61 Cb 0.00 -4.13 -0.23 0.00 0.00 0.00 0.00 36.38 32.02 2w3s s VAL 61 CO 0.00 -0.19 0.16 -0.38 0.00 0.00 0.00 175.10 174.69 2w3s n ILE 62 N 5.44 1.66 -3.84 2.22 2.08 0.21 -4.93 119.36 122.19 2w3s n ILE 62 Ca 0.13 -0.64 -0.11 0.00 0.56 0.00 0.00 62.75 62.69 2w3s n ILE 62 Cb 0.45 -1.54 -0.09 0.00 -0.75 0.00 0.00 39.64 37.71 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 -2.54 -0.40 -0.05 -1.39 0.00 -0.30 -5.00 121.76 112.07 2w3s s ALA 63 Ca -0.25 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.57 2w3s s ALA 63 Cb 0.07 0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.40 2w3s s ALA 63 CO 0.72 -0.30 -0.12 0.08 0.00 0.00 0.00 175.76 176.14 2w3s s VAL 64 N -2.04 1.08 0.09 0.00 1.01 -1.26 0.05 120.40 119.33 2w3s s VAL 64 Ca -0.09 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.50 2w3s s VAL 64 Cb -0.04 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2w3s s VAL 64 CO -0.01 0.34 -0.21 -0.36 0.00 0.00 0.00 175.10 174.86 2w3s s PHE 65 N 0.53 1.82 0.07 5.22 0.40 0.35 -4.93 117.98 121.43 2w3s s PHE 65 Ca -0.11 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 55.84 2w3s s PHE 65 Cb -0.14 -1.02 -0.03 0.00 0.51 0.00 0.00 43.02 42.34 2w3s s PHE 65 CO 0.03 0.18 -0.08 0.99 0.70 0.00 0.00 175.22 177.04 2w3s s THR 66 N -1.05 0.65 0.34 0.64 2.01 -1.26 -1.05 115.64 115.92 2w3s s THR 66 Ca 0.07 -1.49 0.13 0.00 0.31 0.00 0.00 61.69 60.71 2w3s s THR 66 Cb -0.10 -1.13 0.35 0.00 0.01 0.00 0.00 72.50 71.63 2w3s s THR 66 CO 0.04 -0.60 1.62 0.00 -0.69 0.00 0.00 174.62 174.99 2w3s h ALA 67 N 3.78 1.81 0.00 7.40 0.00 -1.78 1.55 119.26 132.02 2w3s h ALA 67 Ca -0.36 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2w3s h ALA 67 Cb 1.19 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 2w3s h ALA 67 CO 0.52 -0.69 -0.01 0.00 0.00 0.00 0.00 179.25 179.07 2w3s h ALA 68 N 1.91 1.76 -0.03 0.00 0.00 -1.95 -1.38 119.26 119.58 2w3s h ALA 68 Ca 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.63 2w3s h ALA 68 Cb 1.72 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2w3s h ALA 68 CO -0.72 0.01 0.00 -0.25 0.00 0.00 0.00 179.25 178.30 2w3s n ASP 69 N -4.21 0.50 -4.60 0.00 8.00 0.53 -4.84 116.55 111.93 2w3s n ASP 69 Ca -0.03 -1.34 -0.43 0.00 0.71 0.00 0.00 54.79 53.70 2w3s n ASP 69 Cb 0.09 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 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 -1.78 3.93 0.19 0.64 1.43 -0.52 -4.89 118.68 117.68 2w3s s LEU 70 Ca 0.37 0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 53.87 2w3s s LEU 70 Cb 0.18 -3.34 0.17 0.00 0.03 0.00 0.00 46.19 43.22 2w3s s LEU 70 CO 0.29 -0.95 1.61 -0.65 0.23 0.00 0.00 176.35 176.88 2w3s h PRO 71 N 8.61 -0.10 0.00 1.29 0.11 -1.88 -3.45 132.00 136.58 2w3s h PRO 71 Ca -0.23 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2w3s h PRO 71 Cb 1.07 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2w3s h PRO 71 CO 1.02 -0.07 0.00 0.72 -0.21 0.00 0.00 178.00 179.46 2w3s n HIS 72 N -5.43 0.00 -1.29 0.65 8.25 -1.13 -5.02 115.22 111.24 2w3s n HIS 72 Ca 0.05 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.12 2w3s n HIS 72 Cb 0.34 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.46 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 -3.16 -3.37 0.41 10.43 -1.14 -4.96 116.55 114.76 2w3s n ASP 73 Ca 0.00 0.69 -0.26 0.00 2.57 0.00 0.00 54.79 57.79 2w3s n ASP 73 Cb 0.00 -0.91 -0.08 0.00 1.84 0.00 0.00 41.12 41.97 2w3s n ASP 73 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 2w3s n ASN 74 N 2.16 1.17 -3.48 -2.24 5.15 -1.26 -4.59 115.26 112.17 2w3s n ASN 74 Ca 0.09 -2.85 -0.05 0.00 -0.60 0.00 0.00 54.58 51.17 2w3s n ASN 74 Cb 0.47 -0.64 -0.06 0.00 -0.53 0.00 0.00 39.78 39.01 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 -1.23 -0.55 0.00 1.20 2.15 -1.26 -3.94 116.67 113.05 2w3s s ASP 75 Ca 0.34 0.90 0.16 0.00 0.43 0.00 0.00 52.55 54.39 2w3s s ASP 75 Cb 0.11 1.66 0.25 0.00 -0.30 0.00 0.00 42.92 44.64 2w3s s ASP 75 CO -0.12 -0.25 1.15 0.00 -0.17 0.00 0.00 175.17 175.79 2w3s n ALA 76 N 5.40 2.40 -1.95 3.66 0.00 -0.38 -4.93 120.51 124.72 2w3s n ALA 76 Ca -0.07 -0.84 -0.41 0.00 0.00 0.00 0.00 53.44 52.12 2w3s n ALA 76 Cb 0.50 -0.60 -0.03 0.00 0.00 0.00 0.00 19.45 19.32 2w3s n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w3s s SER 77 N -1.26 6.74 0.00 0.00 0.15 -1.26 -4.85 113.70 113.22 2w3s s SER 77 Ca 0.25 2.54 0.02 0.00 0.70 0.00 0.00 55.95 59.46 2w3s s SER 77 Cb 0.15 -2.61 0.13 0.00 -1.71 0.00 0.00 66.02 61.99 2w3s s SER 77 CO 0.22 -0.65 0.97 -0.81 1.20 0.00 0.00 173.24 174.17 2w3s n PRO 78 N 2.75 0.88 -4.23 5.44 -0.04 -1.26 -4.83 135.00 133.70 2w3s n PRO 78 Ca 0.08 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.40 2w3s n PRO 78 Cb 0.41 -1.04 -0.10 0.00 -0.04 0.00 0.00 33.50 32.73 2w3s n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3s s ALA 79 N -2.00 1.35 -2.00 0.55 0.00 -1.26 -4.97 121.76 113.43 2w3s s ALA 79 Ca 0.03 -1.46 0.05 0.00 0.00 0.00 0.00 51.96 50.59 2w3s s ALA 79 Cb 0.02 0.07 0.32 0.00 0.00 0.00 0.00 23.12 23.52 2w3s s ALA 79 CO 0.03 -0.13 0.74 -0.35 0.00 0.00 0.00 175.76 176.06 2w3s n PRO 80 N -0.15 0.19 -4.46 0.00 -0.04 -1.26 -4.60 135.00 124.68 2w3s n PRO 80 Ca -0.11 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.02 2w3s n PRO 80 Cb 0.61 -1.43 -0.12 0.00 -0.04 0.00 0.00 33.50 32.51 2w3s n PRO 80 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2w3s s SER 81 N -1.98 4.75 0.45 3.54 1.04 -1.26 -5.09 113.70 115.16 2w3s s SER 81 Ca 0.08 -0.11 -0.24 0.00 0.48 0.00 0.00 55.95 56.16 2w3s s SER 81 Cb 0.04 -1.67 -0.09 0.00 0.10 0.00 0.00 66.02 64.40 2w3s s SER 81 CO 0.06 0.21 1.13 -0.81 0.98 0.00 0.00 173.24 174.81 2w3s n PRO 82 N 3.25 1.55 -3.53 4.02 -0.04 -1.26 -4.69 135.00 134.30 2w3s n PRO 82 Ca -0.18 0.56 -0.21 0.00 -0.04 0.00 0.00 63.50 63.64 2w3s n PRO 82 Cb 0.53 -2.23 -0.14 0.00 -0.04 0.00 0.00 33.50 31.62 2w3s n PRO 82 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2w3s s GLU 83 N -2.24 0.15 0.60 0.54 2.12 -1.26 -4.90 118.70 113.71 2w3s s GLU 83 Ca 0.64 0.10 -0.17 0.00 0.36 0.00 0.00 54.97 55.90 2w3s s GLU 83 Cb -0.51 -1.40 -0.03 0.00 0.26 0.00 0.00 34.13 32.45 2w3s s GLU 83 CO 0.56 -0.67 1.11 -1.25 -0.54 0.00 0.00 175.26 174.46 2w3s s PRO 84 N 2.27 3.10 0.01 4.30 0.04 -1.25 -1.25 135.00 142.22 2w3s s PRO 84 Ca 0.05 1.45 -0.06 0.00 0.04 0.00 0.00 61.00 62.49 2w3s s PRO 84 Cb -0.16 -1.99 -0.29 0.00 0.04 0.00 0.00 34.50 32.11 2w3s s PRO 84 CO -0.12 -1.02 0.91 0.28 0.04 0.00 0.00 177.00 177.09 2w3s h VAL 85 N 0.57 1.21 -3.74 -0.36 2.07 -1.92 -3.44 116.25 110.64 2w3s h VAL 85 Ca -0.48 -2.80 -0.69 0.00 0.82 0.00 0.00 66.70 63.55 2w3s h VAL 85 Cb 1.25 2.83 -0.32 0.00 -1.52 0.00 0.00 31.29 33.53 2w3s h VAL 85 CO 0.56 0.84 -0.88 -0.76 0.02 0.00 0.00 177.57 177.34 2w3s s LEU 86 N -7.12 2.11 0.04 2.57 1.43 -1.26 -4.63 118.68 111.82 2w3s s LEU 86 Ca -0.09 -0.52 -0.38 0.00 -1.03 0.00 0.00 54.13 52.11 2w3s s LEU 86 Cb 0.06 -1.40 -0.18 0.00 0.03 0.00 0.00 46.19 44.71 2w3s s LEU 86 CO 0.87 0.21 1.24 0.00 0.23 0.00 0.00 176.35 178.90 2w3s n ALA 87 N 3.17 -2.03 -3.38 4.21 0.00 -0.70 -4.67 120.51 117.11 2w3s n ALA 87 Ca -0.18 0.55 -0.38 0.00 0.00 0.00 0.00 53.44 53.43 2w3s n ALA 87 Cb 0.52 -1.95 -0.04 0.00 0.00 0.00 0.00 19.45 17.99 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 2.15 3.82 -0.92 0.00 -2.24 -1.26 -4.47 114.28 111.35 2w3s n THR 88 Ca 0.19 -5.40 0.00 0.00 -2.27 0.00 0.00 64.05 56.57 2w3s n THR 88 Cb 0.14 -2.29 0.00 0.00 -2.10 0.00 0.00 70.33 66.08 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 1.86 1.04 3.56 3.38 0.00 -1.26 -4.94 105.19 108.83 2w3s n GLY 89 Ca 0.25 0.00 -0.06 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 -0.05 0.48 0.18 1.61 -1.05 -1.26 -2.01 118.70 116.60 2w3s s GLU 90 Ca 0.00 -0.17 0.10 0.00 -0.15 0.00 0.00 54.97 54.75 2w3s s GLU 90 Cb 0.00 0.22 -0.04 0.00 -0.44 0.00 0.00 34.13 33.87 2w3s s GLU 90 CO 0.00 -0.21 -0.21 0.14 0.95 0.00 0.00 175.26 175.93 2w3s s VAL 91 N -2.65 2.10 0.00 1.83 -7.23 0.29 -4.81 120.40 109.93 2w3s s VAL 91 Ca 0.08 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 2w3s s VAL 91 Cb -0.01 -1.99 0.00 0.00 0.56 0.00 0.00 36.38 34.94 2w3s s VAL 91 CO -0.06 -0.22 0.15 1.41 -0.31 0.00 0.00 175.10 176.07 2w3s n HIS 92 N 0.26 0.00 -3.73 2.82 8.25 -1.26 -2.71 115.22 118.85 2w3s n HIS 92 Ca -0.13 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.27 2w3s n HIS 92 Cb 0.57 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.66 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 -0.16 -0.23 -0.33 4.41 -0.12 -1.07 -3.98 117.98 116.50 2w3s s PHE 93 Ca 0.00 -0.12 -0.29 0.00 -0.05 0.00 0.00 56.93 56.47 2w3s s PHE 93 Cb 0.00 0.65 0.01 0.00 -0.63 0.00 0.00 43.02 43.05 2w3s s PHE 93 CO 0.00 -0.98 1.21 0.08 -0.05 0.00 0.00 175.22 175.47 2w3s s VAL 94 N -3.60 4.27 0.00 -2.49 1.01 -1.14 -3.17 120.40 115.28 2w3s s VAL 94 Ca 0.10 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.50 2w3s s VAL 94 Cb -0.03 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2w3s s VAL 94 CO 0.01 -0.55 0.00 0.61 0.00 0.00 0.00 175.10 175.18 2w3s n GLY 95 N 4.24 0.54 3.67 4.51 0.00 -0.60 -4.81 105.19 112.74 2w3s n GLY 95 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 4.30 0.27 1.61 0.74 -1.19 -4.46 119.66 120.94 2w3s s GLN 96 Ca 0.00 1.62 -0.31 0.00 0.05 0.00 0.00 55.36 56.73 2w3s s GLN 96 Cb 0.00 -3.64 -0.12 0.00 1.10 0.00 0.00 33.01 30.35 2w3s s GLN 96 CO 0.00 -0.55 1.59 -2.30 -0.55 0.00 0.00 175.29 173.48 2w3s n PRO 97 N 5.81 2.62 -0.04 1.67 -0.02 -1.26 0.10 135.00 143.88 2w3s n PRO 97 Ca 0.12 0.93 -0.08 0.00 -2.02 0.00 0.00 63.50 62.45 2w3s n PRO 97 Cb 0.46 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.19 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 2.39 0.49 -4.26 4.25 5.41 0.15 -1.72 119.36 126.06 2w3s n ILE 98 Ca 0.10 -0.15 -0.14 0.00 1.00 0.00 0.00 62.75 63.56 2w3s n ILE 98 Cb 0.36 -1.29 -0.10 0.00 -0.71 0.00 0.00 39.64 37.89 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 -2.17 1.33 -0.04 1.39 -0.12 -1.17 -4.05 117.98 113.15 2w3s s PHE 99 Ca -0.12 -1.19 0.03 0.00 -0.05 0.00 0.00 56.93 55.61 2w3s s PHE 99 Cb 0.04 -0.75 0.00 0.00 -0.63 0.00 0.00 43.02 41.68 2w3s s PHE 99 CO 0.17 -0.38 -0.14 -1.17 -0.05 0.00 0.00 175.22 173.64 2w3s s LEU 100 N -3.23 1.84 -0.15 -1.99 2.96 -0.21 0.08 118.68 117.98 2w3s s LEU 100 Ca 0.34 -0.31 -0.02 0.00 -0.22 0.00 0.00 54.13 53.92 2w3s s LEU 100 Cb 0.07 -0.85 -0.02 0.00 0.50 0.00 0.00 46.19 45.89 2w3s s LEU 100 CO 0.10 0.11 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.47 2w3s s VAL 101 N 0.20 3.44 -0.23 1.68 1.01 0.12 0.13 120.40 126.75 2w3s s VAL 101 Ca -0.06 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 2w3s s VAL 101 Cb -0.12 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2w3s s VAL 101 CO 0.02 0.50 0.05 0.00 0.00 0.00 0.00 175.10 175.67 2w3s s ALA 102 N 0.43 3.14 0.21 5.51 0.00 0.11 -1.59 121.76 129.57 2w3s s ALA 102 Ca -0.07 -1.05 -0.06 0.00 0.00 0.00 0.00 51.96 50.79 2w3s s ALA 102 Cb -0.15 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.98 2w3s s ALA 102 CO 0.04 -0.31 0.26 0.00 0.00 0.00 0.00 175.76 175.75 2w3s s ALA 103 N 1.29 0.56 -2.00 0.00 0.00 -0.07 0.64 121.76 122.18 2w3s s ALA 103 Ca 0.04 -1.33 0.11 0.00 0.00 0.00 0.00 51.96 50.79 2w3s s ALA 103 Cb -0.15 1.20 0.67 0.00 0.00 0.00 0.00 23.12 24.84 2w3s s ALA 103 CO 0.03 -0.68 1.27 0.25 0.00 0.00 0.00 175.76 176.63 2w3s n THR 104 N -0.29 0.00 -3.49 0.00 -2.24 0.98 -0.48 114.28 108.76 2w3s n THR 104 Ca -0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 2w3s n THR 104 Cb 0.64 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 2w3s n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2w3s s SER 105 N -1.55 -0.46 0.18 3.42 1.04 -1.26 -4.85 113.70 110.22 2w3s s SER 105 Ca 0.17 0.10 -0.09 0.00 0.48 0.00 0.00 55.95 56.60 2w3s s SER 105 Cb 0.08 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.71 2w3s s SER 105 CO 0.13 -0.70 1.62 -0.74 0.98 0.00 0.00 173.24 174.52 2w3s h HIS 106 N 2.14 1.17 0.22 5.02 2.76 -1.89 -1.44 115.15 123.13 2w3s h HIS 106 Ca -0.26 -0.22 -0.01 0.00 -2.20 0.00 0.00 60.37 57.68 2w3s h HIS 106 Cb 1.25 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.91 2w3s h HIS 106 CO 0.26 1.05 -0.15 0.00 -1.30 0.00 0.00 177.93 177.79 2w3s h ARG 107 N 0.96 -0.34 -1.00 5.26 2.47 -1.98 -2.08 114.38 117.67 2w3s h ARG 107 Ca 0.16 0.02 0.31 0.00 -1.26 0.00 0.00 59.98 59.21 2w3s h ARG 107 Cb 0.61 0.08 -0.18 0.00 -1.65 0.00 0.00 29.97 28.83 2w3s h ARG 107 CO 0.04 -0.22 0.15 0.00 0.56 0.00 0.00 179.97 180.49 2w3s h ALA 108 N -1.63 1.42 -0.15 0.04 0.00 -1.87 0.23 119.26 117.29 2w3s h ALA 108 Ca -0.03 0.33 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2w3s h ALA 108 Cb 0.29 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2w3s h ALA 108 CO 0.02 -0.67 0.06 0.00 0.00 0.00 0.00 179.25 178.66 2w3s h ALA 109 N 2.00 0.19 -0.19 0.00 0.00 -1.11 -1.17 119.26 118.98 2w3s h ALA 109 Ca 0.67 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.47 2w3s h ALA 109 Cb 1.49 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2w3s h ALA 109 CO -0.89 -0.22 0.11 0.00 0.00 0.00 0.00 179.25 178.25 2w3s h ARG 110 N 0.08 0.26 -0.43 0.00 3.08 0.08 -1.02 114.38 116.44 2w3s h ARG 110 Ca 0.05 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.16 2w3s h ARG 110 Cb 0.17 -0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.07 2w3s h ARG 110 CO -0.00 0.22 -0.29 0.82 -1.07 0.00 0.00 179.97 179.65 2w3s h ILE 111 N 0.23 0.27 0.00 2.04 2.04 -0.88 -2.11 117.51 119.09 2w3s h ILE 111 Ca 0.07 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.80 2w3s h ILE 111 Cb 0.03 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2w3s h ILE 111 CO -0.01 0.00 -0.59 0.00 0.00 0.00 0.00 178.15 177.55 2w3s h ALA 112 N 0.92 1.02 -0.68 1.87 0.00 -0.97 -2.72 119.26 118.70 2w3s h ALA 112 Ca 0.19 -0.54 0.11 0.00 0.00 0.00 0.00 54.91 54.67 2w3s h ALA 112 Cb 0.52 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2w3s h ALA 112 CO -0.55 0.74 0.45 0.00 0.00 0.00 0.00 179.25 179.89 2w3s h ALA 113 N 1.41 1.98 0.00 0.00 0.00 -0.49 -0.89 119.26 121.27 2w3s h ALA 113 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2w3s h ALA 113 Cb 1.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2w3s h ALA 113 CO 0.08 -0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.73 2w3s n ARG 114 N -4.48 0.75 -0.37 0.00 1.74 -1.02 -3.94 116.66 109.34 2w3s n ARG 114 Ca 0.12 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.27 2w3s n ARG 114 Cb 0.40 -1.33 0.23 0.00 -1.02 0.00 0.00 32.46 30.74 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 -0.83 3.04 -2.66 5.56 5.02 -0.34 -4.99 118.16 122.96 2w3s n LYS 115 Ca 0.12 -2.55 -0.38 0.00 -2.02 0.00 0.00 58.31 53.48 2w3s n LYS 115 Cb 0.06 -1.64 -0.05 0.00 -0.02 0.00 0.00 35.03 33.38 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 -2.01 3.25 -0.49 7.82 0.00 -1.25 -4.24 121.76 124.84 2w3s s ALA 116 Ca 0.36 0.66 -0.15 0.00 0.00 0.00 0.00 51.96 52.83 2w3s s ALA 116 Cb 0.26 -3.24 0.09 0.00 0.00 0.00 0.00 23.12 20.23 2w3s s ALA 116 CO 0.13 0.03 0.41 1.03 0.00 0.00 0.00 175.76 177.36 2w3s s ARG 117 N -1.84 2.93 -0.12 0.00 0.52 -0.47 -5.03 118.95 114.93 2w3s s ARG 117 Ca 0.49 -1.47 -0.01 0.00 -0.52 0.00 0.00 55.73 54.21 2w3s s ARG 117 Cb -0.24 -4.14 -0.02 0.00 0.52 0.00 0.00 34.95 31.08 2w3s s ARG 117 CO 0.30 -1.11 -0.08 0.42 0.02 0.00 0.00 175.30 174.85 2w3s s ILE 118 N 1.60 3.50 -0.15 1.52 1.01 -1.26 -0.44 121.20 126.97 2w3s s ILE 118 Ca 0.04 -0.52 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 2w3s s ILE 118 Cb -0.26 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 2w3s s ILE 118 CO 0.05 0.53 -0.05 0.42 0.00 0.00 0.00 174.94 175.89 2w3s s THR 119 N 0.06 3.79 0.19 2.92 -4.23 0.15 -4.98 115.64 113.55 2w3s s THR 119 Ca -0.03 -0.39 0.09 0.00 -1.18 0.00 0.00 61.69 60.18 2w3s s THR 119 Cb -0.14 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 2w3s s THR 119 CO 0.04 0.50 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.21 2w3s s TYR 120 N 0.35 2.64 -0.76 3.99 1.51 -1.26 -1.28 117.35 122.54 2w3s s TYR 120 Ca -0.05 -0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 55.78 2w3s s TYR 120 Cb -0.14 -1.28 0.19 0.00 -0.11 0.00 0.00 41.96 40.61 2w3s s TYR 120 CO 0.03 0.52 0.60 0.00 -1.11 0.00 0.00 175.55 175.59 2w3s s ALA 121 N -1.75 3.92 0.89 3.71 0.00 -0.47 -4.88 121.76 123.18 2w3s s ALA 121 Ca 0.25 -3.63 -0.14 0.00 0.00 0.00 0.00 51.96 48.45 2w3s s ALA 121 Cb -0.09 -2.64 0.01 0.00 0.00 0.00 0.00 23.12 20.41 2w3s s ALA 121 CO 0.15 -2.12 0.43 -2.30 0.00 0.00 0.00 175.76 171.92 2w3s n PRO 122 N 2.68 -0.12 -4.14 0.00 -0.02 -1.26 -3.14 135.00 129.00 2w3s n PRO 122 Ca 0.16 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.56 2w3s n PRO 122 Cb 0.37 -1.84 -0.10 0.00 -0.02 0.00 0.00 33.50 31.90 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 -3.38 0.87 0.35 -0.52 0.52 -0.00 -4.88 118.95 111.91 2w3s s ARG 123 Ca 0.59 -1.40 -0.29 0.00 -0.52 0.00 0.00 55.73 54.12 2w3s s ARG 123 Cb -0.25 0.20 -0.11 0.00 0.52 0.00 0.00 34.95 35.31 2w3s s ARG 123 CO 0.65 -0.22 1.48 -1.25 0.02 0.00 0.00 175.30 175.98 2w3s s PRO 124 N -4.01 4.15 -0.10 3.54 0.04 -1.26 -4.68 135.00 132.69 2w3s s PRO 124 Ca 0.20 2.52 0.03 0.00 0.04 0.00 0.00 61.00 63.79 2w3s s PRO 124 Cb 0.07 -3.00 0.01 0.00 0.04 0.00 0.00 34.50 31.63 2w3s s PRO 124 CO -0.01 -0.50 -0.19 0.00 0.04 0.00 0.00 177.00 176.34 2w3s s ALA 125 N -0.90 1.84 -0.62 8.56 0.00 -1.26 -4.93 121.76 124.45 2w3s s ALA 125 Ca 0.54 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 51.45 2w3s s ALA 125 Cb -0.46 -0.76 0.03 0.00 0.00 0.00 0.00 23.12 21.94 2w3s s ALA 125 CO 0.59 0.15 1.16 0.42 0.00 0.00 0.00 175.76 178.07 2w3s s ILE 126 N 0.59 4.03 -0.04 0.00 1.09 -1.26 -4.82 121.20 120.79 2w3s s ILE 126 Ca -0.14 0.61 0.06 0.00 -1.10 0.00 0.00 60.65 60.08 2w3s s ILE 126 Cb -0.17 -4.74 -0.09 0.00 -1.06 0.00 0.00 42.46 36.41 2w3s s ILE 126 CO 0.05 -1.43 0.07 0.18 -0.10 0.00 0.00 174.94 173.71 2w3s n LEU 127 N 8.44 0.00 -4.58 2.97 4.77 -1.26 -0.62 117.00 126.72 2w3s n LEU 127 Ca 0.05 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.73 2w3s n LEU 127 Cb 0.49 0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.56 2w3s n LEU 127 CO 0.70 0.09 -0.42 0.42 -1.33 0.00 0.00 177.39 176.85 2w3s s THR 128 N -2.28 3.40 0.49 -5.08 -4.23 -1.26 -4.96 115.64 101.72 2w3s s THR 128 Ca -0.03 -1.20 0.19 0.00 -1.18 0.00 0.00 61.69 59.48 2w3s s THR 128 Cb 0.03 -2.57 0.35 0.00 1.34 0.00 0.00 72.50 71.65 2w3s s THR 128 CO 0.26 0.16 2.01 -0.07 -0.54 0.00 0.00 174.62 176.44 2w3s h LEU 129 N 3.75 0.15 0.13 4.79 4.07 -1.97 -1.12 115.31 125.11 2w3s h LEU 129 Ca -0.49 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.47 2w3s h LEU 129 Cb 1.17 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2w3s h LEU 129 CO 0.52 0.09 -0.06 0.44 -1.08 0.00 0.00 178.44 178.35 2w3s h ASP 130 N 0.16 -0.15 -1.08 -0.43 3.32 -1.99 -1.44 116.42 114.81 2w3s h ASP 130 Ca 0.23 -0.32 0.29 0.00 0.02 0.00 0.00 57.03 57.25 2w3s h ASP 130 Cb 0.69 0.04 -0.09 0.00 0.22 0.00 0.00 39.33 40.20 2w3s h ASP 130 CO -0.03 0.27 0.72 1.56 -1.72 0.00 0.00 179.24 180.03 2w3s h GLN 131 N -0.60 0.28 0.12 3.56 4.20 -1.75 0.70 115.11 121.62 2w3s h GLN 131 Ca -0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2w3s h GLN 131 Cb 0.46 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2w3s h GLN 131 CO 0.03 0.18 -0.06 0.00 -0.67 0.00 0.00 178.83 178.32 2w3s h ALA 132 N 1.58 -0.16 -0.60 3.87 0.00 -0.83 0.21 119.26 123.33 2w3s h ALA 132 Ca 0.60 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.37 2w3s h ALA 132 Cb 1.73 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 2w3s h ALA 132 CO -0.24 -0.44 0.38 -0.07 0.00 0.00 0.00 179.25 178.88 2w3s h LEU 133 N -0.45 0.62 -0.05 0.00 -0.00 0.03 0.21 115.31 115.68 2w3s h LEU 133 Ca -0.02 -0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.89 2w3s h LEU 133 Cb 0.37 -0.14 -0.04 0.00 -0.00 0.00 0.00 40.66 40.85 2w3s h LEU 133 CO 0.03 0.44 -0.17 0.00 -0.00 0.00 0.00 178.44 178.74 2w3s h ALA 134 N 1.25 -0.17 0.00 1.53 0.00 0.50 -2.31 119.26 120.07 2w3s h ALA 134 Ca 0.24 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2w3s h ALA 134 Cb -0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2w3s h ALA 134 CO -0.09 -0.65 -0.19 0.00 0.00 0.00 0.00 179.25 178.33 2w3s n ALA 135 N -2.54 2.65 -1.74 0.00 0.00 0.73 -4.92 120.51 114.69 2w3s n ALA 135 Ca -0.04 -0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.14 2w3s n ALA 135 Cb 0.22 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.76 -3.86 -4.56 0.00 2.03 0.54 -4.96 116.55 103.98 2w3s n ASP 136 Ca 0.06 0.13 -0.35 0.00 0.52 0.00 0.00 54.79 55.15 2w3s n ASP 136 Cb 0.37 -2.69 -0.04 0.00 -0.72 0.00 0.00 41.12 38.05 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 -2.71 5.69 0.07 1.67 0.15 0.02 -4.92 113.70 113.67 2w3s s SER 137 Ca 0.00 -0.68 -0.14 0.00 0.70 0.00 0.00 55.95 55.84 2w3s s SER 137 Cb 0.00 -2.56 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 2w3s s SER 137 CO 0.00 -2.20 0.31 0.00 1.20 0.00 0.00 173.24 172.55 2w3s s ARG 138 N 6.27 0.89 0.12 5.44 1.70 -1.26 -0.02 118.95 132.09 2w3s s ARG 138 Ca 0.58 -0.64 0.01 0.00 -0.47 0.00 0.00 55.73 55.21 2w3s s ARG 138 Cb -0.06 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 34.67 2w3s s ARG 138 CO 0.03 -0.31 0.27 -0.06 -1.08 0.00 0.00 175.30 174.15 2w3s s PHE 139 N -3.15 3.50 0.00 5.89 0.40 0.12 -4.55 117.98 120.19 2w3s s PHE 139 Ca -0.01 0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.52 2w3s s PHE 139 Cb 0.01 -1.73 0.00 0.00 0.51 0.00 0.00 43.02 41.81 2w3s s PHE 139 CO -0.07 0.53 0.00 0.39 0.70 0.00 0.00 175.22 176.77 2w3s n GLU 140 N -0.21 0.00 -2.48 0.44 1.02 -1.26 -4.52 120.64 113.63 2w3s n GLU 140 Ca -0.06 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.06 2w3s n GLU 140 Cb 0.53 -0.96 -0.02 0.00 -0.02 0.00 0.00 31.44 30.97 2w3s n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w3s n GLY 141 N -2.00 -4.45 0.00 0.62 0.00 -1.26 -4.98 105.19 93.12 2w3s n GLY 141 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.84 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 0.94 -1.70 3.77 -0.02 0.00 -1.26 -5.00 105.19 101.93 2w3s n GLY 142 Ca -0.15 -1.52 -0.32 0.00 0.00 0.00 0.00 46.02 44.03 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 -3.15 2.58 -0.09 1.61 0.04 -1.26 -4.90 135.00 129.83 2w3s s PRO 143 Ca 0.00 1.27 -0.22 0.00 0.04 0.00 0.00 61.00 62.09 2w3s s PRO 143 Cb 0.00 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 2w3s s PRO 143 CO 0.00 -1.41 0.63 0.08 0.04 0.00 0.00 177.00 176.34 2w3s s VAL 144 N -2.62 5.09 -0.12 -0.36 1.01 0.08 -4.86 120.40 118.62 2w3s s VAL 144 Ca 0.64 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.91 2w3s s VAL 144 Cb -0.19 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.24 2w3s s VAL 144 CO 0.48 0.27 -0.11 -0.63 0.00 0.00 0.00 175.10 175.10 2w3s s ILE 145 N 0.80 1.28 -0.06 2.22 1.01 -1.26 0.16 121.20 125.36 2w3s s ILE 145 Ca 0.34 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.56 2w3s s ILE 145 Cb -0.17 -1.23 -0.00 0.00 0.01 0.00 0.00 42.46 41.07 2w3s s ILE 145 CO 0.15 0.41 -0.21 0.26 0.00 0.00 0.00 174.94 175.55 2w3s s TRP 146 N 1.38 2.06 -0.01 3.97 0.51 -0.79 -4.93 118.94 121.13 2w3s s TRP 146 Ca 0.00 -0.64 0.02 0.00 -2.12 0.00 0.00 56.10 53.37 2w3s s TRP 146 Cb -0.13 -1.37 -0.00 0.00 -0.81 0.00 0.00 33.47 31.15 2w3s s TRP 146 CO -0.06 -0.22 -0.07 0.00 -0.51 0.00 0.00 176.95 176.10 2w3s s ALA 147 N 0.02 0.59 -0.12 0.98 0.00 -1.26 -0.04 121.76 121.93 2w3s s ALA 147 Ca -0.06 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.66 2w3s s ALA 147 Cb -0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.81 2w3s s ALA 147 CO 0.03 0.13 -0.21 0.50 0.00 0.00 0.00 175.76 176.21 2w3s s ARG 148 N -0.05 3.11 4.79 0.00 3.52 0.20 -4.98 118.95 125.55 2w3s s ARG 148 Ca 0.01 -0.83 0.00 0.00 -0.13 0.00 0.00 55.73 54.78 2w3s s ARG 148 Cb -0.04 -2.41 0.00 0.00 -1.56 0.00 0.00 34.95 30.94 2w3s s ARG 148 CO -0.00 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.03 2w3s n GLY 149 N 3.67 1.65 2.53 8.12 0.00 -1.26 -0.12 105.19 119.78 2w3s n GLY 149 Ca -0.19 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 44.95 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 2.82 0.18 1.61 -1.08 -1.26 -4.88 116.67 110.06 2w3s s ASP 150 Ca 0.00 -1.84 -0.17 0.00 -0.52 0.00 0.00 52.55 50.03 2w3s s ASP 150 Cb 0.00 -0.23 0.14 0.00 -1.46 0.00 0.00 42.92 41.37 2w3s s ASP 150 CO 0.00 -0.34 1.65 0.58 0.52 0.00 0.00 175.17 177.58 2w3s h VAL 151 N 5.41 0.48 -0.43 1.11 2.07 -1.85 -2.20 116.25 120.83 2w3s h VAL 151 Ca -0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.56 2w3s h VAL 151 Cb 0.99 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2w3s h VAL 151 CO 0.30 0.00 0.16 -0.08 0.02 0.00 0.00 177.57 177.97 2w3s h GLU 152 N -0.04 0.32 0.37 1.57 4.57 -1.98 0.44 114.58 119.83 2w3s h GLU 152 Ca 0.23 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2w3s h GLU 152 Cb 0.38 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2w3s h GLU 152 CO -0.50 0.21 -0.18 1.15 -1.18 0.00 0.00 179.01 178.51 2w3s h THR 153 N 0.33 0.64 -0.12 0.32 2.02 -1.97 -1.42 112.91 112.71 2w3s h THR 153 Ca 0.20 -0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.43 2w3s h THR 153 Cb 0.19 0.64 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 2w3s h THR 153 CO -0.20 0.00 -0.29 0.00 0.37 0.00 0.00 175.52 175.40 2w3s h ALA 154 N 0.15 -0.31 -0.92 6.16 0.00 -0.53 -2.38 119.26 121.43 2w3s h ALA 154 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2w3s h ALA 154 Cb 0.38 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 2w3s h ALA 154 CO 0.08 -0.76 0.58 -0.07 0.00 0.00 0.00 179.25 179.08 2w3s h LEU 155 N -0.36 1.08 -1.37 0.00 3.38 -0.16 -1.60 115.31 116.29 2w3s h LEU 155 Ca 0.10 -0.05 0.19 0.00 0.09 0.00 0.00 57.88 58.20 2w3s h LEU 155 Cb 0.51 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 2w3s h LEU 155 CO -0.33 0.81 0.59 0.00 0.09 0.00 0.00 178.44 179.61 2w3s h ALA 156 N 1.32 2.02 -0.62 1.53 0.00 -0.73 -1.49 119.26 121.28 2w3s h ALA 156 Ca 0.33 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2w3s h ALA 156 Cb -0.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2w3s h ALA 156 CO -0.07 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.28 2w3s n GLY 157 N -1.46 2.88 3.64 0.00 0.00 -0.62 -4.99 105.19 104.64 2w3s n GLY 157 Ca 0.20 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.35 3.56 0.47 4.61 0.00 -0.56 -4.91 121.76 122.57 2w3s s ALA 158 Ca 0.54 -0.02 0.28 0.00 0.00 0.00 0.00 51.96 52.75 2w3s s ALA 158 Cb 0.38 -3.59 1.34 0.00 0.00 0.00 0.00 23.12 21.24 2w3s s ALA 158 CO 0.20 -1.32 1.79 0.00 0.00 0.00 0.00 175.76 176.43 2w3s h ALA 159 N 7.90 2.68 -3.62 0.00 0.00 -1.75 -3.41 119.26 121.06 2w3s h ALA 159 Ca -0.20 0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.48 2w3s h ALA 159 Cb 1.06 0.06 -0.29 0.00 0.00 0.00 0.00 17.79 18.63 2w3s h ALA 159 CO 1.00 -1.06 -0.69 -1.01 0.00 0.00 0.00 179.25 177.49 2w3s s HIS 160 N -5.21 -0.03 -0.01 0.00 3.76 -0.13 -4.95 115.29 108.72 2w3s s HIS 160 Ca -0.07 0.10 0.01 0.00 -0.15 0.00 0.00 55.06 54.95 2w3s s HIS 160 Cb 0.24 -0.03 0.01 0.00 1.11 0.00 0.00 32.58 33.91 2w3s s HIS 160 CO 0.80 -0.03 -0.01 -1.17 -0.85 0.00 0.00 174.74 173.48 2w3s s LEU 161 N 0.24 1.59 -0.29 0.89 2.96 -1.26 -0.94 118.68 121.87 2w3s s LEU 161 Ca -0.02 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 2w3s s LEU 161 Cb -0.03 -0.15 0.08 0.00 0.50 0.00 0.00 46.19 46.59 2w3s s LEU 161 CO -0.01 -0.04 0.01 0.00 -1.32 0.00 0.00 176.35 175.00 2w3s s ALA 162 N 0.47 2.21 -0.01 5.97 0.00 -0.23 -4.95 121.76 125.21 2w3s s ALA 162 Ca -0.04 -1.83 -0.16 0.00 0.00 0.00 0.00 51.96 49.93 2w3s s ALA 162 Cb -0.07 -1.66 -0.06 0.00 0.00 0.00 0.00 23.12 21.34 2w3s s ALA 162 CO -0.01 -1.46 0.44 -1.21 0.00 0.00 0.00 175.76 173.52 2w3s s GLU 163 N 1.27 4.04 0.10 0.00 2.02 -1.26 -2.23 118.70 122.63 2w3s s GLU 163 Ca 0.03 0.46 -0.27 0.00 0.02 0.00 0.00 54.97 55.21 2w3s s GLU 163 Cb -0.19 -3.27 0.08 0.00 0.10 0.00 0.00 34.13 30.85 2w3s s GLU 163 CO -0.11 0.58 0.98 0.20 0.02 0.00 0.00 175.26 176.93 2w3s s GLY 164 N -0.73 -0.30 -0.18 -1.39 0.00 -0.19 -5.01 107.32 99.50 2w3s s GLY 164 Ca 0.25 0.40 -0.16 0.00 0.00 0.00 0.00 44.72 45.20 2w3s s GLY 164 CO 0.13 0.10 0.49 0.00 0.00 0.00 0.00 173.10 173.82 2w3s s PHE 166 N 0.37 -0.35 -0.16 0.00 -0.12 0.40 -4.99 117.98 113.13 2w3s s PHE 166 Ca -0.01 0.15 -0.09 0.00 -0.05 0.00 0.00 56.93 56.93 2w3s s PHE 166 Cb -0.04 0.57 -0.05 0.00 -0.63 0.00 0.00 43.02 42.87 2w3s s PHE 166 CO -0.01 -0.70 0.15 -1.21 -0.05 0.00 0.00 175.22 173.41 2w3s s GLU 167 N -3.34 3.89 -0.20 1.99 0.41 -1.26 -1.14 118.70 119.05 2w3s s GLU 167 Ca 0.05 -0.14 -0.03 0.00 -0.41 0.00 0.00 54.97 54.44 2w3s s GLU 167 Cb -0.01 -3.32 -0.01 0.00 -1.78 0.00 0.00 34.13 29.01 2w3s s GLU 167 CO -0.07 0.50 -0.07 0.42 -0.49 0.00 0.00 175.26 175.54 2w3s s ILE 168 N -0.23 3.23 0.76 -1.63 1.01 0.14 -1.51 121.20 122.98 2w3s s ILE 168 Ca 0.12 -0.55 -0.11 0.00 0.00 0.00 0.00 60.65 60.11 2w3s s ILE 168 Cb -0.12 -2.44 0.06 0.00 0.01 0.00 0.00 42.46 39.97 2w3s s ILE 168 CO 0.01 0.45 1.12 -0.83 0.00 0.00 0.00 174.94 175.70 2w3s s GLY 169 N 1.20 1.62 0.00 6.18 0.00 -0.98 -0.29 107.32 115.04 2w3s s GLY 169 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.09 2w3s s GLY 169 CO -0.02 -0.21 0.00 0.61 0.00 0.00 0.00 173.10 173.48 2w3s n GLY 170 N -3.15 -2.32 3.55 0.20 0.00 -1.26 -4.48 105.19 97.72 2w3s n GLY 170 Ca 0.08 -1.29 0.01 0.00 0.00 0.00 0.00 46.02 44.82 2w3s n GLY 170 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2w3s s GLN 171 N 0.00 0.17 -0.20 1.61 0.74 -1.22 -4.86 119.66 115.90 2w3s s GLN 171 Ca 0.00 0.33 -0.16 0.00 0.05 0.00 0.00 55.36 55.58 2w3s s GLN 171 Cb 0.00 0.09 -0.04 0.00 1.10 0.00 0.00 33.01 34.16 2w3s s GLN 171 CO 0.00 -0.04 0.40 -2.00 -0.55 0.00 0.00 175.29 173.10 2w3s s GLU 172 N 1.46 4.17 0.20 1.67 2.56 -1.26 -0.76 118.70 126.73 2w3s s GLU 172 Ca -0.06 0.20 -0.22 0.00 0.00 0.00 0.00 54.97 54.89 2w3s s GLU 172 Cb -0.03 -3.54 0.12 0.00 2.00 0.00 0.00 34.13 32.68 2w3s s GLU 172 CO -0.13 -0.05 1.48 0.72 -0.56 0.00 0.00 175.26 176.72 2w3s n HIS 173 N 4.51 -0.14 -3.94 5.30 8.25 -1.26 -4.89 115.22 123.06 2w3s n HIS 173 Ca -0.08 1.19 -0.27 0.00 -0.26 0.00 0.00 57.72 58.30 2w3s n HIS 173 Cb 0.51 -0.75 -0.01 0.00 1.12 0.00 0.00 29.99 30.86 2w3s n HIS 173 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2w3s n PHE 174 N -5.33 -1.80 -1.68 4.41 7.35 -1.26 -4.91 117.46 114.24 2w3s n PHE 174 Ca 0.07 0.79 -0.45 0.00 -0.76 0.00 0.00 57.45 57.10 2w3s n PHE 174 Cb 0.33 -3.79 -0.04 0.00 0.35 0.00 0.00 39.48 36.33 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 -4.41 2.41 -0.10 -5.13 0.18 -1.26 -4.91 117.16 103.93 2w3s n TYR 175 Ca -0.21 0.19 -0.01 0.00 1.88 0.00 0.00 57.90 59.75 2w3s n TYR 175 Cb 0.64 -2.59 0.26 0.00 -0.38 0.00 0.00 39.34 37.26 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 6.36 0.69 -8.95 -3.48 -0.00 -1.88 -3.36 115.31 104.70 2w3s h LEU 176 Ca -0.45 -0.09 -0.60 0.00 -0.00 0.00 0.00 57.88 56.75 2w3s h LEU 176 Cb 1.24 -0.18 -0.09 0.00 -0.00 0.00 0.00 40.66 41.63 2w3s h LEU 176 CO 0.91 0.63 0.46 -0.70 -0.00 0.00 0.00 178.44 179.74 2w3s s GLU 177 N -5.33 4.03 0.99 1.13 2.12 -0.44 -5.05 118.70 116.16 2w3s s GLU 177 Ca -0.09 0.72 -0.12 0.00 0.36 0.00 0.00 54.97 55.83 2w3s s GLU 177 Cb 0.16 -3.71 0.19 0.00 0.26 0.00 0.00 34.13 31.03 2w3s s GLU 177 CO 0.78 -0.66 1.08 0.20 -0.54 0.00 0.00 175.26 176.12 2w3s s GLY 178 N 1.55 1.58 0.47 -1.50 0.00 -1.26 -4.79 107.32 103.38 2w3s s GLY 178 Ca 0.34 -0.21 -0.22 0.00 0.00 0.00 0.00 44.72 44.62 2w3s s GLY 178 CO 0.11 0.38 0.98 -1.06 0.00 0.00 0.00 173.10 173.51 2w3s n GLN 179 N -4.22 1.22 -3.62 2.90 1.13 -1.26 -4.92 117.38 108.61 2w3s n GLN 179 Ca 0.06 0.45 -0.07 0.00 -1.94 0.00 0.00 57.00 55.50 2w3s n GLN 179 Cb 0.56 -2.07 -0.05 0.00 0.11 0.00 0.00 30.24 28.78 2w3s n GLN 179 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2w3s s ALA 180 N -1.36 -2.04 0.17 -1.58 0.00 -1.26 -2.40 121.76 113.28 2w3s s ALA 180 Ca 0.66 1.74 -0.19 0.00 0.00 0.00 0.00 51.96 54.18 2w3s s ALA 180 Cb -0.51 -1.25 0.04 0.00 0.00 0.00 0.00 23.12 21.40 2w3s s ALA 180 CO 0.54 -0.24 0.51 0.00 0.00 0.00 0.00 175.76 176.58 2w3s s ALA 181 N -0.66 -1.11 -0.15 0.00 0.00 -0.34 -0.80 121.76 118.70 2w3s s ALA 181 Ca 0.04 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.92 2w3s s ALA 181 Cb -0.02 0.82 0.05 0.00 0.00 0.00 0.00 23.12 23.97 2w3s s ALA 181 CO -0.05 -0.76 0.35 -1.17 0.00 0.00 0.00 175.76 174.13 2w3s s LEU 182 N -2.82 0.08 -0.12 0.00 2.96 0.16 -1.97 118.68 116.96 2w3s s LEU 182 Ca 0.05 0.75 0.03 0.00 -0.22 0.00 0.00 54.13 54.75 2w3s s LEU 182 Cb -0.00 1.11 0.00 0.00 0.50 0.00 0.00 46.19 47.80 2w3s s LEU 182 CO -0.08 -0.18 -0.22 0.00 -1.32 0.00 0.00 176.35 174.54 2w3s s ALA 183 N 1.39 2.23 -0.30 5.97 0.00 -0.67 -0.65 121.76 129.74 2w3s s ALA 183 Ca -0.09 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 50.84 2w3s s ALA 183 Cb -0.09 -0.92 0.05 0.00 0.00 0.00 0.00 23.12 22.16 2w3s s ALA 183 CO -0.11 0.14 -0.01 -0.51 0.00 0.00 0.00 175.76 175.27 2w3s s LEU 184 N 0.56 3.88 0.16 0.00 1.43 0.17 -2.16 118.68 122.72 2w3s s LEU 184 Ca -0.13 -1.33 -0.34 0.00 -1.03 0.00 0.00 54.13 51.30 2w3s s LEU 184 Cb -0.17 -1.69 -0.14 0.00 0.03 0.00 0.00 46.19 44.23 2w3s s LEU 184 CO 0.04 -0.26 1.61 -0.81 0.23 0.00 0.00 176.35 177.16 2w3s n PRO 185 N 4.58 2.25 -3.47 1.29 -0.04 -1.26 -0.12 135.00 138.23 2w3s n PRO 185 Ca -0.13 0.81 -0.28 0.00 -0.04 0.00 0.00 63.50 63.87 2w3s n PRO 185 Cb 0.43 -2.59 -0.12 0.00 -0.04 0.00 0.00 33.50 31.17 2w3s n PRO 185 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3s s ALA 186 N 1.03 0.68 0.00 0.55 0.00 0.52 -4.89 121.76 119.65 2w3s s ALA 186 Ca 0.79 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 51.19 2w3s s ALA 186 Cb -0.65 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 20.87 2w3s s ALA 186 CO 0.37 -2.00 0.00 0.39 0.00 0.00 0.00 175.76 174.52 2w3s n GLU 187 N 4.37 0.00 0.00 0.00 1.02 -1.26 -0.72 120.64 124.05 2w3s n GLU 187 Ca 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2w3s n GLU 187 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.81 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 0.88 1.79 0.00 0.62 0.00 -1.26 -4.90 105.19 102.31 2w3s n GLY 188 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 5.47 3.10 -0.02 0.00 0.11 -5.06 105.19 108.79 2w3s n GLY 189 Ca 0.00 -2.07 -0.10 0.00 0.00 0.00 0.00 46.02 43.86 2w3s n GLY 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w3s s VAL 190 N -0.41 0.42 -0.09 1.61 0.11 -0.59 -0.36 120.40 121.09 2w3s s VAL 190 Ca 0.00 -1.60 0.03 0.00 -2.93 0.00 0.00 61.98 57.49 2w3s s VAL 190 Cb 0.00 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.62 2w3s s VAL 190 CO 0.00 -0.78 -0.21 -0.69 -3.33 0.00 0.00 175.10 170.09 2w3s s VAL 191 N -3.03 1.85 -0.15 2.04 1.01 0.83 -2.43 120.40 120.51 2w3s s VAL 191 Ca 0.02 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 2w3s s VAL 191 Cb 0.01 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 2w3s s VAL 191 CO -0.05 0.51 -0.10 -0.63 0.00 0.00 0.00 175.10 174.84 2w3s s ILE 192 N 0.45 3.27 -0.09 2.22 -1.09 0.70 0.42 121.20 127.08 2w3s s ILE 192 Ca -0.17 -0.57 -0.01 0.00 -2.23 0.00 0.00 60.65 57.67 2w3s s ILE 192 Cb -0.17 -2.41 -0.03 0.00 -1.58 0.00 0.00 42.46 38.27 2w3s s ILE 192 CO 0.07 0.50 -0.05 -1.00 -1.23 0.00 0.00 174.94 173.23 2w3s s HIS 193 N 0.57 3.01 0.20 3.97 3.76 0.18 -1.27 115.29 125.70 2w3s s HIS 193 Ca -0.06 -0.02 -0.22 0.00 -0.15 0.00 0.00 55.06 54.60 2w3s s HIS 193 Cb -0.15 -1.79 0.05 0.00 1.11 0.00 0.00 32.58 31.80 2w3s s HIS 193 CO 0.03 0.27 0.67 0.00 -0.85 0.00 0.00 174.74 174.87 2w3s n SER 195 N -0.41 5.04 -4.17 0.00 2.88 0.02 -4.73 113.62 112.25 2w3s n SER 195 Ca -0.11 -3.02 -0.20 0.00 -1.33 0.00 0.00 58.87 54.21 2w3s n SER 195 Cb 0.62 -1.56 -0.13 0.00 -0.75 0.00 0.00 64.21 62.40 2w3s n SER 195 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2w3s s SER 196 N 2.17 1.76 0.00 -3.46 0.15 -1.26 -4.70 113.70 108.36 2w3s s SER 196 Ca 0.43 -0.52 0.28 0.00 0.70 0.00 0.00 55.95 56.84 2w3s s SER 196 Cb 0.04 -0.10 1.13 0.00 -1.71 0.00 0.00 66.02 65.39 2w3s s SER 196 CO 0.00 0.01 1.81 0.00 1.20 0.00 0.00 173.24 176.27 2w3s n GLN 197 N 1.66 0.43 -3.19 5.44 6.02 -0.40 -4.57 117.38 122.77 2w3s n GLN 197 Ca -0.19 -0.14 -0.23 0.00 -0.01 0.00 0.00 57.00 56.43 2w3s n GLN 197 Cb 0.54 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.24 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 -1.17 -0.14 -0.33 1.08 -0.00 -1.26 -1.34 115.22 112.06 2w3s n HIS 198 Ca 0.11 -3.63 0.10 0.00 0.46 0.00 0.00 57.72 54.77 2w3s n HIS 198 Cb 0.30 -0.37 0.31 0.00 -0.12 0.00 0.00 29.99 30.10 2w3s n HIS 198 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2w3s h PRO 199 N 3.81 0.82 -0.40 1.57 0.11 -1.90 -1.57 132.00 134.43 2w3s h PRO 199 Ca 0.08 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.08 2w3s h PRO 199 Cb 0.89 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 2w3s h PRO 199 CO 0.48 0.54 0.01 0.77 -0.21 0.00 0.00 178.00 179.58 2w3s h SER 200 N 0.84 0.61 0.25 -2.05 0.02 -1.91 -0.42 113.55 110.89 2w3s h SER 200 Ca 0.51 -0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 61.19 2w3s h SER 200 Cb 0.68 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 2w3s h SER 200 CO -0.28 0.67 -0.55 -0.08 -1.14 0.00 0.00 176.83 175.45 2w3s h GLU 201 N 0.61 0.32 -0.85 3.45 4.81 -1.59 -1.69 114.58 119.63 2w3s h GLU 201 Ca 0.13 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 2w3s h GLU 201 Cb 0.38 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 2w3s h GLU 201 CO 0.01 0.78 0.45 0.82 -0.73 0.00 0.00 179.01 180.35 2w3s h ILE 202 N 0.24 1.25 -0.08 2.32 1.08 -0.67 -0.70 117.51 120.95 2w3s h ILE 202 Ca 0.00 -0.65 -0.02 0.00 -0.39 0.00 0.00 64.86 63.80 2w3s h ILE 202 Cb 1.04 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.91 2w3s h ILE 202 CO 0.09 0.29 -0.03 -0.61 -0.69 0.00 0.00 178.15 177.20 2w3s h GLN 203 N 1.20 0.17 -0.11 2.37 4.15 -0.84 0.20 115.11 122.25 2w3s h GLN 203 Ca 0.30 -0.07 0.05 0.00 0.77 0.00 0.00 58.65 59.70 2w3s h GLN 203 Cb 0.05 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.67 2w3s h GLN 203 CO -0.05 0.51 -0.30 1.25 -1.93 0.00 0.00 178.83 178.32 2w3s h HIS 204 N -0.18 -0.81 -0.17 3.99 2.76 -1.16 -0.68 115.15 118.89 2w3s h HIS 204 Ca 0.02 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 2w3s h HIS 204 Cb 0.45 0.37 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 2w3s h HIS 204 CO 0.06 -0.38 0.01 0.87 -1.30 0.00 0.00 177.93 177.20 2w3s h LYS 205 N -0.38 0.29 -0.73 5.26 1.79 -0.94 -1.91 116.57 119.96 2w3s h LYS 205 Ca 0.09 -0.09 -0.04 0.00 -2.18 0.00 0.00 60.65 58.44 2w3s h LYS 205 Cb 0.52 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 31.11 2w3s h LYS 205 CO -0.33 0.49 0.31 0.28 -1.08 0.00 0.00 179.45 179.12 2w3s h VAL 206 N 0.06 1.24 0.23 0.50 2.07 -0.87 -0.31 116.25 119.17 2w3s h VAL 206 Ca 0.05 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2w3s h VAL 206 Cb 0.34 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2w3s h VAL 206 CO 0.01 0.31 -0.17 0.00 0.02 0.00 0.00 177.57 177.73 2w3s h ALA 207 N 1.28 -0.38 -0.70 1.67 0.00 -0.97 -1.73 119.26 118.42 2w3s h ALA 207 Ca 0.25 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2w3s h ALA 207 Cb 0.18 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2w3s h ALA 207 CO -0.02 -0.73 0.19 0.45 0.00 0.00 0.00 179.25 179.14 2w3s h HIS 208 N -0.40 1.16 -1.00 0.00 -0.00 -1.07 0.13 115.15 113.97 2w3s h HIS 208 Ca -0.02 -0.13 0.17 0.00 -0.00 0.00 0.00 60.37 60.39 2w3s h HIS 208 Cb 0.35 -0.33 -0.10 0.00 -0.00 0.00 0.00 27.41 27.33 2w3s h HIS 208 CO -0.11 0.93 0.62 0.00 -0.00 0.00 0.00 177.93 179.37 2w3s h ALA 209 N 1.09 1.64 0.00 2.45 0.00 -0.88 -2.83 119.26 120.73 2w3s h ALA 209 Ca 0.22 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2w3s h ALA 209 Cb 0.34 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2w3s h ALA 209 CO -0.00 0.04 -1.14 1.28 0.00 0.00 0.00 179.25 179.43 2w3s n LEU 210 N -4.70 0.60 0.00 0.00 4.77 -0.51 -2.86 117.00 114.30 2w3s n LEU 210 Ca 0.22 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2w3s n LEU 210 Cb 0.50 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2w3s n LEU 210 CO 0.24 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 2w3s n GLY 211 N 1.38 0.51 3.90 -0.72 0.00 0.35 -4.85 105.19 105.75 2w3s n GLY 211 Ca 0.02 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 4.27 0.71 0.99 1.43 -0.72 -5.02 118.68 120.34 2w3s s LEU 212 Ca 0.00 0.58 -0.15 0.00 -1.03 0.00 0.00 54.13 53.53 2w3s s LEU 212 Cb 0.00 -3.29 0.03 0.00 0.03 0.00 0.00 46.19 42.96 2w3s s LEU 212 CO 0.00 0.06 1.17 0.00 0.23 0.00 0.00 176.35 177.81 2w3s s ALA 213 N -1.65 2.24 0.27 4.21 0.00 -1.26 -4.54 121.76 121.04 2w3s s ALA 213 Ca 0.41 0.75 -0.01 0.00 0.00 0.00 0.00 51.96 53.11 2w3s s ALA 213 Cb -0.12 -3.41 0.46 0.00 0.00 0.00 0.00 23.12 20.04 2w3s s ALA 213 CO 0.24 -1.66 1.86 0.74 0.00 0.00 0.00 175.76 176.95 2w3s h PHE 214 N -0.19 1.18 0.00 0.00 -1.00 -1.94 -0.73 116.94 114.27 2w3s h PHE 214 Ca -0.47 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.34 2w3s h PHE 214 Cb 1.28 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 40.45 2w3s h PHE 214 CO 0.50 0.56 0.00 -2.39 -1.61 0.00 0.00 178.31 175.37 2w3s n HIS 215 N -4.55 0.00 0.04 -0.55 1.44 -1.26 -1.60 115.22 108.74 2w3s n HIS 215 Ca 0.17 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.91 2w3s n HIS 215 Cb 0.24 0.00 0.07 0.00 0.12 0.00 0.00 29.99 30.42 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 -0.69 2.16 -3.99 4.39 8.00 -0.28 -4.96 116.55 121.18 2w3s n ASP 216 Ca 0.00 -1.72 -0.25 0.00 0.71 0.00 0.00 54.79 53.53 2w3s n ASP 216 Cb 0.00 -0.08 -0.17 0.00 -0.02 0.00 0.00 41.12 40.85 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 -0.83 1.09 -0.03 2.53 1.01 -0.63 -1.54 120.40 122.00 2w3s s VAL 217 Ca 0.11 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.71 2w3s s VAL 217 Cb 0.06 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.42 2w3s s VAL 217 CO 0.09 0.35 -0.15 -0.60 0.00 0.00 0.00 175.10 174.79 2w3s s ARG 218 N 0.91 1.50 -0.19 2.72 3.52 -1.02 -4.90 118.95 121.49 2w3s s ARG 218 Ca -0.10 -0.53 0.01 0.00 -0.13 0.00 0.00 55.73 54.98 2w3s s ARG 218 Cb -0.15 -1.34 0.04 0.00 -1.56 0.00 0.00 34.95 31.94 2w3s s ARG 218 CO 0.01 0.23 -0.12 0.08 -0.81 0.00 0.00 175.30 174.68 2w3s s VAL 219 N 0.01 1.72 -0.02 7.11 1.01 -1.26 -0.21 120.40 128.76 2w3s s VAL 219 Ca -0.02 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.01 2w3s s VAL 219 Cb -0.10 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2w3s s VAL 219 CO 0.01 0.26 -0.07 -1.61 0.00 0.00 0.00 175.10 173.69 2w3s s GLU 220 N 1.38 2.59 -0.30 2.72 2.02 -0.40 -1.40 118.70 125.30 2w3s s GLU 220 Ca 0.00 -0.68 -0.07 0.00 0.02 0.00 0.00 54.97 54.24 2w3s s GLU 220 Cb -0.15 -2.51 0.16 0.00 0.10 0.00 0.00 34.13 31.72 2w3s s GLU 220 CO -0.09 0.62 0.66 1.41 0.02 0.00 0.00 175.26 177.88 2w3s s MET 221 N -1.24 0.55 -0.12 1.61 -2.45 -0.02 -3.57 119.30 114.05 2w3s s MET 221 Ca 0.16 1.20 0.07 0.00 -1.25 0.00 0.00 55.69 55.86 2w3s s MET 221 Cb -0.11 0.70 -0.24 0.00 1.25 0.00 0.00 34.83 36.44 2w3s s MET 221 CO 0.06 -0.36 0.35 -2.13 1.05 0.00 0.00 175.02 173.99 2w3s n ARG 222 N 5.42 0.68 -3.63 4.11 3.00 -1.26 -1.90 116.66 123.07 2w3s n ARG 222 Ca -0.07 0.21 -0.03 0.00 -0.00 0.00 0.00 57.85 57.96 2w3s n ARG 222 Cb 0.50 -1.68 -0.04 0.00 0.00 0.00 0.00 32.46 31.23 2w3s n ARG 222 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2w3s s ARG 223 N -2.56 0.14 -0.02 -0.14 1.70 -1.26 -4.57 118.95 112.24 2w3s s ARG 223 Ca -0.15 0.04 0.03 0.00 -0.47 0.00 0.00 55.73 55.18 2w3s s ARG 223 Cb 0.07 0.07 -0.03 0.00 -0.57 0.00 0.00 34.95 34.49 2w3s s ARG 223 CO 0.78 -0.04 -0.08 -1.64 -1.08 0.00 0.00 175.30 173.24 2w3s s MET 224 N -1.00 2.59 -1.22 3.89 -1.94 -0.24 -4.76 119.30 116.62 2w3s s MET 224 Ca 0.07 -0.67 -0.08 0.00 -1.71 0.00 0.00 55.69 53.30 2w3s s MET 224 Cb -0.01 -2.50 -0.07 0.00 2.01 0.00 0.00 34.83 34.26 2w3s s MET 224 CO -0.07 0.62 2.47 0.41 -0.01 0.00 0.00 175.02 178.44 2w3s n GLY 225 N 1.85 3.60 0.00 -0.03 0.00 -1.26 -4.41 105.19 104.94 2w3s n GLY 225 Ca -0.16 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 3.70 0.47 2.02 -0.02 0.00 -1.23 -1.32 105.19 108.81 2w3s n GLY 226 Ca 0.59 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.81 -0.43 2.73 -0.02 0.00 -1.26 -4.81 105.19 102.21 2w3s n GLY 227 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.68 -1.62 0.00 1.61 3.01 -1.26 0.81 117.46 117.34 2w3s n PHE 228 Ca 0.00 0.14 0.00 0.00 1.01 0.00 0.00 57.45 58.60 2w3s n PHE 228 Cb 0.00 -2.50 0.00 0.00 -0.01 0.00 0.00 39.48 36.97 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 -0.86 2.88 0.40 1.37 0.00 -1.26 -1.24 105.19 106.48 2w3s n GLY 229 Ca -0.08 -0.08 0.20 0.00 0.00 0.00 0.00 46.02 46.05 2w3s n GLY 229 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2w3s h GLY 230 N 0.00 0.35 -2.70 -0.02 0.00 0.38 0.23 103.07 101.31 2w3s h GLY 230 Ca 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 2w3s h GLY 230 CO 0.00 0.02 0.00 0.28 0.00 0.00 0.00 176.54 176.84 2w3s n LYS 231 N -4.41 4.04 0.20 4.80 5.02 -1.19 -3.82 118.16 122.81 2w3s n LYS 231 Ca 0.14 -3.03 0.08 0.00 -2.02 0.00 0.00 58.31 53.48 2w3s n LYS 231 Cb 0.65 -2.09 0.36 0.00 -0.02 0.00 0.00 35.03 33.93 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 3.03 0.00 0.00 1.97 4.81 -0.86 -1.05 114.58 122.48 2w3s h GLU 232 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2w3s h GLU 232 Cb 1.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.13 2w3s h GLU 232 CO 0.38 0.28 0.00 -1.13 -0.73 0.00 0.00 179.01 177.81 2w3s n SER 233 N -3.36 0.00 0.00 1.04 3.41 -1.26 -4.57 113.62 108.88 2w3s n SER 233 Ca 0.01 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.67 2w3s n SER 233 Cb 0.50 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.72 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 -0.18 0.15 0.23 4.33 1.13 -1.25 -0.47 117.38 121.32 2w3s n GLN 234 Ca 0.00 0.18 0.15 0.00 -1.94 0.00 0.00 57.00 55.39 2w3s n GLN 234 Cb 0.00 -1.50 0.51 0.00 0.11 0.00 0.00 30.24 29.36 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 1.83 0.00 0.50 1.08 0.00 -1.82 -3.36 103.07 101.30 2w3s h GLY 235 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.41 2w3s h GLY 235 CO 0.00 0.00 0.29 3.43 0.00 0.00 0.00 176.54 180.26 2w3s h ASN 236 N 0.00 0.36 -0.51 0.19 -0.26 -1.10 -2.54 115.58 111.71 2w3s h ASN 236 Ca 0.00 0.06 -0.06 0.00 -0.56 0.00 0.00 56.30 55.74 2w3s h ASN 236 Cb 0.62 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.86 2w3s h ASN 236 CO 0.00 0.22 0.09 0.45 -1.06 0.00 0.00 177.43 177.13 2w3s h HIS 237 N 0.51 0.94 0.01 1.19 3.86 -1.81 -1.32 115.15 118.53 2w3s h HIS 237 Ca 0.30 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.40 2w3s h HIS 237 Cb 0.31 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2w3s h HIS 237 CO -0.13 0.81 -0.01 -0.07 0.86 0.00 0.00 177.93 179.39 2w3s h LEU 238 N 0.85 -0.02 0.09 2.43 4.07 -1.76 -1.48 115.31 119.50 2w3s h LEU 238 Ca 0.18 -0.32 -0.00 0.00 0.08 0.00 0.00 57.88 57.81 2w3s h LEU 238 Cb 0.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 2w3s h LEU 238 CO 0.01 0.31 -0.04 0.00 -1.08 0.00 0.00 178.44 177.64 2w3s h ALA 239 N 0.64 -0.12 -0.41 1.53 0.00 -1.30 0.41 119.26 120.01 2w3s h ALA 239 Ca -0.00 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.92 2w3s h ALA 239 Cb 0.33 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 2w3s h ALA 239 CO 0.00 -0.52 -0.19 0.82 0.00 0.00 0.00 179.25 179.37 2w3s h ILE 240 N -0.22 0.43 -0.55 0.00 2.04 -1.32 -0.39 117.51 117.50 2w3s h ILE 240 Ca -0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.95 2w3s h ILE 240 Cb 0.18 0.43 -0.08 0.00 -0.74 0.00 0.00 36.82 36.61 2w3s h ILE 240 CO 0.02 0.00 0.07 0.00 0.00 0.00 0.00 178.15 178.24 2w3s h ALA 241 N 1.19 0.59 -0.06 1.87 0.00 -0.74 0.47 119.26 122.58 2w3s h ALA 241 Ca 0.20 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 2w3s h ALA 241 Cb 0.42 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2w3s h ALA 241 CO -0.48 -0.34 0.02 0.00 0.00 0.00 0.00 179.25 178.45 2w3s h ALA 243 N 0.86 -1.30 -0.42 0.00 0.00 -0.51 0.19 119.26 118.09 2w3s h ALA 243 Ca 0.02 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 54.76 2w3s h ALA 243 Cb 0.16 0.58 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 2w3s h ALA 243 CO -0.00 -1.24 -0.22 0.28 0.00 0.00 0.00 179.25 178.07 2w3s h VAL 244 N -1.23 0.37 0.00 0.00 2.07 -1.00 0.26 116.25 116.72 2w3s h VAL 244 Ca -0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2w3s h VAL 244 Cb 0.97 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2w3s h VAL 244 CO 0.14 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.64 2w3s h ALA 245 N 1.11 1.83 -0.06 1.67 0.00 -1.21 -2.26 119.26 120.35 2w3s h ALA 245 Ca 0.20 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2w3s h ALA 245 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w3s h ALA 245 CO -0.51 0.11 -0.29 0.00 0.00 0.00 0.00 179.25 178.56 2w3s h ALA 246 N 1.91 0.11 -1.00 0.00 0.00 0.12 -0.45 119.26 119.94 2w3s h ALA 246 Ca -0.00 -0.44 0.18 0.00 0.00 0.00 0.00 54.91 54.66 2w3s h ALA 246 Cb 0.16 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.85 2w3s h ALA 246 CO 0.01 0.15 0.62 -0.09 0.00 0.00 0.00 179.25 179.94 2w3s h ARG 247 N -0.23 0.74 0.00 0.00 2.43 -0.78 0.30 114.38 116.85 2w3s h ARG 247 Ca -0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2w3s h ARG 247 Cb 0.95 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.33 2w3s h ARG 247 CO 0.06 0.49 -0.13 0.00 -1.51 0.00 0.00 179.97 178.88 2w3s h ALA 248 N 1.63 0.02 0.00 2.80 0.00 -1.33 -3.36 119.26 119.02 2w3s h ALA 248 Ca 0.56 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2w3s h ALA 248 Cb 0.88 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2w3s h ALA 248 CO -0.36 0.09 -0.03 1.79 0.00 0.00 0.00 179.25 180.74 2w3s h THR 249 N -1.00 0.12 0.00 0.00 1.35 -1.01 -3.46 112.91 108.90 2w3s h THR 249 Ca -0.02 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 2w3s h THR 249 Cb 0.48 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2w3s h THR 249 CO -0.01 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 2w3s n GLY 250 N -0.26 2.88 3.65 5.82 0.00 0.09 -5.01 105.19 112.36 2w3s n GLY 250 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.07 2.28 0.73 1.61 0.52 -1.25 -4.92 118.95 117.84 2w3s s ARG 251 Ca 0.00 -1.46 -0.16 0.00 -0.52 0.00 0.00 55.73 53.59 2w3s s ARG 251 Cb 0.00 -2.14 -0.00 0.00 0.52 0.00 0.00 34.95 33.33 2w3s s ARG 251 CO 0.00 0.31 0.85 -0.35 0.02 0.00 0.00 175.30 176.14 2w3s n PRO 252 N -0.93 0.43 -3.79 3.54 -0.04 -1.26 -4.45 135.00 128.50 2w3s n PRO 252 Ca -0.06 0.20 -0.16 0.00 -0.04 0.00 0.00 63.50 63.44 2w3s n PRO 252 Cb 0.60 -2.12 -0.16 0.00 -0.04 0.00 0.00 33.50 31.77 2w3s n PRO 252 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w3s s LYS 254 N 1.19 2.12 -0.14 0.00 2.20 0.00 -1.67 119.74 123.45 2w3s s LYS 254 Ca -0.08 -1.01 -0.05 0.00 -0.36 0.00 0.00 55.97 54.47 2w3s s LYS 254 Cb -0.13 -2.29 0.07 0.00 -1.51 0.00 0.00 37.83 33.97 2w3s s LYS 254 CO -0.03 0.51 0.27 1.41 -0.36 0.00 0.00 175.35 177.16 2w3s s MET 255 N -2.09 0.16 -0.13 4.03 -2.45 -0.83 -0.90 119.30 117.09 2w3s s MET 255 Ca 0.20 0.73 0.03 0.00 -1.25 0.00 0.00 55.69 55.40 2w3s s MET 255 Cb -0.11 -0.09 0.01 0.00 1.25 0.00 0.00 34.83 35.89 2w3s s MET 255 CO 0.12 -0.31 -0.22 -0.98 1.05 0.00 0.00 175.02 174.68 2w3s s ARG 256 N 2.43 3.01 0.12 4.11 1.70 -1.26 -1.20 118.95 127.86 2w3s s ARG 256 Ca 0.02 -0.86 -0.31 0.00 -0.47 0.00 0.00 55.73 54.11 2w3s s ARG 256 Cb -0.12 -2.38 -0.10 0.00 -0.57 0.00 0.00 34.95 31.78 2w3s s ARG 256 CO -0.09 0.04 1.78 0.71 -1.08 0.00 0.00 175.30 176.66 2w3s s TYR 257 N 0.67 2.29 0.43 5.89 4.12 -1.01 -5.00 117.35 124.75 2w3s s TYR 257 Ca -0.11 0.09 -0.25 0.00 0.02 0.00 0.00 57.07 56.82 2w3s s TYR 257 Cb -0.16 -4.13 -0.08 0.00 -1.52 0.00 0.00 41.96 36.07 2w3s s TYR 257 CO 0.01 -4.59 1.35 0.34 0.02 0.00 0.00 175.55 172.69 2w3s s ASP 258 N 2.47 6.07 0.21 2.29 -1.08 -1.26 -4.65 116.67 120.73 2w3s s ASP 258 Ca 0.79 2.75 -0.16 0.00 -0.52 0.00 0.00 52.55 55.41 2w3s s ASP 258 Cb -0.45 -2.64 0.23 0.00 -1.46 0.00 0.00 42.92 38.59 2w3s s ASP 258 CO 0.35 -1.02 1.59 -0.09 0.52 0.00 0.00 175.17 176.52 2w3s h ARG 259 N 2.44 -0.06 -0.38 4.34 9.65 -1.96 0.25 114.38 128.65 2w3s h ARG 259 Ca -0.50 0.00 0.08 0.00 -1.10 0.00 0.00 59.98 58.46 2w3s h ARG 259 Cb 1.26 0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 29.77 2w3s h ARG 259 CO 0.62 -0.04 -0.14 -0.44 2.80 0.00 0.00 179.97 182.76 2w3s h ASP 260 N -0.07 -0.49 -0.93 -3.80 3.45 -1.93 -0.90 116.42 111.75 2w3s h ASP 260 Ca 0.31 0.13 0.09 0.00 0.43 0.00 0.00 57.03 57.99 2w3s h ASP 260 Cb 0.55 0.29 -0.07 0.00 -0.56 0.00 0.00 39.33 39.54 2w3s h ASP 260 CO -0.74 -0.17 0.60 0.44 -1.57 0.00 0.00 179.24 177.79 2w3s h ASP 261 N -0.06 0.87 -0.18 6.45 5.19 -0.89 -1.24 116.42 126.56 2w3s h ASP 261 Ca 0.19 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2w3s h ASP 261 Cb 0.35 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 2w3s h ASP 261 CO -0.42 0.52 0.11 -0.78 -3.12 0.00 0.00 179.24 175.55 2w3s h ASP 262 N 0.97 0.21 0.74 6.45 3.58 0.14 0.33 116.42 128.83 2w3s h ASP 262 Ca 0.43 -0.02 -0.16 0.00 0.42 0.00 0.00 57.03 57.70 2w3s h ASP 262 Cb 0.37 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 2w3s h ASP 262 CO -0.19 0.16 -0.74 0.24 -2.88 0.00 0.00 179.24 175.83 2w3s h MET 263 N 0.23 0.00 -0.04 0.28 2.86 -0.73 -1.20 114.93 116.32 2w3s h MET 263 Ca 0.06 -0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.45 2w3s h MET 263 Cb -0.01 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.67 2w3s h MET 263 CO -0.01 0.74 -0.96 0.28 1.06 0.00 0.00 176.91 178.01 2w3s h VAL 264 N 0.00 1.28 0.00 -2.22 2.07 -0.97 -3.38 116.25 113.03 2w3s h VAL 264 Ca -0.01 -2.18 -0.09 0.00 0.82 0.00 0.00 66.70 65.25 2w3s h VAL 264 Cb 1.31 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 33.33 2w3s h VAL 264 CO 0.10 0.68 -0.52 0.40 0.02 0.00 0.00 177.57 178.24 2w3s h ILE 265 N 0.43 1.09 -4.11 4.57 2.04 -0.29 -3.43 117.51 117.80 2w3s h ILE 265 Ca -0.11 -2.00 -0.48 0.00 1.00 0.00 0.00 64.86 63.27 2w3s h ILE 265 Cb 1.61 2.24 0.05 0.00 -0.74 0.00 0.00 36.82 39.98 2w3s h ILE 265 CO 0.19 0.37 0.39 0.42 0.00 0.00 0.00 178.15 179.52 2w3s s THR 266 N -2.20 3.63 1.09 -0.27 -4.23 -0.46 -4.77 115.64 108.43 2w3s s THR 266 Ca -0.20 0.94 -0.15 0.00 -1.18 0.00 0.00 61.69 61.10 2w3s s THR 266 Cb 0.01 -3.38 0.23 0.00 1.34 0.00 0.00 72.50 70.71 2w3s s THR 266 CO 0.53 -0.29 1.09 -0.83 -0.54 0.00 0.00 174.62 174.58 2w3s s GLY 267 N -2.16 1.56 0.00 3.99 0.00 -1.25 -4.83 107.32 104.63 2w3s s GLY 267 Ca 0.68 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.82 2w3s s GLY 267 CO 0.27 0.15 0.00 0.28 0.00 0.00 0.00 173.10 173.79 2w3s n LYS 268 N -4.45 0.98 -2.53 2.90 5.02 -1.26 -4.80 118.16 114.01 2w3s n LYS 268 Ca 0.08 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.95 2w3s n LYS 268 Cb 0.58 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.56 2w3s n LYS 268 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2w3s s ARG 269 N -0.69 4.46 -0.39 1.97 3.52 0.06 -1.32 118.95 126.56 2w3s s ARG 269 Ca 0.00 1.63 -0.39 0.00 -0.13 0.00 0.00 55.73 56.84 2w3s s ARG 269 Cb 0.00 -3.42 -0.15 0.00 -1.56 0.00 0.00 34.95 29.82 2w3s s ARG 269 CO 0.00 -0.22 2.07 0.72 -0.81 0.00 0.00 175.30 177.05 2w3s n HIS 270 N 4.16 1.56 -2.40 5.12 8.25 -1.26 -3.46 115.22 127.19 2w3s n HIS 270 Ca 0.08 0.51 -0.38 0.00 -0.26 0.00 0.00 57.72 57.67 2w3s n HIS 270 Cb 0.48 -2.43 -0.03 0.00 1.12 0.00 0.00 29.99 29.13 2w3s n HIS 270 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2w3s s ASP 271 N 6.02 6.76 0.06 0.41 -4.77 -1.26 -4.73 116.67 119.16 2w3s s ASP 271 Ca 1.11 2.25 0.08 0.00 -3.30 0.00 0.00 52.55 52.69 2w3s s ASP 271 Cb -1.12 -2.61 -0.03 0.00 -1.09 0.00 0.00 42.92 38.07 2w3s s ASP 271 CO 0.59 -0.50 -0.23 -0.36 0.70 0.00 0.00 175.17 175.37 2w3s s PHE 272 N -1.42 2.03 -0.21 2.11 0.08 0.60 -1.61 117.98 119.55 2w3s s PHE 272 Ca 0.54 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 57.10 2w3s s PHE 272 Cb -0.29 -1.19 -0.05 0.00 -0.57 0.00 0.00 43.02 40.92 2w3s s PHE 272 CO 0.36 0.13 0.13 0.50 -0.10 0.00 0.00 175.22 176.25 2w3s s ARG 273 N -1.34 4.13 -0.09 0.44 3.52 -0.03 0.25 118.95 125.83 2w3s s ARG 273 Ca 0.09 -0.25 0.04 0.00 -0.13 0.00 0.00 55.73 55.48 2w3s s ARG 273 Cb -0.09 -3.44 -0.01 0.00 -1.56 0.00 0.00 34.95 29.85 2w3s s ARG 273 CO 0.02 0.22 -0.22 0.42 -0.81 0.00 0.00 175.30 174.93 2w3s s ILE 274 N 0.60 2.33 -0.07 4.11 1.01 -0.30 -1.51 121.20 127.37 2w3s s ILE 274 Ca 0.07 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 59.82 2w3s s ILE 274 Cb -0.12 -1.89 -0.00 0.00 0.01 0.00 0.00 42.46 40.46 2w3s s ILE 274 CO 0.00 0.56 -0.22 -0.60 0.00 0.00 0.00 174.94 174.69 2w3s s ARG 275 N 0.06 2.46 0.01 2.79 3.52 -0.96 -0.45 118.95 126.38 2w3s s ARG 275 Ca -0.09 -0.78 -0.03 0.00 -0.13 0.00 0.00 55.73 54.70 2w3s s ARG 275 Cb -0.15 -2.00 -0.01 0.00 -1.56 0.00 0.00 34.95 31.23 2w3s s ARG 275 CO 0.06 0.25 0.04 1.52 -0.81 0.00 0.00 175.30 176.36 2w3s s TYR 276 N 0.13 0.15 -0.07 5.12 -0.85 0.11 -1.05 117.35 120.89 2w3s s TYR 276 Ca -0.10 -0.33 0.01 0.00 -0.52 0.00 0.00 57.07 56.14 2w3s s TYR 276 Cb -0.15 -0.12 0.02 0.00 0.38 0.00 0.00 41.96 42.09 2w3s s TYR 276 CO 0.05 -0.22 -0.09 1.03 -1.52 0.00 0.00 175.55 174.81 2w3s s ARG 277 N -1.32 1.36 -0.02 -3.49 0.52 -0.19 -1.03 118.95 114.77 2w3s s ARG 277 Ca -0.14 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 2w3s s ARG 277 Cb -0.08 -1.24 0.01 0.00 0.52 0.00 0.00 34.95 34.16 2w3s s ARG 277 CO 0.00 -0.06 -0.06 -1.50 0.02 0.00 0.00 175.30 173.70 2w3s s ILE 278 N 0.95 0.56 0.04 1.52 2.07 -0.95 -0.04 121.20 125.35 2w3s s ILE 278 Ca -0.10 -0.22 0.05 0.00 -1.41 0.00 0.00 60.65 58.96 2w3s s ILE 278 Cb -0.15 -0.52 -0.02 0.00 0.13 0.00 0.00 42.46 41.90 2w3s s ILE 278 CO 0.00 0.19 -0.13 -0.83 -1.91 0.00 0.00 174.94 172.26 2w3s s GLY 279 N 0.33 0.76 0.09 1.50 0.00 0.12 -1.06 107.32 109.06 2w3s s GLY 279 Ca -0.04 -0.81 0.04 0.00 0.00 0.00 0.00 44.72 43.91 2w3s s GLY 279 CO 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 173.10 172.20 2w3s s ALA 280 N -0.87 1.15 1.16 3.20 0.00 -0.12 0.84 121.76 127.12 2w3s s ALA 280 Ca 0.01 -1.15 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 2w3s s ALA 280 Cb -0.08 -0.01 0.24 0.00 0.00 0.00 0.00 23.12 23.28 2w3s s ALA 280 CO 0.01 0.02 0.99 -0.40 0.00 0.00 0.00 175.76 176.37 2w3s n ASP 281 N 0.72 -1.44 0.06 0.00 5.68 -0.62 -0.95 116.55 120.00 2w3s n ASP 281 Ca -0.17 -1.16 0.12 0.00 -0.50 0.00 0.00 54.79 53.09 2w3s n ASP 281 Cb 0.57 -0.86 0.47 0.00 -1.14 0.00 0.00 41.12 40.16 2w3s n ASP 281 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2w3s n ALA 282 N -4.39 2.11 0.15 2.12 0.00 -1.26 -2.55 120.51 116.69 2w3s n ALA 282 Ca -0.18 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.27 2w3s n ALA 282 Cb 0.50 -1.43 0.04 0.00 0.00 0.00 0.00 19.45 18.57 2w3s n ALA 282 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2w3s h SER 283 N 0.00 0.00 0.00 0.00 4.64 -2.03 -3.48 113.55 112.68 2w3s h SER 283 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2w3s h SER 283 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2w3s h SER 283 CO 0.00 0.43 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 2w3s n GLY 284 N 1.21 0.98 3.74 -0.77 0.00 -1.06 -5.09 105.19 104.22 2w3s n GLY 284 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.60 4.73 0.30 1.61 -0.14 -1.26 -4.86 119.74 119.52 2w3s s LYS 285 Ca 0.00 1.58 -0.29 0.00 -1.36 0.00 0.00 55.97 55.89 2w3s s LYS 285 Cb 0.00 -3.29 -0.10 0.00 -1.68 0.00 0.00 37.83 32.76 2w3s s LYS 285 CO 0.00 0.30 1.37 -0.51 -0.76 0.00 0.00 175.35 175.75 2w3s s LEU 286 N -0.75 4.40 -0.24 3.17 1.43 -1.26 -1.59 118.68 123.84 2w3s s LEU 286 Ca 0.45 2.69 -0.00 0.00 -1.03 0.00 0.00 54.13 56.24 2w3s s LEU 286 Cb -0.27 -3.64 -0.18 0.00 0.03 0.00 0.00 46.19 42.13 2w3s s LEU 286 CO 0.33 -0.62 -0.15 0.18 0.23 0.00 0.00 176.35 176.33 2w3s n LEU 287 N 1.40 2.88 -3.57 1.79 4.77 0.25 -4.55 117.00 119.97 2w3s n LEU 287 Ca 0.03 -0.07 -0.06 0.00 -0.03 0.00 0.00 56.01 55.88 2w3s n LEU 287 Cb 0.41 -0.94 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 2w3s n LEU 287 CO 0.60 0.91 0.90 -0.83 -1.33 0.00 0.00 177.39 177.64 2w3s s GLY 288 N -6.33 -0.31 -0.08 -0.72 0.00 -1.13 -3.38 107.32 95.36 2w3s s GLY 288 Ca -0.33 1.59 -0.04 0.00 0.00 0.00 0.00 44.72 45.94 2w3s s GLY 288 CO 0.62 0.59 0.18 0.00 0.00 0.00 0.00 173.10 174.49 2w3s s ALA 289 N -2.33 -0.34 -0.17 3.20 0.00 -0.78 -0.70 121.76 120.63 2w3s s ALA 289 Ca 0.07 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.80 2w3s s ALA 289 Cb -0.01 -0.62 0.02 0.00 0.00 0.00 0.00 23.12 22.51 2w3s s ALA 289 CO -0.05 -0.29 -0.18 0.34 0.00 0.00 0.00 175.76 175.58 2w3s s ASP 290 N 1.52 3.05 0.03 0.00 2.15 0.94 -2.16 116.67 122.20 2w3s s ASP 290 Ca -0.06 -0.63 0.07 0.00 0.43 0.00 0.00 52.55 52.36 2w3s s ASP 290 Cb -0.11 -1.41 -0.03 0.00 -0.30 0.00 0.00 42.92 41.07 2w3s s ASP 290 CO -0.07 -0.02 -0.20 -0.36 -0.17 0.00 0.00 175.17 174.35 2w3s s PHE 291 N 1.33 2.51 -0.11 -5.34 0.40 0.02 -1.03 117.98 115.77 2w3s s PHE 291 Ca 0.05 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.12 2w3s s PHE 291 Cb -0.13 -1.47 0.01 0.00 0.51 0.00 0.00 43.02 41.94 2w3s s PHE 291 CO -0.12 0.20 -0.20 0.08 0.70 0.00 0.00 175.22 175.88 2w3s s VAL 292 N -0.86 1.81 -0.22 -0.44 1.01 -0.21 -1.94 120.40 119.55 2w3s s VAL 292 Ca 0.13 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 2w3s s VAL 292 Cb -0.10 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 2w3s s VAL 292 CO 0.04 0.50 0.03 -1.00 0.00 0.00 0.00 175.10 174.67 2w3s s HIS 293 N 0.64 3.06 -0.32 5.22 3.76 0.87 -2.26 115.29 126.27 2w3s s HIS 293 Ca -0.13 -0.45 -0.03 0.00 -0.15 0.00 0.00 55.06 54.30 2w3s s HIS 293 Cb -0.16 -2.15 0.05 0.00 1.11 0.00 0.00 32.58 31.42 2w3s s HIS 293 CO 0.03 -0.30 0.05 -0.51 -0.85 0.00 0.00 174.74 173.17 2w3s s LEU 294 N 1.28 4.16 -0.08 0.89 1.43 -0.57 -0.07 118.68 125.72 2w3s s LEU 294 Ca 0.04 -1.31 0.03 0.00 -1.03 0.00 0.00 54.13 51.86 2w3s s LEU 294 Cb -0.15 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 2w3s s LEU 294 CO 0.02 -0.31 -0.16 0.00 0.23 0.00 0.00 176.35 176.13 2w3s s ALA 295 N 1.28 2.55 -0.41 4.21 0.00 -0.43 -0.85 121.76 128.12 2w3s s ALA 295 Ca -0.03 -0.96 -0.23 0.00 0.00 0.00 0.00 51.96 50.74 2w3s s ALA 295 Cb -0.20 -0.99 0.02 0.00 0.00 0.00 0.00 23.12 21.95 2w3s s ALA 295 CO -0.00 0.43 0.79 0.50 0.00 0.00 0.00 175.76 177.47 2w3s s ARG 296 N -0.27 3.59 0.00 0.00 3.52 -0.64 -1.12 118.95 124.03 2w3s s ARG 296 Ca 0.01 0.12 0.22 0.00 -0.13 0.00 0.00 55.73 55.95 2w3s s ARG 296 Cb -0.13 -3.87 -0.02 0.00 -1.56 0.00 0.00 34.95 29.37 2w3s s ARG 296 CO 0.03 -0.98 1.07 0.00 -0.81 0.00 0.00 175.30 174.61 2w3s n GLY 298 N 1.43 -0.69 0.17 0.00 0.00 -1.25 -1.44 105.19 103.40 2w3s n GLY 298 Ca 0.08 -1.13 0.10 0.00 0.00 0.00 0.00 46.02 45.08 2w3s n GLY 298 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2w3s h TRP 299 N 0.00 0.00 -3.77 1.61 5.08 -0.23 -2.67 115.95 115.96 2w3s h TRP 299 Ca 0.00 0.00 -0.26 0.00 1.08 0.00 0.00 58.89 59.71 2w3s h TRP 299 Cb 0.00 0.00 -0.15 0.00 -3.00 0.00 0.00 29.16 26.01 2w3s h TRP 299 CO 0.00 0.08 -0.68 -1.54 -1.28 0.00 0.00 178.44 175.02 2w3s s SER 300 N -5.88 1.20 0.16 0.11 1.04 -1.26 -4.90 113.70 104.17 2w3s s SER 300 Ca 0.03 -1.10 -0.14 0.00 0.48 0.00 0.00 55.95 55.23 2w3s s SER 300 Cb 0.07 0.10 0.05 0.00 0.10 0.00 0.00 66.02 66.35 2w3s s SER 300 CO 0.73 -0.52 1.74 0.00 0.98 0.00 0.00 173.24 176.17 2w3s h ALA 301 N 2.81 0.68 -0.38 5.32 0.00 -1.89 -3.43 119.26 122.36 2w3s h ALA 301 Ca -0.36 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2w3s h ALA 301 Cb 1.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2w3s h ALA 301 CO 0.63 0.25 0.00 -3.47 0.00 0.00 0.00 179.25 176.66 2w3s n ASP 302 N -4.58 0.00 -0.15 0.00 -0.08 -1.26 -1.42 116.55 109.06 2w3s n ASP 302 Ca 0.02 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.34 2w3s n ASP 302 Cb 0.13 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.66 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 2.33 -0.30 -2.67 4.77 -1.26 -4.20 117.00 115.67 2w3s n LEU 303 Ca 0.00 -2.39 0.14 0.00 -0.03 0.00 0.00 56.01 53.73 2w3s n LEU 303 Cb 0.00 -0.19 0.31 0.00 -2.33 0.00 0.00 43.42 41.21 2w3s n LEU 303 CO 0.00 0.60 0.93 0.28 -1.33 0.00 0.00 177.39 177.87 2w3s h SER 304 N 0.35 -0.04 0.35 -1.43 0.02 -1.43 -1.40 113.55 109.96 2w3s h SER 304 Ca 0.00 0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2w3s h SER 304 Cb 0.74 0.30 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 2w3s h SER 304 CO 0.01 -0.20 -0.30 0.25 -1.14 0.00 0.00 176.83 175.46 2w3s h LEU 305 N 0.17 -0.80 -0.66 5.07 6.46 -1.85 -1.09 115.31 122.60 2w3s h LEU 305 Ca 0.58 0.07 -0.12 0.00 -0.12 0.00 0.00 57.88 58.28 2w3s h LEU 305 Cb 1.19 0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 41.37 2w3s h LEU 305 CO -0.70 -0.44 -0.27 1.55 -0.62 0.00 0.00 178.44 177.96 2w3s h PRO 306 N -0.66 0.75 -0.19 5.25 0.13 -1.87 -1.91 132.00 133.50 2w3s h PRO 306 Ca -0.02 -0.32 0.05 0.00 -0.87 0.00 0.00 66.00 64.84 2w3s h PRO 306 Cb 0.59 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.63 2w3s h PRO 306 CO -0.03 0.94 -0.25 0.28 -0.23 0.00 0.00 178.00 178.70 2w3s h VAL 307 N 0.64 0.38 -0.79 1.56 2.07 -1.01 -0.99 116.25 118.13 2w3s h VAL 307 Ca 0.08 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.57 2w3s h VAL 307 Cb 0.79 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 2w3s h VAL 307 CO 0.07 0.00 0.36 0.00 0.02 0.00 0.00 177.57 178.01 2w3s h ASP 309 N 1.12 0.19 0.70 0.00 3.32 -0.51 -2.46 116.42 118.78 2w3s h ASP 309 Ca 0.27 0.01 -0.26 0.00 0.02 0.00 0.00 57.03 57.07 2w3s h ASP 309 Cb 0.14 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2w3s h ASP 309 CO -0.03 0.10 -1.32 -0.09 -1.72 0.00 0.00 179.24 176.18 2w3s h ARG 310 N 0.21 0.10 0.17 3.56 2.43 0.34 -2.39 114.38 118.80 2w3s h ARG 310 Ca 0.30 -0.17 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 2w3s h ARG 310 Cb 0.88 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2w3s h ARG 310 CO -0.05 0.95 -0.20 0.00 -1.51 0.00 0.00 179.97 179.16 2w3s h ALA 311 N 0.81 -0.38 -0.14 2.80 0.00 -1.13 -1.16 119.26 120.06 2w3s h ALA 311 Ca -0.15 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2w3s h ALA 311 Cb 1.91 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 19.92 2w3s h ALA 311 CO 0.14 -0.74 -0.41 0.52 0.00 0.00 0.00 179.25 178.75 2w3s h MET 312 N -0.41 -0.46 -0.99 0.00 2.86 -1.46 0.10 114.93 114.57 2w3s h MET 312 Ca 0.01 0.03 0.29 0.00 -2.06 0.00 0.00 59.70 57.97 2w3s h MET 312 Cb 0.40 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 2w3s h MET 312 CO -0.07 -0.30 0.76 -0.07 1.06 0.00 0.00 176.91 178.29 2w3s h LEU 313 N -0.47 0.00 -2.91 1.22 4.07 -1.27 -1.45 115.31 114.50 2w3s h LEU 313 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2w3s h LEU 313 Cb 0.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.36 2w3s h LEU 313 CO -0.40 0.00 0.00 1.41 -1.08 0.00 0.00 178.44 178.37 2w3s n HIS 314 N -4.11 1.07 0.57 1.13 8.25 -0.03 -4.51 115.22 117.60 2w3s n HIS 314 Ca 0.21 -0.55 0.11 0.00 -0.26 0.00 0.00 57.72 57.23 2w3s n HIS 314 Cb 1.10 -0.09 0.44 0.00 1.12 0.00 0.00 29.99 32.56 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 1.27 1.89 1.09 -1.41 0.00 -0.55 -2.27 120.51 120.53 2w3s n ALA 315 Ca 0.23 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.80 2w3s n ALA 315 Cb 0.69 -1.37 0.63 0.00 0.00 0.00 0.00 19.45 19.40 2w3s n ALA 315 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3s n ASP 316 N -1.89 0.00 0.00 0.00 5.75 -1.26 -4.56 116.55 114.59 2w3s n ASP 316 Ca 0.04 0.27 0.00 0.00 -0.01 0.00 0.00 54.79 55.09 2w3s n ASP 316 Cb 0.27 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 2w3s n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w3s n GLY 317 N 1.24 3.32 1.36 6.12 0.00 -0.96 -0.58 105.19 115.69 2w3s n GLY 317 Ca 0.09 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.29 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 4.56 4.00 -4.39 1.61 7.64 -1.26 -4.58 113.62 121.20 2w3s n SER 318 Ca 0.00 -2.02 -0.32 0.00 1.01 0.00 0.00 58.87 57.54 2w3s n SER 318 Cb 0.00 -0.49 -0.15 0.00 -1.01 0.00 0.00 64.21 62.56 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 -1.04 2.52 0.14 1.43 1.51 0.25 -2.83 117.35 119.33 2w3s s TYR 319 Ca 0.49 -0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 55.94 2w3s s TYR 319 Cb 0.26 -1.57 -0.07 0.00 -0.11 0.00 0.00 41.96 40.46 2w3s s TYR 319 CO 0.33 0.07 1.27 0.12 -1.11 0.00 0.00 175.55 176.23 2w3s s PHE 320 N -0.65 3.35 -0.07 2.71 5.36 -0.39 -4.85 117.98 123.43 2w3s s PHE 320 Ca 0.10 1.23 -0.02 0.00 -0.96 0.00 0.00 56.93 57.28 2w3s s PHE 320 Cb -0.10 -3.53 0.03 0.00 -0.34 0.00 0.00 43.02 39.08 2w3s s PHE 320 CO -0.00 -1.67 0.04 0.08 -1.46 0.00 0.00 175.22 172.21 2w3s s VAL 321 N 0.58 0.08 -0.50 3.12 1.01 -1.26 -4.76 120.40 118.67 2w3s s VAL 321 Ca 0.58 0.20 0.26 0.00 0.00 0.00 0.00 61.98 63.03 2w3s s VAL 321 Cb -0.34 -0.37 0.30 0.00 0.00 0.00 0.00 36.38 35.97 2w3s s VAL 321 CO 0.33 0.13 1.76 -0.65 0.00 0.00 0.00 175.10 176.66 2w3s h PRO 322 N 8.39 0.00 -3.05 2.72 0.11 -1.80 -3.42 132.00 134.95 2w3s h PRO 322 Ca -0.15 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.73 2w3s h PRO 322 Cb 1.13 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.92 2w3s h PRO 322 CO 0.21 0.00 -0.55 0.00 -0.21 0.00 0.00 178.00 177.46 2w3s s ALA 323 N -3.26 -0.42 -0.14 -0.75 0.00 -1.22 -4.39 121.76 111.59 2w3s s ALA 323 Ca 0.07 0.84 -0.14 0.00 0.00 0.00 0.00 51.96 52.72 2w3s s ALA 323 Cb 0.10 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.55 2w3s s ALA 323 CO 0.55 -0.35 0.40 -1.17 0.00 0.00 0.00 175.76 175.19 2w3s s LEU 324 N 1.68 0.48 -0.00 0.00 0.20 0.83 -1.86 118.68 120.00 2w3s s LEU 324 Ca -0.05 0.76 0.01 0.00 0.69 0.00 0.00 54.13 55.54 2w3s s LEU 324 Cb -0.11 1.39 -0.00 0.00 -0.43 0.00 0.00 46.19 47.03 2w3s s LEU 324 CO -0.07 -0.16 -0.03 -0.60 -0.29 0.00 0.00 176.35 175.19 2w3s s ARG 325 N 0.10 0.23 -0.02 1.98 3.52 -0.92 0.58 118.95 124.43 2w3s s ARG 325 Ca -0.01 -0.10 0.05 0.00 -0.13 0.00 0.00 55.73 55.54 2w3s s ARG 325 Cb -0.03 -0.23 -0.01 0.00 -1.56 0.00 0.00 34.95 33.12 2w3s s ARG 325 CO 0.01 0.06 -0.19 0.42 -0.81 0.00 0.00 175.30 174.80 2w3s s ILE 326 N -0.06 1.48 -0.25 4.11 1.09 0.94 -0.80 121.20 127.71 2w3s s ILE 326 Ca 0.01 -0.79 0.02 0.00 -1.10 0.00 0.00 60.65 58.80 2w3s s ILE 326 Cb -0.01 -1.24 0.06 0.00 -1.06 0.00 0.00 42.46 40.20 2w3s s ILE 326 CO -0.00 0.42 -0.09 -0.70 -0.10 0.00 0.00 174.94 174.47 2w3s s GLU 327 N -0.31 2.05 -0.32 2.79 2.12 -0.82 -1.88 118.70 122.35 2w3s s GLU 327 Ca 0.04 -1.21 -0.05 0.00 0.36 0.00 0.00 54.97 54.11 2w3s s GLU 327 Cb -0.09 -2.78 0.03 0.00 0.26 0.00 0.00 34.13 31.56 2w3s s GLU 327 CO 0.00 -0.57 0.07 0.45 -0.54 0.00 0.00 175.26 174.67 2w3s s SER 328 N 1.21 5.12 -0.28 -1.70 0.15 0.12 -0.09 113.70 118.23 2w3s s SER 328 Ca -0.08 -1.06 -0.10 0.00 0.70 0.00 0.00 55.95 55.41 2w3s s SER 328 Cb -0.19 -1.82 -0.04 0.00 -1.71 0.00 0.00 66.02 62.25 2w3s s SER 328 CO -0.06 -0.27 0.17 -1.00 1.20 0.00 0.00 173.24 173.28 2w3s s HIS 329 N 1.39 3.20 -0.58 3.44 3.76 0.89 -0.74 115.29 126.64 2w3s s HIS 329 Ca -0.01 -0.05 -0.10 0.00 -0.15 0.00 0.00 55.06 54.75 2w3s s HIS 329 Cb -0.19 -2.37 0.15 0.00 1.11 0.00 0.00 32.58 31.29 2w3s s HIS 329 CO 0.01 -0.23 0.48 -0.98 -0.85 0.00 0.00 174.74 173.17 2w3s s ARG 330 N 1.72 2.82 -0.07 1.40 3.03 -1.26 -1.32 118.95 125.27 2w3s s ARG 330 Ca 0.07 -2.03 -0.16 0.00 2.03 0.00 0.00 55.73 55.64 2w3s s ARG 330 Cb -0.16 -4.07 -0.05 0.00 -1.03 0.00 0.00 34.95 29.64 2w3s s ARG 330 CO 0.09 -1.24 0.41 -0.51 -1.13 0.00 0.00 175.30 172.93 2w3s s LEU 331 N 0.92 4.36 0.12 -1.89 1.43 -0.28 0.16 118.68 123.51 2w3s s LEU 331 Ca 0.10 0.83 -0.30 0.00 -1.03 0.00 0.00 54.13 53.72 2w3s s LEU 331 Cb -0.22 -2.58 -0.06 0.00 0.03 0.00 0.00 46.19 43.35 2w3s s LEU 331 CO -0.02 0.17 1.02 -0.60 0.23 0.00 0.00 176.35 177.15 2w3s s ARG 332 N -0.20 4.64 0.06 1.70 3.52 0.97 -1.88 118.95 127.76 2w3s s ARG 332 Ca 0.23 1.55 0.01 0.00 -0.13 0.00 0.00 55.73 57.39 2w3s s ARG 332 Cb -0.15 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 2w3s s ARG 332 CO 0.10 0.12 -0.05 0.95 -0.81 0.00 0.00 175.30 175.61 2w3s s THR 333 N 0.08 0.45 -1.46 4.11 -4.23 -1.01 -4.56 115.64 109.02 2w3s s THR 333 Ca 0.49 -1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 59.28 2w3s s THR 333 Cb -0.25 -1.25 0.04 0.00 1.34 0.00 0.00 72.50 72.38 2w3s s THR 333 CO 0.31 -0.77 2.35 0.59 -0.54 0.00 0.00 174.62 176.56 2w3s n ASN 334 N 0.50 5.62 -3.89 3.99 4.13 0.21 -1.74 115.26 124.07 2w3s n ASN 334 Ca -0.16 -2.85 -0.09 0.00 1.68 0.00 0.00 54.58 53.16 2w3s n ASN 334 Cb 0.59 -1.58 -0.07 0.00 -1.54 0.00 0.00 39.78 37.18 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 2.07 0.12 -0.08 3.41 -4.23 -1.26 -4.53 115.64 111.14 2w3s s THR 335 Ca 0.52 -1.26 -0.08 0.00 -1.18 0.00 0.00 61.69 59.69 2w3s s THR 335 Cb 0.15 -1.50 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 2w3s s THR 335 CO -0.07 -0.54 0.31 0.00 -0.54 0.00 0.00 174.62 173.78 2w3s n GLN 336 N -0.11 0.00 -1.61 3.99 3.00 -1.26 -1.06 117.38 120.33 2w3s n GLN 336 Ca -0.13 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.53 2w3s n GLN 336 Cb 0.63 -0.25 -0.03 0.00 0.00 0.00 0.00 30.24 30.58 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 0.75 4.45 0.79 1.08 0.15 -1.26 -3.88 113.70 115.78 2w3s s SER 337 Ca 0.19 0.87 -0.14 0.00 0.70 0.00 0.00 55.95 57.57 2w3s s SER 337 Cb -0.25 -2.51 0.07 0.00 -1.71 0.00 0.00 66.02 61.62 2w3s s SER 337 CO 0.12 -2.95 1.20 0.20 1.20 0.00 0.00 173.24 173.01 2w3s s ASN 338 N 11.64 3.74 0.00 5.45 0.01 -0.52 -3.85 114.94 131.41 2w3s s ASN 338 Ca 0.94 2.35 0.00 0.00 -0.71 0.00 0.00 52.86 55.43 2w3s s ASN 338 Cb -0.16 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.91 2w3s s ASN 338 CO 0.23 -2.56 0.00 1.07 -1.51 0.00 0.00 177.10 174.33 2w3s n THR 339 N -3.18 0.00 -2.35 1.60 5.66 -0.44 -4.26 114.28 111.32 2w3s n THR 339 Ca 0.13 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.78 2w3s n THR 339 Cb 0.50 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.27 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 -1.69 2.85 -0.25 1.79 0.00 -1.26 -4.54 121.76 118.65 2w3s s ALA 340 Ca 0.00 0.80 -0.14 0.00 0.00 0.00 0.00 51.96 52.62 2w3s s ALA 340 Cb 0.00 -3.34 0.08 0.00 0.00 0.00 0.00 23.12 19.86 2w3s s ALA 340 CO 0.00 -0.59 0.62 0.12 0.00 0.00 0.00 175.76 175.91 2w3s s PHE 341 N -1.74 -0.98 0.00 0.00 5.99 -1.25 -3.44 117.98 116.57 2w3s s PHE 341 Ca 0.68 1.94 0.00 0.00 0.00 0.00 0.00 56.93 59.55 2w3s s PHE 341 Cb -0.23 0.56 0.00 0.00 0.00 0.00 0.00 43.02 43.34 2w3s s PHE 341 CO 0.28 -0.50 0.00 -2.13 -0.00 0.00 0.00 175.22 172.87 2w3s n ARG 342 N 4.41 0.00 0.00 10.12 0.63 -0.37 -0.35 116.66 131.09 2w3s n ARG 342 Ca -0.20 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 2w3s n ARG 342 Cb 0.57 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.48 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 2.38 3.60 5.14 0.00 -1.26 -4.90 105.19 110.16 2w3s n GLY 343 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.02 0.00 1.61 7.35 0.52 -0.38 117.46 124.54 2w3s n PHE 344 Ca 0.00 0.67 0.00 0.00 -0.76 0.00 0.00 57.45 57.36 2w3s n PHE 344 Cb 0.00 -3.90 0.00 0.00 0.35 0.00 0.00 39.48 35.93 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 -1.56 3.01 0.34 7.13 0.00 -1.26 -4.49 105.19 108.35 2w3s n GLY 345 Ca -0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.77 2.00 -0.02 0.00 -0.92 -2.83 103.07 100.53 2w3s h GLY 346 Ca 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 47.33 47.64 2w3s h GLY 346 CO 0.00 -0.29 -0.12 -0.56 0.00 0.00 0.00 176.54 175.57 2w3s h PRO 347 N -0.72 0.00 0.41 4.80 0.13 -1.91 -1.46 132.00 133.25 2w3s h PRO 347 Ca -0.05 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.06 2w3s h PRO 347 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2w3s h PRO 347 CO 0.03 0.12 -0.20 1.96 -0.23 0.00 0.00 178.00 179.68 2w3s h GLN 348 N 0.00 -0.53 -0.49 0.86 7.50 -1.89 -0.30 115.11 120.26 2w3s h GLN 348 Ca -0.00 0.04 0.07 0.00 0.50 0.00 0.00 58.65 59.25 2w3s h GLN 348 Cb 0.37 0.12 -0.06 0.00 0.05 0.00 0.00 27.48 27.96 2w3s h GLN 348 CO 0.02 -0.23 0.16 0.78 -1.50 0.00 0.00 178.83 178.06 2w3s h GLY 349 N -0.99 0.65 0.69 3.46 0.00 -1.45 -1.27 103.07 104.16 2w3s h GLY 349 Ca -0.06 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.23 2w3s h GLY 349 CO 0.09 -0.00 0.11 0.00 0.00 0.00 0.00 176.54 176.74 2w3s h ALA 350 N 1.34 0.38 -0.52 3.60 0.00 -1.19 -2.20 119.26 120.67 2w3s h ALA 350 Ca 0.24 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 2w3s h ALA 350 Cb 0.26 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2w3s h ALA 350 CO -0.25 -0.29 0.08 1.25 0.00 0.00 0.00 179.25 180.04 2w3s h LEU 351 N 0.25 0.83 -0.47 0.00 5.85 -0.77 0.25 115.31 121.25 2w3s h LEU 351 Ca 0.15 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.70 2w3s h LEU 351 Cb 0.14 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 40.85 2w3s h LEU 351 CO -0.17 0.89 -0.36 1.23 -0.34 0.00 0.00 178.44 179.69 2w3s h GLY 352 N 0.75 -0.29 1.00 3.75 0.00 -0.92 0.24 103.07 107.61 2w3s h GLY 352 Ca 0.16 0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.89 2w3s h GLY 352 CO 0.01 -0.20 0.16 1.98 0.00 0.00 0.00 176.54 178.49 2w3s h MET 353 N -0.24 0.91 0.00 4.80 1.85 -1.18 -2.20 114.93 118.87 2w3s h MET 353 Ca 0.18 -0.21 -0.05 0.00 -0.61 0.00 0.00 59.70 59.01 2w3s h MET 353 Cb 0.55 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.45 2w3s h MET 353 CO -0.60 0.83 -0.25 0.93 -0.40 0.00 0.00 176.91 177.43 2w3s h GLU 354 N 0.82 0.00 -0.10 0.39 4.39 -0.24 -0.82 114.58 119.02 2w3s h GLU 354 Ca 0.18 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.81 2w3s h GLU 354 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 2w3s h GLU 354 CO -0.00 0.25 -0.22 -0.09 -1.16 0.00 0.00 179.01 177.79 2w3s h ARG 355 N 0.00 0.32 -0.44 2.33 1.12 -0.37 -2.49 114.38 114.85 2w3s h ARG 355 Ca -0.00 -0.21 0.05 0.00 -1.11 0.00 0.00 59.98 58.71 2w3s h ARG 355 Cb 0.46 0.03 -0.05 0.00 -0.01 0.00 0.00 29.97 30.41 2w3s h ARG 355 CO 0.03 0.81 0.17 0.00 -3.11 0.00 0.00 179.97 177.88 2w3s h ALA 356 N 0.50 0.54 0.00 2.80 0.00 -0.85 -0.58 119.26 121.67 2w3s h ALA 356 Ca 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2w3s h ALA 356 Cb 0.81 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2w3s h ALA 356 CO 0.05 -0.21 -0.50 0.97 0.00 0.00 0.00 179.25 179.56 2w3s h ILE 357 N 0.35 1.24 -0.08 0.00 2.10 -1.23 -1.18 117.51 118.71 2w3s h ILE 357 Ca 0.20 -1.76 -0.01 0.00 1.08 0.00 0.00 64.86 64.37 2w3s h ILE 357 Cb 0.18 1.98 -0.00 0.00 -1.09 0.00 0.00 36.82 37.89 2w3s h ILE 357 CO -0.19 0.49 0.02 -0.08 -1.08 0.00 0.00 178.15 177.30 2w3s h GLU 358 N 0.00 0.13 0.07 2.19 4.57 -0.94 -2.05 114.58 118.54 2w3s h GLU 358 Ca -0.00 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2w3s h GLU 358 Cb 0.94 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.49 2w3s h GLU 358 CO 0.06 0.34 -0.28 1.25 -1.18 0.00 0.00 179.01 179.21 2w3s h HIS 359 N -0.10 -0.80 -0.67 0.92 2.76 -0.81 0.15 115.15 116.60 2w3s h HIS 359 Ca 0.02 0.02 0.11 0.00 -2.20 0.00 0.00 60.37 58.33 2w3s h HIS 359 Cb 0.27 0.34 -0.12 0.00 1.55 0.00 0.00 27.41 29.45 2w3s h HIS 359 CO 0.01 -0.31 -0.34 1.25 -1.30 0.00 0.00 177.93 177.24 2w3s h LEU 360 N -0.40 -1.21 -0.26 0.26 5.85 -1.27 0.38 115.31 118.66 2w3s h LEU 360 Ca -0.00 0.24 0.06 0.00 0.84 0.00 0.00 57.88 59.02 2w3s h LEU 360 Cb 0.40 0.61 -0.07 0.00 0.37 0.00 0.00 40.66 41.96 2w3s h LEU 360 CO -0.15 -0.30 -0.28 0.00 -0.34 0.00 0.00 178.44 177.38 2w3s h ALA 361 N 1.07 -0.18 -0.39 1.25 0.00 -1.14 0.07 119.26 119.95 2w3s h ALA 361 Ca 0.25 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2w3s h ALA 361 Cb 0.56 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 2w3s h ALA 361 CO -0.74 -0.70 0.18 0.00 0.00 0.00 0.00 179.25 177.99 2w3s h ARG 362 N -0.28 0.36 0.00 0.00 2.47 0.56 0.15 114.38 117.64 2w3s h ARG 362 Ca 0.14 -0.02 -0.04 0.00 -1.26 0.00 0.00 59.98 58.80 2w3s h ARG 362 Cb 0.50 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.73 2w3s h ARG 362 CO -0.42 0.24 -0.20 0.78 0.56 0.00 0.00 179.97 180.93 2w3s h GLY 363 N 0.37 0.00 -2.93 0.04 0.00 0.64 0.18 103.07 101.38 2w3s h GLY 363 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2w3s h GLY 363 CO -0.13 0.00 0.00 1.15 0.00 0.00 0.00 176.54 177.56 2w3s n MET 364 N -4.20 3.76 -3.90 4.80 0.00 -0.08 -4.96 117.12 112.53 2w3s n MET 364 Ca -0.02 -2.88 -0.26 0.00 0.00 0.00 0.00 57.70 54.54 2w3s n MET 364 Cb 0.26 -1.90 -0.01 0.00 0.00 0.00 0.00 33.22 31.58 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 0.95 -0.30 3.63 3.17 0.00 0.65 -4.99 105.19 108.29 2w3s n GLY 365 Ca 0.25 0.18 -0.25 0.00 0.00 0.00 0.00 46.02 46.20 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 -6.45 2.26 -0.00 1.61 6.06 0.44 -5.02 118.95 117.85 2w3s s ARG 366 Ca 0.05 -1.30 -0.30 0.00 -2.50 0.00 0.00 55.73 51.67 2w3s s ARG 366 Cb -0.02 -2.21 -0.07 0.00 0.06 0.00 0.00 34.95 32.72 2w3s s ARG 366 CO 0.88 0.40 1.63 0.34 -2.50 0.00 0.00 175.30 176.06 2w3s s ASP 367 N -3.28 6.66 0.17 -2.12 2.15 -1.26 -4.35 116.67 114.64 2w3s s ASP 367 Ca 0.29 2.32 -0.11 0.00 0.43 0.00 0.00 52.55 55.48 2w3s s ASP 367 Cb -0.08 -2.55 0.07 0.00 -0.30 0.00 0.00 42.92 40.07 2w3s s ASP 367 CO 0.18 -0.89 1.70 -0.65 -0.17 0.00 0.00 175.17 175.35 2w3s h PRO 368 N 8.94 0.94 -0.12 4.34 0.11 -1.94 -2.12 132.00 142.15 2w3s h PRO 368 Ca -0.41 -0.20 0.05 0.00 0.11 0.00 0.00 66.00 65.55 2w3s h PRO 368 Cb 1.19 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.10 2w3s h PRO 368 CO 0.94 0.83 -0.33 0.00 -0.21 0.00 0.00 178.00 179.23 2w3s h ALA 369 N 1.06 -0.40 -0.68 -0.75 0.00 -1.91 -0.07 119.26 116.51 2w3s h ALA 369 Ca 0.19 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.22 2w3s h ALA 369 Cb 0.28 0.62 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 2w3s h ALA 369 CO -0.01 -0.81 0.30 1.49 0.00 0.00 0.00 179.25 180.23 2w3s h GLU 370 N -0.41 0.49 -0.62 0.00 4.22 -1.90 0.07 114.58 116.43 2w3s h GLU 370 Ca 0.09 -0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.47 2w3s h GLU 370 Cb 0.55 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2w3s h GLU 370 CO -0.35 0.33 0.26 1.25 -2.18 0.00 0.00 179.01 178.32 2w3s h LEU 371 N 0.51 0.85 0.09 1.64 5.85 -0.57 0.40 115.31 124.07 2w3s h LEU 371 Ca 0.35 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2w3s h LEU 371 Cb 0.41 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 2w3s h LEU 371 CO -0.30 0.78 -0.06 0.03 -0.34 0.00 0.00 178.44 178.55 2w3s h ARG 372 N 0.86 -0.14 -0.71 1.25 3.08 -0.63 -2.89 114.38 115.21 2w3s h ARG 372 Ca 0.21 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.34 2w3s h ARG 372 Cb 0.19 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 2w3s h ARG 372 CO -0.02 -0.09 0.47 0.00 -1.07 0.00 0.00 179.97 179.25 2w3s h ALA 373 N 0.76 1.74 0.00 0.04 0.00 -0.56 0.37 119.26 121.62 2w3s h ALA 373 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2w3s h ALA 373 Cb 0.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2w3s h ALA 373 CO 0.01 0.14 -0.03 1.25 0.00 0.00 0.00 179.25 180.62 2w3s h LEU 374 N 0.71 0.00 -2.94 0.00 5.85 -0.77 -3.23 115.31 114.92 2w3s h LEU 374 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 2w3s h LEU 374 Cb 0.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.32 2w3s h LEU 374 CO -0.10 0.03 0.00 0.59 -0.34 0.00 0.00 178.44 178.62 2w3s n ASN 375 N -3.22 2.02 -4.66 1.25 3.02 0.12 -4.93 115.26 108.86 2w3s n ASN 375 Ca -0.01 -1.98 -0.37 0.00 -0.03 0.00 0.00 54.58 52.20 2w3s n ASN 375 Cb 0.21 -0.01 0.07 0.00 -0.61 0.00 0.00 39.78 39.44 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 -0.44 1.18 -1.71 3.10 0.99 -0.48 -1.27 117.46 118.84 2w3s n PHE 376 Ca 0.01 0.42 -0.37 0.00 -0.00 0.00 0.00 57.45 57.50 2w3s n PHE 376 Cb 0.25 -2.16 0.06 0.00 -1.00 0.00 0.00 39.48 36.63 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 -2.13 1.79 -1.82 1.38 4.02 -1.13 -4.47 117.16 114.81 2w3s n TYR 377 Ca 0.14 0.43 -0.38 0.00 -0.01 0.00 0.00 57.90 58.08 2w3s n TYR 377 Cb 0.48 -2.26 0.05 0.00 -0.02 0.00 0.00 39.34 37.59 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 -1.27 5.11 0.95 7.72 1.01 -1.26 -4.81 116.67 124.13 2w3s s ASP 378 Ca 0.79 2.66 -0.14 0.00 0.71 0.00 0.00 52.55 56.57 2w3s s ASP 378 Cb -0.39 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 40.88 2w3s s ASP 378 CO 0.43 -1.67 -0.02 -2.65 0.21 0.00 0.00 175.17 171.47 2w3s n PRO 379 N -1.32 -0.16 -2.49 8.23 -0.02 -1.26 -4.53 135.00 133.45 2w3s n PRO 379 Ca 0.12 -0.02 -0.41 0.00 -2.02 0.00 0.00 63.50 61.17 2w3s n PRO 379 Cb 0.47 -1.55 -0.04 0.00 -0.02 0.00 0.00 33.50 32.36 2w3s n PRO 379 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2w3s s PRO 380 N -3.00 4.58 0.00 0.52 0.02 -1.26 -4.92 135.00 130.93 2w3s s PRO 380 Ca 0.51 1.75 0.00 0.00 0.02 0.00 0.00 61.00 63.28 2w3s s PRO 380 Cb -0.21 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.04 2w3s s PRO 380 CO 0.73 0.05 0.00 0.39 -0.33 0.00 0.00 177.00 177.84 2w3s n GLU 381 N 2.34 -0.18 -0.56 5.54 4.71 -1.26 -5.11 120.64 126.12 2w3s n GLU 381 Ca 0.03 0.00 -0.20 0.00 -0.01 0.00 0.00 57.16 56.98 2w3s n GLU 381 Cb 0.46 0.00 0.02 0.00 -1.01 0.00 0.00 31.44 30.90 2w3s n GLU 381 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2w3s n LYS 398 N 0.00 0.00 -0.25 3.49 4.01 -1.26 -5.17 118.16 118.99 2w3s n LYS 398 Ca 0.00 0.00 -0.10 0.00 -0.51 0.00 0.00 58.31 57.70 2w3s n LYS 398 Cb 0.00 -0.58 -0.01 0.00 -0.51 0.00 0.00 35.03 33.93 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 1.42 0.00 -1.66 1.97 -0.00 -1.26 -4.86 118.16 113.77 2w3s n LYS 399 Ca -0.01 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.89 2w3s n LYS 399 Cb 0.39 -0.22 0.02 0.00 -0.00 0.00 0.00 35.03 35.22 2w3s n LYS 399 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2w3s n THR 400 N 0.53 2.69 -1.72 0.58 -1.04 -1.26 -4.96 114.28 109.10 2w3s n THR 400 Ca 0.04 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.13 2w3s n THR 400 Cb -0.01 -1.37 -0.01 0.00 -1.82 0.00 0.00 70.33 67.12 2w3s n THR 400 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2w3s n GLN 401 N -0.07 2.38 -3.74 -2.82 6.02 -1.26 -4.87 117.38 113.01 2w3s n GLN 401 Ca 0.09 0.84 -0.21 0.00 -0.01 0.00 0.00 57.00 57.70 2w3s n GLN 401 Cb 0.40 -2.51 -0.04 0.00 1.02 0.00 0.00 30.24 29.12 2w3s n GLN 401 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2w3s s THR 402 N -0.76 3.15 0.94 5.09 -4.23 -1.26 -1.76 115.64 116.81 2w3s s THR 402 Ca 0.58 -1.38 -0.15 0.00 -1.18 0.00 0.00 61.69 59.55 2w3s s THR 402 Cb -0.54 -3.10 0.18 0.00 1.34 0.00 0.00 72.50 70.38 2w3s s THR 402 CO 0.58 -0.11 1.30 0.42 -0.54 0.00 0.00 174.62 176.28 2w3s s THR 403 N -2.38 2.00 0.40 3.99 -4.23 0.19 -4.83 115.64 110.78 2w3s s THR 403 Ca 0.43 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 61.02 2w3s s THR 403 Cb -0.04 -2.99 0.23 0.00 1.34 0.00 0.00 72.50 71.03 2w3s s THR 403 CO 0.27 0.00 2.02 1.12 -0.54 0.00 0.00 174.62 177.48 2w3s h HIS 404 N -1.57 0.44 0.00 3.99 2.07 -1.90 0.03 115.15 118.21 2w3s h HIS 404 Ca -0.45 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.07 2w3s h HIS 404 Cb 1.25 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 31.09 2w3s h HIS 404 CO -0.94 0.34 0.00 2.48 -3.07 0.00 0.00 177.93 176.74 2w3s n TYR 405 N -4.42 0.00 -0.49 6.12 0.18 -1.26 -4.65 117.16 112.64 2w3s n TYR 405 Ca 0.02 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.80 2w3s n TYR 405 Cb 0.12 -0.25 0.00 0.00 -0.38 0.00 0.00 39.34 38.83 2w3s n TYR 405 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2w3s n GLY 406 N 1.18 0.70 3.68 -7.48 0.00 -0.00 -1.75 105.19 101.53 2w3s n GLY 406 Ca 0.15 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.90 4.31 0.26 1.61 0.74 -1.21 -4.68 119.66 119.78 2w3s s GLN 407 Ca 0.00 0.84 -0.31 0.00 0.05 0.00 0.00 55.36 55.94 2w3s s GLN 407 Cb 0.00 -3.53 -0.12 0.00 1.10 0.00 0.00 33.01 30.45 2w3s s GLN 407 CO 0.00 -0.17 1.55 0.39 -0.55 0.00 0.00 175.29 176.50 2w3s n GLU 408 N 4.71 2.44 -3.56 1.67 1.02 -1.26 -0.64 120.64 125.03 2w3s n GLU 408 Ca 0.01 0.87 -0.41 0.00 -0.02 0.00 0.00 57.16 57.61 2w3s n GLU 408 Cb 0.50 -2.62 -0.08 0.00 -0.02 0.00 0.00 31.44 29.22 2w3s n GLU 408 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2w3s s VAL 409 N 0.18 4.23 -0.61 2.62 1.01 -0.72 -4.91 120.40 122.19 2w3s s VAL 409 Ca 0.68 -1.91 0.06 0.00 0.00 0.00 0.00 61.98 60.80 2w3s s VAL 409 Cb -0.56 -3.78 0.10 0.00 0.00 0.00 0.00 36.38 32.14 2w3s s VAL 409 CO 0.46 -0.80 0.90 0.00 0.00 0.00 0.00 175.10 175.67 2w3s n ALA 410 N 4.76 2.29 -0.28 5.51 0.00 -1.26 -4.57 120.51 126.96 2w3s n ALA 410 Ca -0.06 -0.81 0.02 0.00 0.00 0.00 0.00 53.44 52.60 2w3s n ALA 410 Cb 0.41 -0.21 0.03 0.00 0.00 0.00 0.00 19.45 19.67 2w3s n ALA 410 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2w3s n ASP 411 N 0.18 1.93 -4.55 0.00 5.68 -1.26 -4.43 116.55 114.10 2w3s n ASP 411 Ca 0.05 -2.15 -0.34 0.00 -0.50 0.00 0.00 54.79 51.85 2w3s n ASP 411 Cb 0.24 -0.08 -0.04 0.00 -1.14 0.00 0.00 41.12 40.10 2w3s n ASP 411 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2w3s n VAL 413 N 7.47 0.54 -0.37 0.00 0.24 -1.26 -4.04 118.33 120.91 2w3s n VAL 413 Ca 0.28 -0.55 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2w3s n VAL 413 Cb 0.50 0.31 0.14 0.00 -1.47 0.00 0.00 33.84 33.32 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 2.51 1.08 -0.44 1.34 3.38 -1.89 -2.02 115.31 119.27 2w3s h LEU 414 Ca 0.00 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.04 2w3s h LEU 414 Cb 0.57 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 2w3s h LEU 414 CO 0.00 0.74 0.04 1.23 0.09 0.00 0.00 178.44 180.54 2w3s h GLY 415 N 1.26 0.48 0.85 0.83 0.00 -1.87 -1.37 103.07 103.25 2w3s h GLY 415 Ca 0.39 0.02 -0.17 0.00 0.00 0.00 0.00 47.33 47.58 2w3s h GLY 415 CO -0.12 -0.09 -0.65 -2.09 0.00 0.00 0.00 176.54 173.59 2w3s h GLU 416 N 0.16 0.46 -0.31 4.80 4.81 -1.77 -2.62 114.58 120.10 2w3s h GLU 416 Ca 0.22 -0.48 0.07 0.00 -0.13 0.00 0.00 59.36 59.04 2w3s h GLU 416 Cb 0.30 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.75 2w3s h GLU 416 CO -0.33 1.13 -0.14 1.25 -0.73 0.00 0.00 179.01 180.19 2w3s h LEU 417 N -0.02 -0.46 -0.81 1.64 6.46 -1.29 0.16 115.31 120.98 2w3s h LEU 417 Ca -0.08 0.12 0.03 0.00 -0.12 0.00 0.00 57.88 57.83 2w3s h LEU 417 Cb 1.35 0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 41.49 2w3s h LEU 417 CO 0.13 -0.17 0.52 0.58 -0.62 0.00 0.00 178.44 178.88 2w3s h VAL 418 N -0.08 1.14 0.24 1.05 2.07 -1.27 0.31 116.25 119.70 2w3s h VAL 418 Ca 0.16 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2w3s h VAL 418 Cb 0.33 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 2w3s h VAL 418 CO -0.37 0.19 -0.24 0.74 0.02 0.00 0.00 177.57 177.91 2w3s h THR 419 N 1.03 0.49 -0.91 2.57 2.02 -0.95 0.40 112.91 117.55 2w3s h THR 419 Ca 0.32 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.58 2w3s h THR 419 Cb -0.02 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 66.81 2w3s h THR 419 CO -0.10 0.00 0.57 -0.09 0.37 0.00 0.00 175.52 176.26 2w3s h ARG 420 N -0.51 0.96 -0.35 6.66 2.43 -0.05 -2.06 114.38 121.46 2w3s h ARG 420 Ca -0.00 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 58.97 2w3s h ARG 420 Cb 0.47 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2w3s h ARG 420 CO -0.05 0.63 -0.33 1.25 -1.51 0.00 0.00 179.97 179.96 2w3s h LEU 421 N 0.99 0.89 -0.15 3.80 5.85 -0.13 -2.29 115.31 124.27 2w3s h LEU 421 Ca 0.42 -0.46 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2w3s h LEU 421 Cb 0.27 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2w3s h LEU 421 CO -0.21 1.17 0.09 1.56 -0.34 0.00 0.00 178.44 180.72 2w3s h GLN 422 N 0.63 0.21 -0.15 1.25 4.20 -0.39 0.19 115.11 121.05 2w3s h GLN 422 Ca 0.06 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2w3s h GLN 422 Cb 0.91 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2w3s h GLN 422 CO 0.08 0.17 0.07 1.57 -0.67 0.00 0.00 178.83 180.05 2w3s h LYS 423 N 0.18 0.21 0.00 1.46 -0.00 -1.39 -0.54 116.57 116.50 2w3s h LYS 423 Ca 0.06 -0.03 -0.06 0.00 -0.00 0.00 0.00 60.65 60.61 2w3s h LYS 423 Cb 0.01 -0.04 -0.01 0.00 -0.00 0.00 0.00 32.23 32.20 2w3s h LYS 423 CO -0.01 0.28 -0.29 0.66 -0.00 0.00 0.00 179.45 180.09 2w3s h SER 424 N 0.10 0.00 0.71 7.07 4.64 -1.22 -1.13 113.55 123.73 2w3s h SER 424 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2w3s h SER 424 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2w3s h SER 424 CO -0.01 0.29 -0.09 0.00 -0.87 0.00 0.00 176.83 176.15 2w3s n ALA 425 N -2.37 2.62 -3.25 5.18 0.00 0.64 -4.97 120.51 118.37 2w3s n ALA 425 Ca -0.01 -0.18 -0.16 0.00 0.00 0.00 0.00 53.44 53.09 2w3s n ALA 425 Cb 0.38 -1.40 0.07 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.35 -3.42 0.28 0.00 4.05 -0.43 -4.93 115.26 109.46 2w3s n ASN 426 Ca 0.10 -0.48 -0.15 0.00 0.45 0.00 0.00 54.58 54.50 2w3s n ASN 426 Cb 0.31 -4.23 -0.08 0.00 1.23 0.00 0.00 39.78 37.00 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 -1.80 -0.66 0.10 1.20 3.57 -1.34 -2.41 116.94 115.59 2w3s h PHE 427 Ca -0.47 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.01 2w3s h PHE 427 Cb 1.29 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 40.23 2w3s h PHE 427 CO 0.38 -0.34 -0.21 1.15 -2.23 0.00 0.00 178.31 177.06 2w3s h THR 428 N -0.91 0.00 -0.74 4.41 2.02 -1.93 -2.55 112.91 113.21 2w3s h THR 428 Ca -0.07 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.23 2w3s h THR 428 Cb 0.61 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.90 2w3s h THR 428 CO 0.12 0.00 -0.37 0.74 0.37 0.00 0.00 175.52 176.37 2w3s h THR 429 N -0.34 0.10 -0.83 3.16 2.02 -1.97 -0.55 112.91 114.49 2w3s h THR 429 Ca -0.01 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.31 2w3s h THR 429 Cb 0.32 0.10 -0.06 0.00 -1.74 0.00 0.00 68.15 66.77 2w3s h THR 429 CO -0.08 0.00 0.55 0.03 0.37 0.00 0.00 175.52 176.38 2w3s h ARG 430 N -0.11 0.56 -0.47 6.66 3.08 -1.27 -0.26 114.38 122.57 2w3s h ARG 430 Ca 0.26 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.22 2w3s h ARG 430 Cb 0.56 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2w3s h ARG 430 CO -0.79 0.37 0.06 -0.09 -1.07 0.00 0.00 179.97 178.45 2w3s h ARG 431 N 0.58 0.78 -0.04 0.04 2.43 -0.68 0.15 114.38 117.65 2w3s h ARG 431 Ca 0.41 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2w3s h ARG 431 Cb 0.77 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2w3s h ARG 431 CO -0.17 0.80 0.02 0.00 -1.51 0.00 0.00 179.97 179.11 2w3s h ALA 432 N 0.95 0.05 -0.82 2.80 0.00 -1.10 -0.96 119.26 120.18 2w3s h ALA 432 Ca 0.14 -0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.18 2w3s h ALA 432 Cb 0.41 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.07 2w3s h ALA 432 CO 0.01 -0.40 0.29 0.93 0.00 0.00 0.00 179.25 180.08 2w3s h GLU 433 N -0.04 0.34 -0.15 0.00 5.08 -0.63 -1.74 114.58 117.44 2w3s h GLU 433 Ca 0.01 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2w3s h GLU 433 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2w3s h GLU 433 CO -0.00 0.23 -0.01 0.82 -1.00 0.00 0.00 179.01 179.04 2w3s h ILE 434 N 0.35 1.26 -0.06 3.13 2.04 -0.34 -2.06 117.51 121.83 2w3s h ILE 434 Ca 0.49 -0.88 0.03 0.00 1.00 0.00 0.00 64.86 65.50 2w3s h ILE 434 Cb 0.87 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.44 2w3s h ILE 434 CO -0.51 0.26 -0.44 0.00 0.00 0.00 0.00 178.15 177.46 2w3s h ALA 435 N 0.75 -0.68 -0.75 1.87 0.00 -0.50 0.26 119.26 120.22 2w3s h ALA 435 Ca 0.04 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.07 2w3s h ALA 435 Cb 0.40 0.80 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 2w3s h ALA 435 CO 0.01 -0.97 -0.17 0.00 0.00 0.00 0.00 179.25 178.12 2w3s h ALA 436 N -0.02 0.51 -0.25 0.00 0.00 -1.40 0.15 119.26 118.25 2w3s h ALA 436 Ca 0.06 0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2w3s h ALA 436 Cb 0.65 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2w3s h ALA 436 CO -0.36 -0.41 0.15 2.35 0.00 0.00 0.00 179.25 180.97 2w3s h TRP 437 N 0.01 0.33 -0.32 0.00 7.01 -0.55 -2.82 115.95 119.60 2w3s h TRP 437 Ca 0.36 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.37 2w3s h TRP 437 Cb 0.56 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.49 2w3s h TRP 437 CO -0.58 0.26 0.19 -0.91 -2.79 0.00 0.00 178.44 174.61 2w3s h ASN 438 N 0.31 0.31 -0.40 2.65 2.35 0.51 -2.27 115.58 119.04 2w3s h ASN 438 Ca 0.09 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.96 2w3s h ASN 438 Cb 0.03 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2w3s h ASN 438 CO -0.02 0.23 0.34 0.77 -1.65 0.00 0.00 177.43 177.10 2w3s h SER 439 N 0.39 0.00 0.07 5.81 4.64 -0.82 0.36 113.55 124.01 2w3s h SER 439 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2w3s h SER 439 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2w3s h SER 439 CO -0.05 0.00 -0.19 0.41 -0.87 0.00 0.00 176.83 176.13 2w3s n THR 440 N -4.10 0.00 -4.40 2.95 -1.04 -0.88 -4.94 114.28 101.87 2w3s n THR 440 Ca 0.07 -0.26 -0.28 0.00 -2.04 0.00 0.00 64.05 61.54 2w3s n THR 440 Cb 0.52 0.81 -0.13 0.00 -1.82 0.00 0.00 70.33 69.71 2w3s n THR 440 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2w3s s ASN 441 N -2.27 3.35 0.00 8.00 -0.87 0.13 -5.03 114.94 118.25 2w3s s ASN 441 Ca 0.27 -0.78 0.00 0.00 -1.57 0.00 0.00 52.86 50.79 2w3s s ASN 441 Cb 0.20 -0.23 0.00 0.00 -0.02 0.00 0.00 41.25 41.20 2w3s s ASN 441 CO 0.44 0.17 0.00 -2.11 -2.57 0.00 0.00 177.10 173.03 2w3s n ARG 442 N 0.76 3.15 -0.11 -0.60 1.85 -1.26 -4.87 116.66 115.58 2w3s n ARG 442 Ca -0.17 0.00 -0.20 0.00 -1.00 0.00 0.00 57.85 56.49 2w3s n ARG 442 Cb 0.54 -0.42 -0.12 0.00 -1.05 0.00 0.00 32.46 31.41 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 -0.45 1.54 -3.96 8.89 -1.04 -1.26 -4.88 114.28 113.12 2w3s n THR 443 Ca 0.00 -0.56 -0.22 0.00 -2.04 0.00 0.00 64.05 61.23 2w3s n THR 443 Cb 0.00 -1.52 -0.04 0.00 -1.82 0.00 0.00 70.33 66.95 2w3s n THR 443 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2w3s s LEU 444 N -6.71 3.58 -0.28 -4.42 1.43 -1.26 0.42 118.68 111.44 2w3s s LEU 444 Ca -0.33 -0.48 -0.24 0.00 -1.03 0.00 0.00 54.13 52.05 2w3s s LEU 444 Cb 0.09 -2.15 0.09 0.00 0.03 0.00 0.00 46.19 44.26 2w3s s LEU 444 CO 0.62 -0.24 0.86 0.00 0.23 0.00 0.00 176.35 177.82 2w3s s ALA 445 N -2.28 -1.88 -0.12 4.21 0.00 -0.69 -4.81 121.76 116.19 2w3s s ALA 445 Ca 0.38 1.99 -0.04 0.00 0.00 0.00 0.00 51.96 54.29 2w3s s ALA 445 Cb -0.06 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2w3s s ALA 445 CO 0.25 -0.30 0.04 1.03 0.00 0.00 0.00 175.76 176.78 2w3s s ARG 446 N 0.41 3.32 0.28 0.00 0.52 -1.26 -0.23 118.95 121.99 2w3s s ARG 446 Ca 0.01 -0.34 0.11 0.00 -0.52 0.00 0.00 55.73 54.98 2w3s s ARG 446 Cb -0.05 -2.97 -0.05 0.00 0.52 0.00 0.00 34.95 32.40 2w3s s ARG 446 CO -0.03 0.61 -0.17 0.20 0.02 0.00 0.00 175.30 175.92 2w3s s GLY 447 N -0.59 1.90 -0.08 -3.53 0.00 -1.09 -4.45 107.32 99.47 2w3s s GLY 447 Ca 0.11 -1.90 -0.07 0.00 0.00 0.00 0.00 44.72 42.86 2w3s s GLY 447 CO 0.02 -1.96 0.21 -1.50 0.00 0.00 0.00 173.10 169.87 2w3s s ILE 448 N -2.60 -0.01 0.02 0.90 2.07 -1.25 -1.50 121.20 118.84 2w3s s ILE 448 Ca 0.30 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.57 2w3s s ILE 448 Cb -0.03 -0.30 -0.02 0.00 0.13 0.00 0.00 42.46 42.25 2w3s s ILE 448 CO 0.14 0.01 -0.04 0.00 -1.91 0.00 0.00 174.94 173.14 2w3s s ALA 449 N 0.31 0.27 -0.13 1.50 0.00 -0.64 -4.70 121.76 118.37 2w3s s ALA 449 Ca -0.02 -0.51 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 2w3s s ALA 449 Cb -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 2w3s s ALA 449 CO -0.01 -0.06 -0.08 -1.17 0.00 0.00 0.00 175.76 174.43 2w3s s LEU 450 N -1.12 3.00 -0.01 0.00 0.20 -1.26 -1.57 118.68 117.91 2w3s s LEU 450 Ca -0.10 -0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.54 2w3s s LEU 450 Cb -0.08 -1.69 0.00 0.00 -0.43 0.00 0.00 46.19 44.00 2w3s s LEU 450 CO -0.00 0.20 -0.06 -0.94 -0.29 0.00 0.00 176.35 175.26 2w3s s SER 451 N 0.14 0.78 0.69 3.68 1.04 -0.39 -4.87 113.70 114.77 2w3s s SER 451 Ca -0.04 -0.12 -0.03 0.00 0.48 0.00 0.00 55.95 56.25 2w3s s SER 451 Cb -0.14 -0.16 0.10 0.00 0.10 0.00 0.00 66.02 65.91 2w3s s SER 451 CO 0.04 0.05 0.97 -2.16 0.98 0.00 0.00 173.24 173.11 2w3s s PRO 452 N 0.10 1.92 -0.02 4.02 0.04 -1.26 -2.31 135.00 137.48 2w3s s PRO 452 Ca -0.01 -0.79 -0.01 0.00 0.04 0.00 0.00 61.00 60.23 2w3s s PRO 452 Cb -0.05 -2.30 0.02 0.00 0.04 0.00 0.00 34.50 32.21 2w3s s PRO 452 CO -0.00 -1.30 0.05 0.08 0.04 0.00 0.00 177.00 175.87 2w3s s VAL 453 N -3.13 -0.03 -0.26 -0.36 1.01 -0.04 -4.90 120.40 112.69 2w3s s VAL 453 Ca 0.63 0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.71 2w3s s VAL 453 Cb -0.08 -0.10 0.09 0.00 0.00 0.00 0.00 36.38 36.29 2w3s s VAL 453 CO 0.44 0.05 0.10 -0.75 0.00 0.00 0.00 175.10 174.94 2w3s s LYS 454 N 0.67 0.38 -0.15 2.72 2.20 -1.26 -2.43 119.74 121.88 2w3s s LYS 454 Ca -0.05 -0.59 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 2w3s s LYS 454 Cb -0.08 -1.62 -0.01 0.00 -1.51 0.00 0.00 37.83 34.60 2w3s s LYS 454 CO -0.02 -0.90 -0.11 0.12 -0.36 0.00 0.00 175.35 174.08 2w3s s PHE 455 N 1.94 2.85 0.03 4.03 5.36 0.40 -4.91 117.98 127.69 2w3s s PHE 455 Ca 0.07 -0.70 -0.25 0.00 -0.96 0.00 0.00 56.93 55.09 2w3s s PHE 455 Cb -0.16 -1.90 -0.05 0.00 -0.34 0.00 0.00 43.02 40.57 2w3s s PHE 455 CO -0.25 -0.27 0.77 0.20 -1.46 0.00 0.00 175.22 174.20 2w3s s GLY 456 N 0.57 2.78 -0.30 13.12 0.00 -1.26 0.06 107.32 122.28 2w3s s GLY 456 Ca -0.07 0.28 -0.10 0.00 0.00 0.00 0.00 44.72 44.83 2w3s s GLY 456 CO 0.03 1.12 0.16 -0.42 0.00 0.00 0.00 173.10 174.00 2w3s s ILE 457 N 0.07 4.77 0.00 0.90 -1.09 -0.27 -4.98 121.20 120.60 2w3s s ILE 457 Ca 0.39 -0.28 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 2w3s s ILE 457 Cb -0.20 -3.39 0.00 0.00 -1.58 0.00 0.00 42.46 37.29 2w3s s ILE 457 CO 0.23 0.11 0.00 -1.20 -1.23 0.00 0.00 174.94 172.85 2w3s n SER 458 N 5.00 0.00 -4.67 3.58 7.64 -1.26 -2.12 113.62 121.79 2w3s n SER 458 Ca -0.14 0.00 -0.50 0.00 1.01 0.00 0.00 58.87 59.24 2w3s n SER 458 Cb 0.50 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.65 2w3s n SER 458 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2w3s n PHE 459 N -2.00 2.18 0.25 1.43 3.72 -1.26 -4.85 117.46 116.93 2w3s n PHE 459 Ca 0.00 0.23 0.13 0.00 -0.05 0.00 0.00 57.45 57.76 2w3s n PHE 459 Cb 0.00 -2.56 0.64 0.00 -0.94 0.00 0.00 39.48 36.61 2w3s n PHE 459 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2w3s h THR 460 N 4.70 0.38 -1.96 4.37 1.35 -1.98 -3.30 112.91 116.46 2w3s h THR 460 Ca -0.47 -0.74 -0.55 0.00 -0.55 0.00 0.00 66.41 64.10 2w3s h THR 460 Cb 1.28 1.54 -0.08 0.00 -1.73 0.00 0.00 68.15 69.16 2w3s h THR 460 CO 0.92 0.12 1.19 -0.22 -0.25 0.00 0.00 175.52 177.28 2w3s s LEU 461 N -6.71 3.26 0.16 3.87 1.98 -1.26 -4.96 118.68 115.02 2w3s s LEU 461 Ca -0.01 -0.72 -0.15 0.00 -2.89 0.00 0.00 54.13 50.36 2w3s s LEU 461 Cb 0.11 -2.56 0.08 0.00 0.66 0.00 0.00 46.19 44.48 2w3s s LEU 461 CO 0.58 -1.77 1.76 0.74 -1.89 0.00 0.00 176.35 175.78 2w3s h THR 462 N 6.30 0.92 0.00 3.68 2.02 -1.96 -2.30 112.91 121.57 2w3s h THR 462 Ca -0.13 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2w3s h THR 462 Cb 1.04 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2w3s h THR 462 CO 1.32 0.06 0.00 0.00 0.37 0.00 0.00 175.52 177.28 2w3s n HIS 463 N -4.97 0.00 1.31 3.16 1.44 -1.26 -0.70 115.22 114.20 2w3s n HIS 463 Ca 0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.86 2w3s n HIS 463 Cb 0.13 -0.36 0.67 0.00 0.12 0.00 0.00 29.99 30.54 2w3s n HIS 463 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2w3s n LEU 464 N -1.36 0.00 -3.20 2.39 4.77 -0.87 -4.34 117.00 114.39 2w3s n LEU 464 Ca 0.02 0.22 -0.36 0.00 -0.03 0.00 0.00 56.01 55.85 2w3s n LEU 464 Cb 0.04 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 40.90 2w3s n LEU 464 CO 0.04 -0.04 2.21 0.59 -1.33 0.00 0.00 177.39 178.86 2w3s n ASN 465 N -1.22 7.63 -4.10 -1.43 3.02 0.12 -4.70 115.26 114.58 2w3s n ASN 465 Ca 0.14 -3.13 -0.13 0.00 -0.03 0.00 0.00 54.58 51.42 2w3s n ASN 465 Cb 0.17 -1.33 -0.11 0.00 -0.61 0.00 0.00 39.78 37.90 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 -1.17 0.64 -0.06 3.52 -2.07 -1.26 -0.96 119.66 118.29 2w3s s GLN 466 Ca 0.56 -0.90 -0.15 0.00 -1.82 0.00 0.00 55.36 53.05 2w3s s GLN 466 Cb 0.24 -0.37 0.03 0.00 -1.09 0.00 0.00 33.01 31.82 2w3s s GLN 466 CO -0.12 0.06 0.35 0.00 -1.32 0.00 0.00 175.29 174.25 2w3s s ALA 467 N -1.78 -0.87 0.16 2.60 0.00 0.13 -4.49 121.76 117.50 2w3s s ALA 467 Ca -0.05 0.64 0.09 0.00 0.00 0.00 0.00 51.96 52.65 2w3s s ALA 467 Cb -0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 2w3s s ALA 467 CO -0.00 -0.23 -0.20 0.20 0.00 0.00 0.00 175.76 175.53 2w3s s GLY 468 N -0.73 1.43 0.08 0.00 0.00 -1.26 0.01 107.32 106.85 2w3s s GLY 468 Ca -0.08 -1.49 0.03 0.00 0.00 0.00 0.00 44.72 43.18 2w3s s GLY 468 CO 0.03 -1.53 -0.09 0.00 0.00 0.00 0.00 173.10 171.51 2w3s s ALA 469 N -1.88 0.91 -0.08 3.20 0.00 0.31 -2.06 121.76 122.17 2w3s s ALA 469 Ca 0.16 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 51.08 2w3s s ALA 469 Cb -0.07 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.11 2w3s s ALA 469 CO 0.07 -0.04 -0.10 -1.17 0.00 0.00 0.00 175.76 174.51 2w3s s LEU 470 N -2.18 1.50 -0.07 0.00 2.96 0.57 0.14 118.68 121.59 2w3s s LEU 470 Ca 0.00 -0.28 0.05 0.00 -0.22 0.00 0.00 54.13 53.68 2w3s s LEU 470 Cb -0.05 -0.80 -0.00 0.00 0.50 0.00 0.00 46.19 45.84 2w3s s LEU 470 CO -0.00 -0.02 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.09 2w3s s VAL 471 N 0.96 1.90 -0.06 1.68 1.01 -0.18 -2.10 120.40 123.62 2w3s s VAL 471 Ca -0.09 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 60.98 2w3s s VAL 471 Cb -0.15 -1.63 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2w3s s VAL 471 CO 0.00 0.53 -0.19 -1.10 0.00 0.00 0.00 175.10 174.34 2w3s s GLN 472 N 0.12 2.55 -0.20 2.72 -1.52 -0.65 -1.42 119.66 121.25 2w3s s GLN 472 Ca -0.10 -0.79 -0.04 0.00 -1.95 0.00 0.00 55.36 52.47 2w3s s GLN 472 Cb -0.15 -2.29 -0.02 0.00 -0.22 0.00 0.00 33.01 30.33 2w3s s GLN 472 CO 0.05 0.50 -0.02 0.42 -0.25 0.00 0.00 175.29 175.99 2w3s s ILE 473 N -0.43 3.74 0.50 1.08 1.01 0.33 -1.20 121.20 126.22 2w3s s ILE 473 Ca 0.05 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 2w3s s ILE 473 Cb -0.12 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.65 2w3s s ILE 473 CO 0.02 0.43 0.78 -0.31 0.00 0.00 0.00 174.94 175.86 2w3s s TYR 474 N 1.11 3.41 -0.20 3.97 1.51 -0.25 -4.78 117.35 122.11 2w3s s TYR 474 Ca 0.02 0.63 0.25 0.00 -1.01 0.00 0.00 57.07 56.95 2w3s s TYR 474 Cb -0.14 -2.40 1.23 0.00 -0.11 0.00 0.00 41.96 40.53 2w3s s TYR 474 CO 0.01 -0.43 1.75 1.79 -1.11 0.00 0.00 175.55 177.56 2w3s h THR 475 N 0.17 0.00 -0.40 -0.71 1.35 -1.94 -0.82 112.91 110.57 2w3s h THR 475 Ca -0.47 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 2w3s h THR 475 Cb 1.23 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2w3s h THR 475 CO 0.61 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.98 2w3s n ASP 476 N -2.37 2.34 0.00 5.36 3.85 -1.26 -4.38 116.55 120.08 2w3s n ASP 476 Ca -0.00 -2.05 0.00 0.00 -0.71 0.00 0.00 54.79 52.02 2w3s n ASP 476 Cb 0.12 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 39.58 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 1.07 1.89 3.83 6.12 0.00 -0.31 -4.87 105.19 112.91 2w3s n GLY 477 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.43 6.70 -0.07 1.61 1.04 -1.25 -4.81 113.70 113.48 2w3s s SER 478 Ca 0.00 1.62 0.05 0.00 0.48 0.00 0.00 55.95 58.10 2w3s s SER 478 Cb 0.00 -2.52 -0.01 0.00 0.10 0.00 0.00 66.02 63.59 2w3s s SER 478 CO 0.00 -0.53 -0.23 -0.69 0.98 0.00 0.00 173.24 172.77 2w3s s VAL 479 N -2.46 1.92 -0.28 5.02 1.01 0.10 -1.10 120.40 124.61 2w3s s VAL 479 Ca 0.60 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 61.51 2w3s s VAL 479 Cb -0.10 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2w3s s VAL 479 CO 0.25 0.53 0.15 0.00 0.00 0.00 0.00 175.10 176.03 2w3s s ALA 480 N 0.06 3.37 -0.11 5.51 0.00 -0.34 -0.52 121.76 129.73 2w3s s ALA 480 Ca -0.09 -1.15 -0.04 0.00 0.00 0.00 0.00 51.96 50.68 2w3s s ALA 480 Cb -0.15 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 2w3s s ALA 480 CO 0.05 -0.59 0.03 -1.17 0.00 0.00 0.00 175.76 174.08 2w3s s LEU 481 N 1.69 3.70 -0.13 0.00 2.96 0.12 -1.64 118.68 125.38 2w3s s LEU 481 Ca 0.06 0.15 -0.07 0.00 -0.22 0.00 0.00 54.13 54.05 2w3s s LEU 481 Cb -0.16 -1.87 0.05 0.00 0.50 0.00 0.00 46.19 44.71 2w3s s LEU 481 CO 0.08 0.33 0.32 0.21 -1.32 0.00 0.00 176.35 175.96 2w3s s ASN 482 N -0.58 -0.37 0.26 3.68 3.84 -0.89 -0.99 114.94 119.89 2w3s s ASN 482 Ca 0.10 0.67 0.02 0.00 0.21 0.00 0.00 52.86 53.87 2w3s s ASN 482 Cb -0.12 0.57 -0.04 0.00 -0.55 0.00 0.00 41.25 41.12 2w3s s ASN 482 CO 0.02 -0.17 0.17 -1.38 -2.79 0.00 0.00 177.10 172.95 2w3s s HIS 483 N 1.17 1.43 -0.25 0.43 -3.43 -1.26 -0.31 115.29 113.07 2w3s s HIS 483 Ca -0.08 -1.43 0.28 0.00 -0.80 0.00 0.00 55.06 53.03 2w3s s HIS 483 Cb -0.09 -0.69 1.01 0.00 -1.43 0.00 0.00 32.58 31.38 2w3s s HIS 483 CO -0.09 -0.64 1.82 0.78 -2.00 0.00 0.00 174.74 174.61 2w3s h GLY 484 N 2.40 0.00 -2.73 -1.38 0.00 -1.75 -3.43 103.07 96.17 2w3s h GLY 484 Ca -0.33 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.49 2w3s h GLY 484 CO 0.49 0.00 0.50 -0.32 0.00 0.00 0.00 176.54 177.22 2w3s s GLY 485 N -3.96 2.79 -0.09 4.60 0.00 -1.26 -4.88 107.32 104.52 2w3s s GLY 485 Ca 0.04 0.99 -0.00 0.00 0.00 0.00 0.00 44.72 45.76 2w3s s GLY 485 CO 0.54 1.46 -0.07 -0.51 0.00 0.00 0.00 173.10 174.52 2w3s s THR 486 N -1.51 3.66 -0.26 0.90 -4.23 -1.26 -4.80 115.64 108.13 2w3s s THR 486 Ca 0.65 -0.48 -0.20 0.00 -1.18 0.00 0.00 61.69 60.48 2w3s s THR 486 Cb -0.30 -2.52 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 2w3s s THR 486 CO 0.37 0.57 0.62 -0.70 -0.54 0.00 0.00 174.62 174.94 2w3s s GLU 487 N -0.48 4.07 -0.05 3.99 2.56 -1.26 -4.90 118.70 122.64 2w3s s GLU 487 Ca 0.07 0.49 0.07 0.00 0.00 0.00 0.00 54.97 55.60 2w3s s GLU 487 Cb -0.12 -3.66 0.11 0.00 2.00 0.00 0.00 34.13 32.46 2w3s s GLU 487 CO 0.02 -0.44 0.99 0.00 -0.56 0.00 0.00 175.26 175.28 2w3s n MET 488 N 5.73 0.97 0.00 4.30 0.00 -1.26 -1.08 117.12 125.78 2w3s n MET 488 Ca -0.01 -1.63 0.00 0.00 0.00 0.00 0.00 57.70 56.06 2w3s n MET 488 Cb 0.49 -0.97 0.00 0.00 0.00 0.00 0.00 33.22 32.74 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 -0.64 1.15 0.07 3.17 0.00 -1.26 -3.55 105.19 104.12 2w3s n GLY 489 Ca 0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 0.78 -1.36 1.61 0.00 -1.26 -4.87 117.38 112.09 2w3s n GLN 490 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 57.00 56.85 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 1.18 0.43 0.15 2.61 0.00 -1.26 -4.97 105.19 103.34 2w3s n GLY 491 Ca 0.18 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.26 -0.81 0.99 5.85 -1.93 -2.92 115.31 116.24 2w3s h LEU 492 Ca -0.03 -0.03 0.16 0.00 0.84 0.00 0.00 57.88 58.81 2w3s h LEU 492 Cb 0.40 0.07 -0.10 0.00 0.37 0.00 0.00 40.66 41.40 2w3s h LEU 492 CO 0.04 -0.13 0.35 0.45 -0.34 0.00 0.00 178.44 178.81 2w3s h HIS 493 N -0.36 0.60 -0.72 1.25 3.86 -1.94 0.30 115.15 118.14 2w3s h HIS 493 Ca -0.03 0.04 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2w3s h HIS 493 Cb 0.28 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 2w3s h HIS 493 CO -0.05 0.07 0.20 0.00 0.86 0.00 0.00 177.93 179.02 2w3s h ALA 494 N 1.58 0.95 -0.43 2.45 0.00 -1.89 0.76 119.26 122.68 2w3s h ALA 494 Ca 0.45 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 2w3s h ALA 494 Cb 0.71 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2w3s h ALA 494 CO -0.42 0.65 -0.13 0.87 0.00 0.00 0.00 179.25 180.23 2w3s h LYS 495 N 1.08 0.79 -0.59 0.00 1.57 -1.04 0.29 116.57 118.68 2w3s h LYS 495 Ca 0.23 -0.27 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 2w3s h LYS 495 Cb 0.34 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 2w3s h LYS 495 CO -0.00 0.88 0.01 0.52 -0.57 0.00 0.00 179.45 180.29 2w3s h MET 496 N 0.72 1.01 -0.55 3.15 2.86 -0.54 -0.70 114.93 120.88 2w3s h MET 496 Ca 0.12 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2w3s h MET 496 Cb 0.62 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 2w3s h MET 496 CO 0.04 0.99 0.32 0.28 1.06 0.00 0.00 176.91 179.60 2w3s h VAL 497 N 0.93 1.18 -0.69 -2.22 2.07 0.01 -2.34 116.25 115.18 2w3s h VAL 497 Ca 0.17 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.19 2w3s h VAL 497 Cb 0.53 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2w3s h VAL 497 CO 0.03 0.19 0.15 1.56 0.02 0.00 0.00 177.57 179.51 2w3s h GLN 498 N 0.74 1.12 0.62 1.57 4.20 0.02 -0.01 115.11 123.38 2w3s h GLN 498 Ca 0.20 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 2w3s h GLN 498 Cb 0.02 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 27.67 2w3s h GLN 498 CO -0.03 1.00 -0.30 0.28 -0.67 0.00 0.00 178.83 179.11 2w3s h VAL 499 N 1.06 0.38 -0.56 -0.54 2.07 -0.99 0.17 116.25 117.84 2w3s h VAL 499 Ca 0.22 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.73 2w3s h VAL 499 Cb 0.40 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2w3s h VAL 499 CO 0.01 0.01 0.30 0.00 0.02 0.00 0.00 177.57 177.91 2w3s h ALA 500 N -0.50 0.73 -0.41 1.67 0.00 -1.22 0.17 119.26 119.70 2w3s h ALA 500 Ca -0.09 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2w3s h ALA 500 Cb 0.65 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2w3s h ALA 500 CO 0.14 -0.02 0.22 0.00 0.00 0.00 0.00 179.25 179.59 2w3s h ALA 501 N 1.29 0.52 -0.87 0.00 0.00 -0.92 -0.89 119.26 118.39 2w3s h ALA 501 Ca 0.24 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2w3s h ALA 501 Cb 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2w3s h ALA 501 CO -0.15 -0.12 0.48 0.00 0.00 0.00 0.00 179.25 179.46 2w3s h ALA 502 N 1.20 1.21 -0.12 0.00 0.00 0.34 0.09 119.26 121.97 2w3s h ALA 502 Ca 0.17 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 2w3s h ALA 502 Cb 0.05 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.50 2w3s h ALA 502 CO -0.10 0.64 -0.75 0.28 0.00 0.00 0.00 179.25 179.32 2w3s h VAL 503 N 1.21 1.30 0.00 0.00 2.07 -0.30 -3.25 116.25 117.28 2w3s h VAL 503 Ca 0.31 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.86 2w3s h VAL 503 Cb 0.02 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2w3s h VAL 503 CO -0.05 0.62 0.00 -0.07 0.02 0.00 0.00 177.57 178.09 2w3s h LEU 504 N 0.42 0.00 -1.02 2.57 3.38 -1.09 -3.47 115.31 116.10 2w3s h LEU 504 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2w3s h LEU 504 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2w3s h LEU 504 CO 0.15 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.29 2w3s n GLY 505 N 1.01 0.94 3.19 0.83 0.00 -0.04 -4.66 105.19 106.46 2w3s n GLY 505 Ca 0.04 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 2w3s n GLY 505 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w3s s ILE 506 N -2.97 0.36 0.17 -0.61 -4.36 -0.86 -0.73 121.20 112.21 2w3s s ILE 506 Ca 0.00 -1.94 -0.30 0.00 -0.26 0.00 0.00 60.65 58.15 2w3s s ILE 506 Cb 0.00 -2.08 -0.08 0.00 1.25 0.00 0.00 42.46 41.55 2w3s s ILE 506 CO 0.00 -0.47 1.14 -0.62 0.24 0.00 0.00 174.94 175.23 2w3s s ASP 507 N -3.11 7.19 0.32 4.36 -1.08 -1.26 -4.46 116.67 118.63 2w3s s ASP 507 Ca 0.24 2.13 0.17 0.00 -0.52 0.00 0.00 52.55 54.57 2w3s s ASP 507 Cb 0.07 -2.60 1.13 0.00 -1.46 0.00 0.00 42.92 40.06 2w3s s ASP 507 CO 0.03 -0.29 1.37 -2.65 0.52 0.00 0.00 175.17 174.14 2w3s n PRO 508 N 2.52 -0.05 0.15 4.34 -0.02 -1.26 -0.27 135.00 140.40 2w3s n PRO 508 Ca 0.04 1.20 0.18 0.00 -2.02 0.00 0.00 63.50 62.90 2w3s n PRO 508 Cb 0.46 -2.14 0.78 0.00 -0.02 0.00 0.00 33.50 32.58 2w3s n PRO 508 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2w3s h VAL 509 N 0.00 0.49 0.00 -1.45 2.07 -1.97 0.48 116.25 115.87 2w3s h VAL 509 Ca 0.72 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.24 2w3s h VAL 509 Cb 1.88 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2w3s h VAL 509 CO -0.68 0.00 0.00 0.00 0.02 0.00 0.00 177.57 176.91 2w3s n GLN 510 N -3.86 0.40 -3.95 1.57 1.13 0.62 -4.71 117.38 108.58 2w3s n GLN 510 Ca 0.04 0.02 -0.35 0.00 -1.94 0.00 0.00 57.00 54.77 2w3s n GLN 510 Cb 0.44 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 29.15 2w3s n GLN 510 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2w3s s VAL 511 N -2.57 2.99 -0.12 5.09 1.01 0.17 0.00 120.40 126.97 2w3s s VAL 511 Ca 0.27 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.35 2w3s s VAL 511 Cb 0.19 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 2w3s s VAL 511 CO 0.43 0.29 0.08 -0.60 0.00 0.00 0.00 175.10 175.30 2w3s s ARG 512 N 1.37 3.40 -0.10 2.72 6.06 0.32 -4.96 118.95 127.77 2w3s s ARG 512 Ca 0.02 -0.27 -0.12 0.00 -2.50 0.00 0.00 55.73 52.86 2w3s s ARG 512 Cb -0.16 -3.06 -0.05 0.00 0.06 0.00 0.00 34.95 31.75 2w3s s ARG 512 CO -0.05 0.65 0.29 -1.50 -2.50 0.00 0.00 175.30 172.19 2w3s s ILE 513 N -0.68 5.27 0.18 4.11 1.10 -1.26 0.16 121.20 130.07 2w3s s ILE 513 Ca 0.12 0.55 0.07 0.00 -0.51 0.00 0.00 60.65 60.87 2w3s s ILE 513 Cb -0.12 -3.59 -0.04 0.00 0.15 0.00 0.00 42.46 38.86 2w3s s ILE 513 CO 0.02 0.52 0.05 0.42 -2.11 0.00 0.00 174.94 173.84 2w3s s THR 514 N -0.47 3.97 0.27 4.00 -4.23 -0.16 -4.93 115.64 114.09 2w3s s THR 514 Ca 0.18 -1.34 -0.29 0.00 -1.18 0.00 0.00 61.69 59.07 2w3s s THR 514 Cb -0.14 -3.02 -0.14 0.00 1.34 0.00 0.00 72.50 70.54 2w3s s THR 514 CO 0.07 -0.13 1.10 0.00 -0.54 0.00 0.00 174.62 175.12 2w3s n ALA 515 N -0.26 0.00 -1.76 3.99 0.00 -1.26 -4.78 120.51 116.44 2w3s n ALA 515 Ca -0.09 0.40 -0.41 0.00 0.00 0.00 0.00 53.44 53.33 2w3s n ALA 515 Cb 0.55 -2.07 -0.01 0.00 0.00 0.00 0.00 19.45 17.92 2w3s n ALA 515 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2w3s n THR 516 N 0.57 1.38 -3.40 0.00 -1.04 -0.80 -4.84 114.28 106.15 2w3s n THR 516 Ca 0.10 -0.34 0.01 0.00 -2.04 0.00 0.00 64.05 61.77 2w3s n THR 516 Cb 0.31 -1.97 -0.03 0.00 -1.82 0.00 0.00 70.33 66.82 2w3s n THR 516 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2w3s s ASP 517 N 0.27 -1.15 0.55 8.00 3.68 -1.25 -0.84 116.67 125.93 2w3s s ASP 517 Ca 0.60 1.16 0.23 0.00 2.13 0.00 0.00 52.55 56.67 2w3s s ASP 517 Cb -0.49 2.14 1.52 0.00 -1.45 0.00 0.00 42.92 44.64 2w3s s ASP 517 CO 0.54 -0.24 2.17 0.71 0.13 0.00 0.00 175.17 178.47 2w3s h THR 518 N 6.02 0.75 0.00 1.71 1.35 -1.43 0.45 112.91 121.76 2w3s h THR 518 Ca -0.20 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2w3s h THR 518 Cb 1.13 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2w3s h THR 518 CO 0.18 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.91 2w3s n SER 519 N -4.19 0.00 -0.10 5.36 3.41 -1.26 -3.75 113.62 113.09 2w3s n SER 519 Ca -0.01 0.25 -0.13 0.00 -0.26 0.00 0.00 58.87 58.71 2w3s n SER 519 Cb 0.16 -0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 63.65 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 -1.41 0.53 -3.97 4.33 5.02 0.15 -4.92 118.16 117.89 2w3s n LYS 520 Ca 0.09 0.30 -0.34 0.00 -2.02 0.00 0.00 58.31 56.33 2w3s n LYS 520 Cb 0.28 -1.51 -0.15 0.00 -0.02 0.00 0.00 35.03 33.64 2w3s n LYS 520 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2w3s s VAL 521 N -2.68 2.94 0.51 -0.18 1.01 -0.95 -4.87 120.40 116.17 2w3s s VAL 521 Ca -0.29 -0.69 0.05 0.00 0.00 0.00 0.00 61.98 61.05 2w3s s VAL 521 Cb 0.06 -2.33 0.03 0.00 0.00 0.00 0.00 36.38 34.14 2w3s s VAL 521 CO 0.42 0.43 0.70 -2.16 0.00 0.00 0.00 175.10 174.48 2w3s s PRO 522 N 1.41 2.60 -1.41 2.72 0.04 -1.25 -4.36 135.00 134.75 2w3s s PRO 522 Ca 0.05 -1.08 -0.07 0.00 0.04 0.00 0.00 61.00 59.95 2w3s s PRO 522 Cb -0.14 -2.61 0.04 0.00 0.04 0.00 0.00 34.50 31.82 2w3s s PRO 522 CO -0.06 -0.57 0.88 0.09 0.04 0.00 0.00 177.00 177.37 2w3s n ASN 523 N -2.15 -3.25 -4.88 6.66 3.02 -1.26 -4.88 115.26 108.51 2w3s n ASN 523 Ca 0.09 -0.77 -0.33 0.00 -0.03 0.00 0.00 54.58 53.55 2w3s n ASN 523 Cb 0.60 -4.12 -0.05 0.00 -0.61 0.00 0.00 39.78 35.59 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 -3.47 5.09 0.87 3.41 -4.23 -1.26 -4.99 115.64 111.06 2w3s s THR 524 Ca 0.34 0.26 -0.12 0.00 -1.18 0.00 0.00 61.69 61.00 2w3s s THR 524 Cb -0.17 -3.63 0.12 0.00 1.34 0.00 0.00 72.50 70.16 2w3s s THR 524 CO 0.81 0.08 1.10 -0.44 -0.54 0.00 0.00 174.62 175.64 2w3s s SER 525 N -2.22 3.77 0.97 3.99 0.01 -1.26 -4.61 113.70 114.35 2w3s s SER 525 Ca 0.40 1.25 -0.11 0.00 1.31 0.00 0.00 55.95 58.80 2w3s s SER 525 Cb -0.12 -1.93 0.17 0.00 0.21 0.00 0.00 66.02 64.35 2w3s s SER 525 CO 0.22 -2.42 1.10 0.00 0.41 0.00 0.00 173.24 172.55 2w3s s ALA 526 N -3.11 1.02 -0.73 1.44 0.00 -1.26 -4.88 121.76 114.24 2w3s s ALA 526 Ca 0.63 0.22 -0.20 0.00 0.00 0.00 0.00 51.96 52.61 2w3s s ALA 526 Cb -0.16 -3.32 0.10 0.00 0.00 0.00 0.00 23.12 19.74 2w3s s ALA 526 CO 0.55 -2.89 0.94 0.99 0.00 0.00 0.00 175.76 175.36 2w3s s THR 527 N -2.68 4.60 0.20 0.00 2.01 -0.45 -4.92 115.64 114.40 2w3s s THR 527 Ca 0.66 -0.94 -0.23 0.00 0.31 0.00 0.00 61.69 61.49 2w3s s THR 527 Cb -0.22 -4.66 0.06 0.00 0.01 0.00 0.00 72.50 67.69 2w3s s THR 527 CO 0.59 -1.38 0.93 0.00 -0.69 0.00 0.00 174.62 174.08 2w3s s ALA 528 N 3.21 -1.49 -1.50 7.40 0.00 -1.26 -4.94 121.76 123.18 2w3s s ALA 528 Ca 0.22 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 2w3s s ALA 528 Cb -0.15 0.70 0.02 0.00 0.00 0.00 0.00 23.12 23.68 2w3s s ALA 528 CO 0.03 -1.04 0.70 0.00 0.00 0.00 0.00 175.76 175.44 2w3s n ALA 529 N -0.53 -1.05 -3.54 0.00 0.00 -1.26 -2.41 120.51 111.72 2w3s n ALA 529 Ca -0.05 0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.42 2w3s n ALA 529 Cb 0.60 -4.05 -0.05 0.00 0.00 0.00 0.00 19.45 15.95 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 -2.59 -1.37 -0.00 0.00 7.64 -1.26 -4.12 113.62 111.92 2w3s n SER 530 Ca -0.08 -0.58 0.08 0.00 1.01 0.00 0.00 58.87 59.30 2w3s n SER 530 Cb 0.60 -1.23 -0.11 0.00 -1.01 0.00 0.00 64.21 62.45 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 -1.82 0.95 -0.01 6.43 3.41 -1.01 -4.59 113.62 116.98 2w3s n SER 531 Ca 0.07 -0.41 -0.00 0.00 -0.26 0.00 0.00 58.87 58.27 2w3s n SER 531 Cb 0.41 1.42 -0.00 0.00 -0.26 0.00 0.00 64.21 65.78 2w3s n SER 531 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2w3s h GLY 532 N 3.48 -2.23 1.62 5.00 0.00 -1.86 -0.53 103.07 108.55 2w3s h GLY 532 Ca 0.00 0.97 -0.03 0.00 0.00 0.00 0.00 47.33 48.27 2w3s h GLY 532 CO 0.00 -0.84 0.09 0.00 0.00 0.00 0.00 176.54 175.79 2w3s h ALA 533 N -1.12 1.53 0.81 3.60 0.00 -1.94 -0.20 119.26 121.94 2w3s h ALA 533 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2w3s h ALA 533 Cb 0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2w3s h ALA 533 CO -0.03 0.36 -0.49 -0.44 0.00 0.00 0.00 179.25 178.65 2w3s h ASP 534 N 0.49 -1.22 0.18 0.00 5.19 -1.68 -0.47 116.42 118.91 2w3s h ASP 534 Ca 0.12 0.07 -0.24 0.00 -0.62 0.00 0.00 57.03 56.35 2w3s h ASP 534 Cb 0.18 0.35 0.03 0.00 0.18 0.00 0.00 39.33 40.07 2w3s h ASP 534 CO -0.01 -0.75 -1.05 0.24 -3.12 0.00 0.00 179.24 174.55 2w3s h MET 535 N -1.21 0.39 -0.52 3.56 2.86 -1.07 -2.71 114.93 116.22 2w3s h MET 535 Ca -0.11 -0.66 -0.09 0.00 -2.06 0.00 0.00 59.70 56.77 2w3s h MET 535 Cb 0.97 0.25 -0.02 0.00 0.06 0.00 0.00 31.60 32.86 2w3s h MET 535 CO 0.12 1.32 -0.04 -0.91 1.06 0.00 0.00 176.91 178.45 2w3s h ASN 536 N -0.19 0.94 -0.71 1.22 2.35 -1.15 0.54 115.58 118.58 2w3s h ASN 536 Ca -0.18 -0.33 0.14 0.00 -0.55 0.00 0.00 56.30 55.38 2w3s h ASN 536 Cb 1.83 -0.25 -0.13 0.00 0.05 0.00 0.00 38.32 39.82 2w3s h ASN 536 CO 0.20 1.04 -0.22 1.23 -1.65 0.00 0.00 177.43 178.03 2w3s h GLY 537 N 0.81 0.39 0.93 2.83 0.00 -1.17 0.40 103.07 107.27 2w3s h GLY 537 Ca 0.14 0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.74 2w3s h GLY 537 CO 0.03 -0.26 0.15 -0.33 0.00 0.00 0.00 176.54 176.13 2w3s h MET 538 N -0.03 0.52 -0.64 4.80 2.86 -1.08 -2.15 114.93 119.21 2w3s h MET 538 Ca 0.33 -0.09 0.04 0.00 -2.06 0.00 0.00 59.70 57.92 2w3s h MET 538 Cb 0.54 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 2w3s h MET 538 CO -0.74 0.50 0.38 0.00 1.06 0.00 0.00 176.91 178.11 2w3s h ALA 539 N 0.99 0.85 -0.19 6.32 0.00 0.08 -0.88 119.26 126.43 2w3s h ALA 539 Ca 0.12 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2w3s h ALA 539 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2w3s h ALA 539 CO -0.01 0.09 0.02 0.28 0.00 0.00 0.00 179.25 179.64 2w3s h VAL 540 N 0.72 1.23 0.00 0.00 2.07 -0.21 -2.66 116.25 117.40 2w3s h VAL 540 Ca 0.27 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 2w3s h VAL 540 Cb 0.10 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2w3s h VAL 540 CO -0.14 0.23 -0.11 0.50 0.02 0.00 0.00 177.57 178.07 2w3s h LYS 541 N 0.10 0.00 -0.17 1.57 3.64 -1.19 -0.93 116.57 119.59 2w3s h LYS 541 Ca 0.06 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.23 2w3s h LYS 541 Cb 0.33 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2w3s h LYS 541 CO 0.00 0.11 -0.70 0.22 -2.27 0.00 0.00 179.45 176.81 2w3s h ASP 542 N 0.00 0.91 -0.21 4.20 3.58 -0.84 -0.90 116.42 123.16 2w3s h ASP 542 Ca -0.00 -0.61 -0.19 0.00 0.42 0.00 0.00 57.03 56.65 2w3s h ASP 542 Cb 0.23 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2w3s h ASP 542 CO 0.01 1.37 -0.59 0.00 -2.88 0.00 0.00 179.24 177.16 2w3s h ALA 543 N 0.56 0.36 -0.50 -0.78 0.00 -1.24 -2.26 119.26 115.40 2w3s h ALA 543 Ca -0.04 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.37 2w3s h ALA 543 Cb 1.33 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 2w3s h ALA 543 CO 0.15 0.60 0.28 0.00 0.00 0.00 0.00 179.25 180.28 2w3s h GLU 545 N 0.55 1.05 -0.09 0.00 5.08 -1.15 0.19 114.58 120.21 2w3s h GLU 545 Ca 0.21 -0.30 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2w3s h GLU 545 Cb 0.07 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2w3s h GLU 545 CO -0.12 0.99 -0.09 1.15 -1.00 0.00 0.00 179.01 179.95 2w3s h THR 546 N 0.97 0.75 -0.28 1.13 2.02 -0.77 0.33 112.91 117.06 2w3s h THR 546 Ca 0.18 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.38 2w3s h THR 546 Cb 0.49 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 2w3s h THR 546 CO 0.02 0.00 0.15 -0.07 0.37 0.00 0.00 175.52 175.99 2w3s h LEU 547 N -0.11 0.22 -0.58 2.58 3.38 -0.26 -2.25 115.31 118.29 2w3s h LEU 547 Ca 0.07 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2w3s h LEU 547 Cb 0.20 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 2w3s h LEU 547 CO -0.16 0.17 0.32 -0.09 0.09 0.00 0.00 178.44 178.77 2w3s h ARG 548 N 0.30 0.60 -0.90 1.13 2.43 -0.23 -2.06 114.38 115.65 2w3s h ARG 548 Ca 0.11 -0.04 0.14 0.00 -0.81 0.00 0.00 59.98 59.38 2w3s h ARG 548 Cb 0.02 -0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 29.35 2w3s h ARG 548 CO -0.07 0.40 0.52 0.78 -1.51 0.00 0.00 179.97 180.08 2w3s h GLY 549 N 0.62 1.48 0.96 2.80 0.00 -0.03 0.10 103.07 109.01 2w3s h GLY 549 Ca 0.25 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 2w3s h GLY 549 CO -0.15 0.04 0.19 3.21 0.00 0.00 0.00 176.54 179.83 2w3s h ARG 550 N 0.76 0.71 -0.28 4.80 3.08 -0.79 -1.88 114.38 120.78 2w3s h ARG 550 Ca 0.48 -0.13 -0.15 0.00 0.07 0.00 0.00 59.98 60.25 2w3s h ARG 550 Cb 0.59 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2w3s h ARG 550 CO -0.32 0.64 -0.43 -0.07 -1.07 0.00 0.00 179.97 178.72 2w3s h LEU 551 N 0.63 0.75 -0.16 3.04 3.38 -0.85 -2.30 115.31 119.79 2w3s h LEU 551 Ca 0.16 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2w3s h LEU 551 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2w3s h LEU 551 CO -0.01 1.08 0.05 0.00 0.09 0.00 0.00 178.44 179.64 2w3s h ALA 552 N 0.95 0.22 0.00 1.53 0.00 -0.76 -1.05 119.26 120.15 2w3s h ALA 552 Ca 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2w3s h ALA 552 Cb 0.97 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2w3s h ALA 552 CO 0.09 -0.16 -0.23 0.78 0.00 0.00 0.00 179.25 179.73 2w3s h GLY 553 N 0.09 0.00 0.27 0.00 0.00 -1.26 0.29 103.07 102.46 2w3s h GLY 553 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2w3s h GLY 553 CO -0.00 0.00 -0.04 -2.75 0.00 0.00 0.00 176.54 173.75 2w3s h PHE 554 N 0.00 0.04 -0.13 5.60 3.57 -1.24 -3.06 116.94 121.72 2w3s h PHE 554 Ca -0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2w3s h PHE 554 Cb 0.43 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 2w3s h PHE 554 CO 0.00 0.78 0.09 0.28 -2.23 0.00 0.00 178.31 177.23 2w3s h VAL 555 N -0.72 1.03 -0.44 1.41 2.07 -0.76 -2.28 116.25 116.57 2w3s h VAL 555 Ca -0.00 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.53 2w3s h VAL 555 Cb 0.79 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 2w3s h VAL 555 CO 0.01 0.03 0.05 0.00 0.02 0.00 0.00 177.57 177.68 2w3s h ALA 556 N 1.05 0.46 0.00 1.67 0.00 -0.55 0.38 119.26 122.26 2w3s h ALA 556 Ca 0.05 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2w3s h ALA 556 Cb -0.02 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2w3s h ALA 556 CO -0.01 -0.35 -0.27 0.00 0.00 0.00 0.00 179.25 178.62 2w3s h ALA 557 N 1.36 1.29 0.18 0.00 0.00 -1.41 0.36 119.26 121.05 2w3s h ALA 557 Ca 0.22 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 2w3s h ALA 557 Cb 0.30 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.06 2w3s h ALA 557 CO -0.32 0.33 -1.41 -0.09 0.00 0.00 0.00 179.25 177.76 2w3s h ARG 558 N 0.00 0.39 -0.38 0.00 2.43 -0.47 -3.33 114.38 113.01 2w3s h ARG 558 Ca -0.00 -0.66 0.00 0.00 -0.81 0.00 0.00 59.98 58.51 2w3s h ARG 558 Cb 0.57 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2w3s h ARG 558 CO 0.03 1.32 0.00 0.39 -1.51 0.00 0.00 179.97 180.20 2w3s n GLU 559 N -3.81 2.13 -2.70 0.20 -0.58 0.12 -5.00 120.64 111.00 2w3s n GLU 559 Ca -0.20 -1.74 -0.02 0.00 -0.42 0.00 0.00 57.16 54.78 2w3s n GLU 559 Cb 0.99 -1.43 -0.02 0.00 -0.57 0.00 0.00 31.44 30.42 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 1.31 -4.51 0.00 0.62 0.00 0.11 -4.83 105.19 97.89 2w3s n GLY 560 Ca 0.17 1.02 0.00 0.00 0.00 0.00 0.00 46.02 47.22 2w3s n GLY 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w3s s ALA 562 N -1.00 3.50 0.32 0.00 0.00 -1.26 -4.36 121.76 118.95 2w3s s ALA 562 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 2w3s s ALA 562 Cb 0.00 -2.79 0.51 0.00 0.00 0.00 0.00 23.12 20.84 2w3s s ALA 562 CO 0.00 0.25 1.98 0.00 0.00 0.00 0.00 175.76 178.00 2w3s h ALA 563 N 5.01 1.45 0.00 0.00 0.00 -1.94 0.31 119.26 124.10 2w3s h ALA 563 Ca -0.47 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2w3s h ALA 563 Cb 1.21 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2w3s h ALA 563 CO 0.67 0.51 0.00 2.89 0.00 0.00 0.00 179.25 183.32 2w3s n ARG 564 N -4.42 0.06 0.00 0.00 1.85 -1.26 -0.88 116.66 112.02 2w3s n ARG 564 Ca 0.08 0.41 0.13 0.00 -1.00 0.00 0.00 57.85 57.47 2w3s n ARG 564 Cb 0.03 -1.64 0.27 0.00 -1.05 0.00 0.00 32.46 30.07 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 -1.76 1.48 -4.71 2.89 8.00 0.10 -4.86 116.55 117.69 2w3s n ASP 565 Ca 0.01 -1.21 -0.40 0.00 0.71 0.00 0.00 54.79 53.91 2w3s n ASP 565 Cb 0.11 0.21 -0.05 0.00 -0.02 0.00 0.00 41.12 41.37 2w3s n ASP 565 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2w3s s VAL 566 N -2.40 5.02 -0.14 2.53 1.01 -0.06 -4.73 120.40 121.64 2w3s s VAL 566 Ca 0.25 1.46 -0.02 0.00 0.00 0.00 0.00 61.98 63.66 2w3s s VAL 566 Cb 0.19 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2w3s s VAL 566 CO 0.50 0.22 -0.06 -0.63 0.00 0.00 0.00 175.10 175.12 2w3s s ILE 567 N 1.03 3.72 -0.27 2.22 1.01 0.30 -4.94 121.20 124.27 2w3s s ILE 567 Ca 0.37 -0.43 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 2w3s s ILE 567 Cb -0.18 -2.60 0.04 0.00 0.01 0.00 0.00 42.46 39.73 2w3s s ILE 567 CO 0.17 0.52 -0.04 -0.36 0.00 0.00 0.00 174.94 175.23 2w3s s PHE 568 N 0.15 3.17 -0.21 3.97 0.40 -1.26 0.70 117.98 124.89 2w3s s PHE 568 Ca -0.03 -1.75 -0.26 0.00 -0.60 0.00 0.00 56.93 54.30 2w3s s PHE 568 Cb -0.14 -2.07 0.07 0.00 0.51 0.00 0.00 43.02 41.39 2w3s s PHE 568 CO 0.03 -0.77 0.70 0.34 0.70 0.00 0.00 175.22 176.22 2w3s s ASP 569 N 1.28 -0.72 -1.63 1.36 -1.08 -0.24 -4.43 116.67 111.21 2w3s s ASP 569 Ca -0.03 1.26 -0.16 0.00 -0.52 0.00 0.00 52.55 53.10 2w3s s ASP 569 Cb -0.18 1.23 0.13 0.00 -1.46 0.00 0.00 42.92 42.63 2w3s s ASP 569 CO -0.03 -0.33 0.82 0.00 0.52 0.00 0.00 175.17 176.14 2w3s n ALA 570 N 2.26 -1.33 -1.04 3.66 0.00 -1.09 -0.50 120.51 122.48 2w3s n ALA 570 Ca -0.15 0.03 -0.01 0.00 0.00 0.00 0.00 53.44 53.30 2w3s n ALA 570 Cb 0.56 -3.62 -0.01 0.00 0.00 0.00 0.00 19.45 16.38 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 -1.52 0.34 3.48 0.00 0.00 0.10 -4.94 105.19 102.64 2w3s n GLY 571 Ca 0.04 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 2w3s n GLY 571 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3s s GLN 572 N -1.34 1.74 -0.01 1.61 -1.52 0.34 -2.30 119.66 118.18 2w3s s GLN 572 Ca 0.00 -1.35 0.06 0.00 -1.95 0.00 0.00 55.36 52.12 2w3s s GLN 572 Cb 0.00 -2.01 -0.03 0.00 -0.22 0.00 0.00 33.01 30.75 2w3s s GLN 572 CO 0.00 0.43 -0.19 0.08 -0.25 0.00 0.00 175.29 175.37 2w3s s VAL 573 N -1.51 2.71 -0.05 1.09 1.01 0.78 -1.08 120.40 123.34 2w3s s VAL 573 Ca 0.21 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.22 2w3s s VAL 573 Cb -0.09 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.25 2w3s s VAL 573 CO 0.11 0.51 -0.05 -1.10 0.00 0.00 0.00 175.10 174.57 2w3s s GLN 574 N -0.93 0.87 -0.14 2.72 -0.21 0.22 -0.82 119.66 121.37 2w3s s GLN 574 Ca 0.12 -0.11 -0.13 0.00 0.02 0.00 0.00 55.36 55.27 2w3s s GLN 574 Cb -0.10 -0.90 0.04 0.00 1.00 0.00 0.00 33.01 33.04 2w3s s GLN 574 CO 0.02 -0.10 0.37 0.00 -2.12 0.00 0.00 175.29 173.46 2w3s s ALA 575 N 1.02 -0.92 -1.45 6.09 0.00 -0.72 -0.54 121.76 125.25 2w3s s ALA 575 Ca -0.09 1.07 -0.07 0.00 0.00 0.00 0.00 51.96 52.86 2w3s s ALA 575 Cb -0.14 -0.62 0.04 0.00 0.00 0.00 0.00 23.12 22.39 2w3s s ALA 575 CO -0.00 -0.18 0.63 0.43 0.00 0.00 0.00 175.76 176.63 2w3s n SER 576 N 2.96 -5.18 0.00 0.00 7.64 -1.26 -1.10 113.62 116.69 2w3s n SER 576 Ca -0.14 -0.37 0.00 0.00 1.01 0.00 0.00 58.87 59.37 2w3s n SER 576 Cb 0.57 -4.20 0.00 0.00 -1.01 0.00 0.00 64.21 59.57 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 -1.44 1.77 3.91 0.23 0.00 -1.26 -5.00 105.19 103.40 2w3s n GLY 577 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.07 3.59 0.01 1.61 1.02 -0.25 -5.12 119.74 120.53 2w3s s LYS 578 Ca 0.00 -0.13 0.01 0.00 0.02 0.00 0.00 55.97 55.87 2w3s s LYS 578 Cb 0.00 -2.75 -0.01 0.00 -0.52 0.00 0.00 37.83 34.55 2w3s s LYS 578 CO 0.00 0.32 -0.05 -1.54 -0.92 0.00 0.00 175.35 173.16 2w3s s SER 579 N -3.05 0.52 0.27 2.83 1.04 -1.26 -1.75 113.70 112.29 2w3s s SER 579 Ca 0.42 -0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.64 2w3s s SER 579 Cb -0.11 -0.01 -0.06 0.00 0.10 0.00 0.00 66.02 65.95 2w3s s SER 579 CO 0.29 -0.06 0.02 0.26 0.98 0.00 0.00 173.24 174.73 2w3s s TRP 580 N -0.58 1.75 0.39 5.02 0.51 -0.00 -4.97 118.94 121.06 2w3s s TRP 580 Ca -0.04 -0.93 -0.24 0.00 -2.12 0.00 0.00 56.10 52.78 2w3s s TRP 580 Cb -0.05 -1.06 -0.09 0.00 -0.81 0.00 0.00 33.47 31.46 2w3s s TRP 580 CO -0.00 -0.01 1.01 1.03 -0.51 0.00 0.00 176.95 178.47 2w3s s ARG 581 N -3.87 4.23 0.29 4.98 0.52 -1.26 -0.16 118.95 123.68 2w3s s ARG 581 Ca 0.32 1.40 0.03 0.00 -0.52 0.00 0.00 55.73 56.97 2w3s s ARG 581 Cb 0.07 -2.51 0.73 0.00 0.52 0.00 0.00 34.95 33.76 2w3s s ARG 581 CO 0.12 -0.06 1.68 0.35 0.02 0.00 0.00 175.30 177.41 2w3s h PHE 582 N 2.48 0.55 0.42 -0.53 3.57 -1.76 -1.59 116.94 120.09 2w3s h PHE 582 Ca -0.48 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.05 2w3s h PHE 582 Cb 1.21 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 2w3s h PHE 582 CO 0.59 -0.11 -0.37 0.00 -2.23 0.00 0.00 178.31 176.20 2w3s h ALA 583 N 1.73 -0.83 -0.93 2.41 0.00 -1.89 -1.80 119.26 117.95 2w3s h ALA 583 Ca 0.56 -0.14 0.21 0.00 0.00 0.00 0.00 54.91 55.53 2w3s h ALA 583 Cb 1.09 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 19.28 2w3s h ALA 583 CO -0.57 -1.00 0.49 0.93 0.00 0.00 0.00 179.25 179.11 2w3s h GLU 584 N -0.80 0.55 -0.38 0.00 5.08 -1.68 0.20 114.58 117.54 2w3s h GLU 584 Ca -0.04 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2w3s h GLU 584 Cb 0.70 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2w3s h GLU 584 CO -0.03 0.36 0.13 0.82 -1.00 0.00 0.00 179.01 179.29 2w3s h ILE 585 N 0.56 1.21 -0.47 3.13 1.08 -1.11 -2.08 117.51 119.83 2w3s h ILE 585 Ca 0.56 -0.66 -0.03 0.00 -0.39 0.00 0.00 64.86 64.34 2w3s h ILE 585 Cb 0.99 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.64 2w3s h ILE 585 CO -0.45 0.23 0.18 0.58 -0.69 0.00 0.00 178.15 178.00 2w3s h VAL 586 N 0.47 1.21 -0.41 1.67 2.07 0.14 0.12 116.25 121.52 2w3s h VAL 586 Ca 0.13 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2w3s h VAL 586 Cb 0.23 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 2w3s h VAL 586 CO -0.01 0.24 0.15 0.00 0.02 0.00 0.00 177.57 177.98 2w3s h ALA 587 N 1.03 1.50 -0.19 1.67 0.00 -0.89 0.39 119.26 122.76 2w3s h ALA 587 Ca 0.16 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2w3s h ALA 587 Cb 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2w3s h ALA 587 CO -0.01 0.38 -0.08 0.00 0.00 0.00 0.00 179.25 179.55 2w3s h ALA 588 N 1.59 0.27 0.00 0.00 0.00 -0.61 -1.01 119.26 119.50 2w3s h ALA 588 Ca 0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2w3s h ALA 588 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2w3s h ALA 588 CO -0.01 0.08 -0.20 0.00 0.00 0.00 0.00 179.25 179.11 2w3s h ALA 589 N 0.71 1.16 0.27 0.00 0.00 -0.25 -0.62 119.26 120.51 2w3s h ALA 589 Ca 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2w3s h ALA 589 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2w3s h ALA 589 CO 0.02 0.25 -0.13 -0.92 0.00 0.00 0.00 179.25 178.48 2w3s h TYR 590 N 0.00 -0.33 -0.61 0.00 3.20 0.13 -1.13 116.97 118.24 2w3s h TYR 590 Ca -0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2w3s h TYR 590 Cb 0.57 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 2w3s h TYR 590 CO 0.00 -0.08 0.37 0.52 -1.64 0.00 0.00 178.16 177.33 2w3s h MET 591 N -0.54 0.81 0.00 1.82 2.86 -1.02 -1.55 114.93 117.31 2w3s h MET 591 Ca -0.04 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2w3s h MET 591 Cb 0.40 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.89 2w3s h MET 591 CO 0.06 0.57 0.00 0.00 1.06 0.00 0.00 176.91 178.60 2w3s n ALA 592 N -2.44 2.49 -2.62 6.32 0.00 -0.26 -4.92 120.51 119.08 2w3s n ALA 592 Ca 0.06 -0.16 -0.09 0.00 0.00 0.00 0.00 53.44 53.25 2w3s n ALA 592 Cb 0.07 -1.45 0.04 0.00 0.00 0.00 0.00 19.45 18.11 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 -1.06 -2.24 -4.13 0.00 1.74 -0.58 -5.04 116.66 105.34 2w3s n ARG 593 Ca 0.19 0.49 -0.34 0.00 -0.77 0.00 0.00 57.85 57.42 2w3s n ARG 593 Cb 0.12 -4.15 -0.15 0.00 -1.02 0.00 0.00 32.46 27.26 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 -3.22 2.74 0.08 0.55 1.01 -0.48 -5.06 121.20 116.83 2w3s s ILE 594 Ca 0.16 -0.72 -0.32 0.00 0.00 0.00 0.00 60.65 59.78 2w3s s ILE 594 Cb -0.02 -2.20 -0.11 0.00 0.01 0.00 0.00 42.46 40.14 2w3s s ILE 594 CO 0.42 0.49 1.84 -0.24 0.00 0.00 0.00 174.94 177.45 2w3s n SER 595 N 4.55 3.88 -1.95 3.58 2.88 -1.26 -4.60 113.62 120.70 2w3s n SER 595 Ca -0.19 0.98 -0.21 0.00 -1.33 0.00 0.00 58.87 58.12 2w3s n SER 595 Cb 0.51 -1.50 0.16 0.00 -0.75 0.00 0.00 64.21 62.62 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 5.88 6.12 -4.17 2.46 4.77 -1.26 -4.92 117.00 125.89 2w3s n LEU 596 Ca 0.19 -3.86 -0.23 0.00 -0.03 0.00 0.00 56.01 52.08 2w3s n LEU 596 Cb 0.36 -0.78 -0.14 0.00 -2.33 0.00 0.00 43.42 40.52 2w3s n LEU 596 CO 0.67 1.25 -0.49 -0.55 -1.33 0.00 0.00 177.39 176.95 2w3s s SER 597 N -1.87 1.96 -0.15 -1.43 0.15 -1.26 -0.51 113.70 110.58 2w3s s SER 597 Ca 0.55 -0.40 -0.12 0.00 0.70 0.00 0.00 55.95 56.68 2w3s s SER 597 Cb 0.46 -0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.64 2w3s s SER 597 CO 0.05 0.14 0.38 0.00 1.20 0.00 0.00 173.24 175.01 2w3s s ALA 598 N -0.63 -0.94 0.43 5.45 0.00 -0.51 -4.99 121.76 120.57 2w3s s ALA 598 Ca 0.05 1.17 -0.06 0.00 0.00 0.00 0.00 51.96 53.11 2w3s s ALA 598 Cb -0.07 -0.69 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 2w3s s ALA 598 CO 0.01 -0.20 0.74 0.95 0.00 0.00 0.00 175.76 177.26 2w3s s THR 599 N 0.52 4.90 0.02 0.00 -4.23 -1.26 -1.01 115.64 114.58 2w3s s THR 599 Ca -0.03 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 2w3s s THR 599 Cb -0.04 -3.82 -0.02 0.00 1.34 0.00 0.00 72.50 69.96 2w3s s THR 599 CO -0.03 -0.69 -0.04 -0.83 -0.54 0.00 0.00 174.62 172.50 2w3s s GLY 600 N -3.75 0.27 -0.04 3.99 0.00 0.37 -4.24 107.32 103.92 2w3s s GLY 600 Ca 0.48 -0.56 -0.11 0.00 0.00 0.00 0.00 44.72 44.53 2w3s s GLY 600 CO 0.39 -0.62 0.25 -0.12 0.00 0.00 0.00 173.10 173.00 2w3s s PHE 601 N -1.27 -0.16 -0.08 1.90 5.36 -1.25 0.12 117.98 122.59 2w3s s PHE 601 Ca -0.13 0.33 -0.06 0.00 -0.96 0.00 0.00 56.93 56.11 2w3s s PHE 601 Cb -0.09 0.06 0.03 0.00 -0.34 0.00 0.00 43.02 42.68 2w3s s PHE 601 CO -0.01 -0.27 0.19 -0.47 -1.46 0.00 0.00 175.22 173.21 2w3s s TYR 602 N -0.78 -0.22 -0.10 10.12 5.04 0.10 -4.60 117.35 126.90 2w3s s TYR 602 Ca -0.09 0.55 0.03 0.00 -2.44 0.00 0.00 57.07 55.12 2w3s s TYR 602 Cb -0.05 0.04 0.01 0.00 0.35 0.00 0.00 41.96 42.31 2w3s s TYR 602 CO 0.02 -0.14 -0.18 0.00 -1.34 0.00 0.00 175.55 173.91 2w3s s ALA 603 N 0.52 1.84 0.10 3.97 0.00 -1.26 0.18 121.76 127.11 2w3s s ALA 603 Ca -0.03 -0.79 -0.31 0.00 0.00 0.00 0.00 51.96 50.82 2w3s s ALA 603 Cb -0.05 -0.79 -0.08 0.00 0.00 0.00 0.00 23.12 22.20 2w3s s ALA 603 CO -0.03 0.09 1.43 0.99 0.00 0.00 0.00 175.76 178.25 2w3s s THR 604 N 0.68 3.26 0.77 0.00 2.01 -0.13 -5.00 115.64 117.22 2w3s s THR 604 Ca -0.12 0.87 -0.11 0.00 0.31 0.00 0.00 61.69 62.63 2w3s s THR 604 Cb -0.16 -3.56 0.06 0.00 0.01 0.00 0.00 72.50 68.85 2w3s s THR 604 CO 0.03 0.05 1.14 -2.16 -0.69 0.00 0.00 174.62 172.99 2w3s s PRO 605 N 1.39 2.27 0.00 4.92 0.04 -1.26 -4.49 135.00 137.86 2w3s s PRO 605 Ca 0.66 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.88 2w3s s PRO 605 Cb -0.37 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2w3s s PRO 605 CO 0.30 -1.39 0.00 1.63 0.04 0.00 0.00 177.00 177.58 2w3s n LYS 606 N -3.18 -0.20 -3.32 4.56 5.02 -1.26 -4.88 118.16 114.89 2w3s n LYS 606 Ca 0.08 0.05 -0.38 0.00 -2.02 0.00 0.00 58.31 56.03 2w3s n LYS 606 Cb 0.60 -3.38 -0.06 0.00 -0.02 0.00 0.00 35.03 32.17 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 4.22 -0.29 -0.35 1.43 -1.26 -4.87 118.68 117.56 2w3s s LEU 607 Ca 0.00 0.70 -0.15 0.00 -1.03 0.00 0.00 54.13 53.66 2w3s s LEU 607 Cb 0.00 -2.65 0.12 0.00 0.03 0.00 0.00 46.19 43.69 2w3s s LEU 607 CO 0.00 -0.06 0.82 -0.55 0.23 0.00 0.00 176.35 176.79 2w3s s SER 608 N 0.83 -0.78 0.00 2.29 0.15 0.22 -5.03 113.70 111.39 2w3s s SER 608 Ca 0.24 1.19 -0.28 0.00 0.70 0.00 0.00 55.95 57.80 2w3s s SER 608 Cb -0.15 1.50 0.09 0.00 -1.71 0.00 0.00 66.02 65.75 2w3s s SER 608 CO 0.09 -0.18 0.77 -1.66 1.20 0.00 0.00 173.24 173.46 2w3s s TRP 609 N 1.83 -0.49 -0.36 3.44 1.48 -1.26 0.17 118.94 123.75 2w3s s TRP 609 Ca -0.08 0.56 -0.11 0.00 -1.06 0.00 0.00 56.10 55.41 2w3s s TRP 609 Cb -0.06 0.50 0.02 0.00 -1.16 0.00 0.00 33.47 32.77 2w3s s TRP 609 CO -0.18 -0.62 0.20 0.34 -4.06 0.00 0.00 176.95 172.63 2w3s s ASP 610 N -1.98 5.70 0.10 -2.66 3.68 0.42 -4.96 116.67 116.98 2w3s s ASP 610 Ca -0.02 -0.88 -0.24 0.00 2.13 0.00 0.00 52.55 53.55 2w3s s ASP 610 Cb -0.01 -2.02 -0.11 0.00 -1.45 0.00 0.00 42.92 39.33 2w3s s ASP 610 CO -0.03 -0.34 1.70 -0.09 0.13 0.00 0.00 175.17 176.53 2w3s h ARG 611 N 8.42 -0.18 -0.04 4.34 2.43 -1.96 -0.43 114.38 126.96 2w3s h ARG 611 Ca -0.27 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.91 2w3s h ARG 611 Cb 1.11 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2w3s h ARG 611 CO 0.66 -0.12 0.01 -0.07 -1.51 0.00 0.00 179.97 178.93 2w3s h LEU 612 N -0.19 0.06 0.00 3.80 3.38 -1.95 -3.14 115.31 117.27 2w3s h LEU 612 Ca 0.02 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2w3s h LEU 612 Cb 0.21 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2w3s h LEU 612 CO -0.07 0.30 0.00 0.54 0.09 0.00 0.00 178.44 179.30 2w3s n ARG 613 N -4.93 0.16 -1.88 1.13 1.74 -1.22 -4.90 116.66 106.76 2w3s n ARG 613 Ca -0.07 0.03 -0.14 0.00 -0.77 0.00 0.00 57.85 56.89 2w3s n ARG 613 Cb 0.15 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.06 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 1.21 0.55 3.27 -0.13 0.00 -0.20 -4.91 105.19 104.99 2w3s n GLY 614 Ca 0.09 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 2w3s n GLY 614 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w3s s GLN 615 N -4.03 1.54 0.00 1.61 -1.52 -1.06 -4.16 119.66 112.04 2w3s s GLN 615 Ca 0.00 -0.95 0.00 0.00 -1.95 0.00 0.00 55.36 52.46 2w3s s GLN 615 Cb 0.00 -1.64 0.00 0.00 -0.22 0.00 0.00 33.01 31.15 2w3s s GLN 615 CO 0.00 0.43 0.00 0.41 -0.25 0.00 0.00 175.29 175.88 2w3s n GLY 616 N 1.95 0.68 2.99 3.09 0.00 -0.72 0.16 105.19 113.34 2w3s n GLY 616 Ca -0.17 -1.77 -0.32 0.00 0.00 0.00 0.00 46.02 43.77 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 2.10 0.20 1.61 3.52 0.44 -3.35 118.95 121.48 2w3s s ARG 617 Ca 0.00 -2.58 0.24 0.00 -0.13 0.00 0.00 55.73 53.26 2w3s s ARG 617 Cb 0.00 -3.42 0.29 0.00 -1.56 0.00 0.00 34.95 30.27 2w3s s ARG 617 CO 0.00 -1.12 1.33 -1.00 -0.81 0.00 0.00 175.30 173.70 2w3s h PRO 618 N 6.66 0.00 -6.42 5.12 0.13 -1.92 0.65 132.00 136.22 2w3s h PRO 618 Ca -0.06 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.41 2w3s h PRO 618 Cb 0.91 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.90 2w3s h PRO 618 CO 0.69 0.00 -0.70 -0.06 -0.23 0.00 0.00 178.00 177.70 2w3s s PHE 619 N -3.22 2.88 0.00 1.56 2.99 -1.26 -4.75 117.98 116.18 2w3s s PHE 619 Ca 0.05 -0.08 -0.17 0.00 0.00 0.00 0.00 56.93 56.73 2w3s s PHE 619 Cb 0.11 -1.51 -0.34 0.00 0.00 0.00 0.00 43.02 41.28 2w3s s PHE 619 CO 0.72 0.45 0.93 1.25 -0.00 0.00 0.00 175.22 178.57 2w3s h LEU 620 N 3.65 0.74 -7.97 -0.37 5.85 -1.77 -3.47 115.31 111.97 2w3s h LEU 620 Ca -0.48 -0.93 0.03 0.00 0.84 0.00 0.00 57.88 57.35 2w3s h LEU 620 Cb 1.17 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 2w3s h LEU 620 CO 0.56 1.66 0.32 -0.72 -0.34 0.00 0.00 178.44 179.92 2w3s s TYR 621 N -2.56 0.04 0.14 1.25 -0.85 -1.26 -4.96 117.35 109.15 2w3s s TYR 621 Ca -0.11 -0.62 0.09 0.00 -0.52 0.00 0.00 57.07 55.92 2w3s s TYR 621 Cb 0.03 0.79 -0.04 0.00 0.38 0.00 0.00 41.96 43.12 2w3s s TYR 621 CO 0.91 -1.38 -0.17 -0.06 -1.52 0.00 0.00 175.55 173.33 2w3s s PHE 622 N -2.66 2.51 -0.13 -3.49 0.40 -1.26 -1.11 117.98 112.25 2w3s s PHE 622 Ca 0.15 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.21 2w3s s PHE 622 Cb -0.05 -1.30 -0.01 0.00 0.51 0.00 0.00 43.02 42.17 2w3s s PHE 622 CO 0.09 0.43 -0.14 0.00 0.70 0.00 0.00 175.22 176.31 2w3s s ALA 623 N -1.35 2.59 0.36 5.36 0.00 0.11 -4.90 121.76 123.93 2w3s s ALA 623 Ca 0.20 -0.89 0.09 0.00 0.00 0.00 0.00 51.96 51.35 2w3s s ALA 623 Cb -0.10 -1.19 -0.06 0.00 0.00 0.00 0.00 23.12 21.77 2w3s s ALA 623 CO 0.11 0.25 -0.03 0.71 0.00 0.00 0.00 175.76 176.80 2w3s s TYR 624 N 0.35 2.47 0.00 0.00 1.51 -1.26 -0.45 117.35 119.97 2w3s s TYR 624 Ca -0.11 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 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 0.06 0.51 0.00 0.41 -1.11 0.00 0.00 175.55 175.42 2w3s n GLY 625 N -0.89 -0.67 3.38 0.71 0.00 -1.02 -1.80 105.19 104.90 2w3s n GLY 625 Ca -0.05 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.27 0.12 4.61 0.00 0.12 -0.86 121.76 122.48 2w3s s ALA 626 Ca 0.00 0.86 0.04 0.00 0.00 0.00 0.00 51.96 52.86 2w3s s ALA 626 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 2w3s s ALA 626 CO 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 175.76 175.34 2w3s s ALA 627 N -1.16 1.28 -0.32 0.00 0.00 -0.98 -1.32 121.76 119.26 2w3s s ALA 627 Ca -0.12 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.55 2w3s s ALA 627 Cb -0.03 0.01 0.10 0.00 0.00 0.00 0.00 23.12 23.21 2w3s s ALA 627 CO 0.07 -0.02 0.11 0.42 0.00 0.00 0.00 175.76 176.34 2w3s s ILE 628 N -2.60 0.86 -0.02 0.00 1.01 -0.79 -1.26 121.20 118.40 2w3s s ILE 628 Ca 0.09 -1.48 -0.15 0.00 0.00 0.00 0.00 60.65 59.11 2w3s s ILE 628 Cb -0.02 -1.65 -0.06 0.00 0.01 0.00 0.00 42.46 40.75 2w3s s ILE 628 CO 0.01 -0.71 0.41 -0.89 0.00 0.00 0.00 174.94 173.76 2w3s s THR 629 N 1.52 5.05 -0.07 2.92 2.01 -0.61 -2.02 115.64 124.44 2w3s s THR 629 Ca 0.11 0.84 0.05 0.00 0.31 0.00 0.00 61.69 63.00 2w3s s THR 629 Cb -0.18 -3.72 -0.01 0.00 0.01 0.00 0.00 72.50 68.60 2w3s s THR 629 CO -0.23 0.55 -0.22 -0.70 -0.69 0.00 0.00 174.62 173.33 2w3s s GLU 630 N -0.85 2.67 0.27 4.92 2.12 0.12 -1.62 118.70 126.33 2w3s s GLU 630 Ca 0.24 -0.84 0.02 0.00 0.36 0.00 0.00 54.97 54.74 2w3s s GLU 630 Cb -0.16 -2.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.92 2w3s s GLU 630 CO 0.13 0.39 0.12 0.14 -0.54 0.00 0.00 175.26 175.50 2w3s s VAL 631 N -0.16 0.43 0.01 3.70 -7.23 -0.56 0.67 120.40 117.26 2w3s s VAL 631 Ca -0.03 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.16 2w3s s VAL 631 Cb -0.14 -2.58 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 2w3s s VAL 631 CO 0.04 0.00 -0.05 0.68 -0.31 0.00 0.00 175.10 175.46 2w3s s VAL 632 N -3.72 0.35 0.04 1.32 -7.23 -0.52 -2.68 120.40 107.97 2w3s s VAL 632 Ca 0.37 -0.52 0.07 0.00 -1.81 0.00 0.00 61.98 60.09 2w3s s VAL 632 Cb 0.07 -0.37 -0.02 0.00 0.56 0.00 0.00 36.38 36.62 2w3s s VAL 632 CO 0.15 -0.12 -0.21 0.27 -0.31 0.00 0.00 175.10 174.88 2w3s s ILE 633 N -0.63 1.69 -0.37 -0.62 -4.36 0.68 -2.00 121.20 115.60 2w3s s ILE 633 Ca -0.04 -1.19 -0.21 0.00 -0.26 0.00 0.00 60.65 58.95 2w3s s ILE 633 Cb -0.05 -1.47 0.01 0.00 1.25 0.00 0.00 42.46 42.20 2w3s s ILE 633 CO -0.00 0.23 0.66 -0.62 0.24 0.00 0.00 174.94 175.45 2w3s s ASP 634 N -1.14 6.43 0.37 4.36 3.68 0.17 -1.71 116.67 128.84 2w3s s ASP 634 Ca 0.08 0.13 0.28 0.00 2.13 0.00 0.00 52.55 55.16 2w3s s ASP 634 Cb -0.09 -2.34 1.17 0.00 -1.45 0.00 0.00 42.92 40.22 2w3s s ASP 634 CO 0.02 -0.63 1.82 0.03 0.13 0.00 0.00 175.17 176.54 2w3s h ARG 635 N 8.51 0.00 0.12 4.34 3.08 -0.37 0.15 114.38 130.22 2w3s h ARG 635 Ca -0.26 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.53 2w3s h ARG 635 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 2w3s h ARG 635 CO 0.85 0.00 -1.30 -0.07 -1.07 0.00 0.00 179.97 178.38 2w3s h LEU 636 N 0.00 0.41 0.00 3.04 3.38 -1.93 -3.44 115.31 116.77 2w3s h LEU 636 Ca 0.00 -0.87 -0.16 0.00 0.09 0.00 0.00 57.88 56.94 2w3s h LEU 636 Cb 0.38 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2w3s h LEU 636 CO 0.00 1.58 -1.60 0.35 0.09 0.00 0.00 178.44 178.86 2w3s n THR 637 N -3.95 0.60 0.00 0.22 -2.24 -1.15 -5.03 114.28 102.73 2w3s n THR 637 Ca -0.23 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2w3s n THR 637 Cb 0.89 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 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 2.47 0.33 3.62 3.38 0.00 0.53 -4.38 105.19 111.15 2w3s n GLY 638 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2w3s n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2w3s n GLU 639 N -1.74 0.82 -3.51 1.61 1.02 -1.26 -4.23 120.64 113.35 2w3s n GLU 639 Ca 0.00 0.33 -0.09 0.00 -0.02 0.00 0.00 57.16 57.38 2w3s n GLU 639 Cb 0.00 -2.19 -0.02 0.00 -0.02 0.00 0.00 31.44 29.20 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 -1.34 -0.36 -0.02 1.62 2.20 -1.26 -0.66 114.94 115.13 2w3s s ASN 640 Ca 0.77 0.04 -0.04 0.00 -0.94 0.00 0.00 52.86 52.69 2w3s s ASN 640 Cb -0.40 0.37 0.00 0.00 -2.00 0.00 0.00 41.25 39.22 2w3s s ASN 640 CO 0.46 -0.58 0.09 -0.60 -2.94 0.00 0.00 177.10 173.53 2w3s s ARG 641 N -2.90 0.25 0.05 3.55 3.52 -0.85 -4.99 118.95 117.59 2w3s s ARG 641 Ca 0.04 -0.13 -0.27 0.00 -0.13 0.00 0.00 55.73 55.24 2w3s s ARG 641 Cb -0.01 0.11 -0.05 0.00 -1.56 0.00 0.00 34.95 33.44 2w3s s ARG 641 CO -0.08 -0.05 0.85 0.42 -0.81 0.00 0.00 175.30 175.63 2w3s s ILE 642 N -0.60 4.70 -0.21 4.11 1.01 -1.26 -1.43 121.20 127.52 2w3s s ILE 642 Ca -0.07 1.80 0.04 0.00 0.00 0.00 0.00 60.65 62.43 2w3s s ILE 642 Cb -0.04 -4.20 -0.16 0.00 0.01 0.00 0.00 42.46 38.07 2w3s s ILE 642 CO 0.00 0.32 -0.15 0.18 0.00 0.00 0.00 174.94 175.29 2w3s n LEU 643 N 3.01 2.47 -3.77 2.97 4.77 0.21 -3.79 117.00 122.88 2w3s n LEU 643 Ca 0.00 -0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 2w3s n LEU 643 Cb 0.50 -0.57 -0.10 0.00 -2.33 0.00 0.00 43.42 40.92 2w3s n LEU 643 CO 0.49 0.80 0.00 -0.60 -1.33 0.00 0.00 177.39 176.75 2w3s s ARG 644 N -2.44 0.53 0.01 3.23 3.52 -1.02 -1.19 118.95 121.58 2w3s s ARG 644 Ca -0.26 0.09 0.02 0.00 -0.13 0.00 0.00 55.73 55.45 2w3s s ARG 644 Cb 0.07 0.24 -0.01 0.00 -1.56 0.00 0.00 34.95 33.70 2w3s s ARG 644 CO 0.55 -0.12 -0.06 0.99 -0.81 0.00 0.00 175.30 175.85 2w3s s THR 645 N -0.65 0.41 -0.21 4.11 2.01 0.67 0.11 115.64 122.11 2w3s s THR 645 Ca -0.07 -0.42 -0.03 0.00 0.31 0.00 0.00 61.69 61.48 2w3s s THR 645 Cb -0.04 -0.39 0.07 0.00 0.01 0.00 0.00 72.50 72.14 2w3s s THR 645 CO 0.02 -0.02 0.04 -1.81 -0.69 0.00 0.00 174.62 172.17 2w3s s ASP 646 N -0.48 3.07 -0.14 3.53 1.01 -0.86 -1.17 116.67 121.63 2w3s s ASP 646 Ca -0.01 -0.93 -0.03 0.00 0.71 0.00 0.00 52.55 52.29 2w3s s ASP 646 Cb -0.04 -0.63 -0.03 0.00 1.01 0.00 0.00 42.92 43.23 2w3s s ASP 646 CO -0.00 -0.32 -0.03 -0.63 0.21 0.00 0.00 175.17 174.40 2w3s s ILE 647 N 1.83 3.95 -0.16 0.77 1.01 0.25 -1.88 121.20 126.97 2w3s s ILE 647 Ca 0.00 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.32 2w3s s ILE 647 Cb -0.17 -2.71 0.01 0.00 0.01 0.00 0.00 42.46 39.60 2w3s s ILE 647 CO -0.10 0.52 -0.21 -0.22 0.00 0.00 0.00 174.94 174.92 2w3s s LEU 648 N 0.09 2.09 0.02 2.97 2.96 -0.44 -0.58 118.68 125.79 2w3s s LEU 648 Ca -0.00 -0.61 0.01 0.00 -0.22 0.00 0.00 54.13 53.31 2w3s s LEU 648 Cb -0.13 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.10 2w3s s LEU 648 CO 0.03 0.04 -0.05 -2.28 -1.32 0.00 0.00 176.35 172.77 2w3s s HIS 649 N 1.03 0.44 -0.49 5.38 5.65 -0.59 -0.70 115.29 126.00 2w3s s HIS 649 Ca -0.02 -0.27 -0.17 0.00 0.25 0.00 0.00 55.06 54.85 2w3s s HIS 649 Cb -0.14 -0.27 0.07 0.00 -1.18 0.00 0.00 32.58 31.05 2w3s s HIS 649 CO -0.07 -0.06 0.52 0.34 -0.65 0.00 0.00 174.74 174.82 2w3s s ASP 650 N -0.77 6.19 -0.14 9.88 2.15 -0.75 0.17 116.67 133.39 2w3s s ASP 650 Ca -0.05 -1.13 0.15 0.00 0.43 0.00 0.00 52.55 51.95 2w3s s ASP 650 Cb -0.05 -2.24 0.69 0.00 -0.30 0.00 0.00 42.92 41.02 2w3s s ASP 650 CO -0.00 -0.78 1.58 0.00 -0.17 0.00 0.00 175.17 175.80 2w3s n ALA 651 N 5.71 3.31 -0.95 3.66 0.00 -1.21 -4.44 120.51 126.60 2w3s n ALA 651 Ca -0.09 -1.55 0.00 0.00 0.00 0.00 0.00 53.44 51.80 2w3s n ALA 651 Cb 0.44 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 0.89 0.90 3.56 0.00 0.00 -1.26 -1.32 105.19 107.97 2w3s n GLY 652 Ca 0.24 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.95 1.65 0.10 4.61 0.00 -0.09 -3.65 121.76 122.43 2w3s s ALA 653 Ca 0.00 -1.44 -0.36 0.00 0.00 0.00 0.00 51.96 50.16 2w3s s ALA 653 Cb 0.00 -4.55 -0.17 0.00 0.00 0.00 0.00 23.12 18.40 2w3s s ALA 653 CO 0.00 -4.81 1.17 0.45 0.00 0.00 0.00 175.76 172.57 2w3s n SER 654 N 14.08 0.97 0.13 0.00 2.88 -1.20 -3.33 113.62 127.15 2w3s n SER 654 Ca 0.40 1.14 -0.01 0.00 -1.33 0.00 0.00 58.87 59.06 2w3s n SER 654 Cb 0.47 -1.12 0.11 0.00 -0.75 0.00 0.00 64.21 62.93 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 3.60 0.00 -6.32 2.46 3.38 -1.92 -3.37 115.31 113.14 2w3s h LEU 655 Ca -0.46 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.34 2w3s h LEU 655 Cb 1.37 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.84 2w3s h LEU 655 CO 0.71 0.67 -0.51 0.21 0.09 0.00 0.00 178.44 179.61 2w3s s ASN 656 N -6.72 0.24 0.28 -0.43 3.84 -1.26 -0.97 114.94 109.92 2w3s s ASN 656 Ca -0.00 -0.21 -0.01 0.00 0.21 0.00 0.00 52.86 52.85 2w3s s ASN 656 Cb 0.11 1.17 0.39 0.00 -0.55 0.00 0.00 41.25 42.37 2w3s s ASN 656 CO 0.76 -0.34 1.80 -0.65 -2.79 0.00 0.00 177.10 175.88 2w3s h PRO 657 N 8.15 0.77 0.79 0.43 0.11 -1.80 0.45 132.00 140.90 2w3s h PRO 657 Ca -0.11 -0.18 -0.04 0.00 0.11 0.00 0.00 66.00 65.78 2w3s h PRO 657 Cb 1.13 -0.10 0.01 0.00 0.11 0.00 0.00 31.00 32.15 2w3s h PRO 657 CO 0.26 0.75 -0.38 0.00 -0.21 0.00 0.00 178.00 178.42 2w3s h ALA 658 N 1.32 -1.06 -0.99 -0.75 0.00 -1.87 -0.58 119.26 115.33 2w3s h ALA 658 Ca 0.15 -0.23 0.20 0.00 0.00 0.00 0.00 54.91 55.02 2w3s h ALA 658 Cb 0.38 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 18.48 2w3s h ALA 658 CO 0.01 -0.99 0.61 -0.07 0.00 0.00 0.00 179.25 178.82 2w3s h LEU 659 N -1.26 0.71 -0.16 0.00 3.38 -1.78 -0.16 115.31 116.04 2w3s h LEU 659 Ca -0.11 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2w3s h LEU 659 Cb 0.82 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2w3s h LEU 659 CO 0.18 0.24 -0.02 0.44 0.09 0.00 0.00 178.44 179.37 2w3s h ASP 660 N 0.69 0.29 -0.82 -0.43 3.32 -0.01 -0.93 116.42 118.53 2w3s h ASP 660 Ca 0.57 -0.34 0.10 0.00 0.02 0.00 0.00 57.03 57.37 2w3s h ASP 660 Cb 0.99 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.39 2w3s h ASP 660 CO -0.35 0.57 0.47 0.40 -1.72 0.00 0.00 179.24 178.60 2w3s h ILE 661 N 0.01 0.90 -0.34 0.35 1.08 -0.49 -1.22 117.51 117.80 2w3s h ILE 661 Ca 0.04 -0.27 0.06 0.00 -0.39 0.00 0.00 64.86 64.30 2w3s h ILE 661 Cb 0.43 0.05 -0.05 0.00 -3.07 0.00 0.00 36.82 34.18 2w3s h ILE 661 CO 0.01 0.14 0.02 1.23 -0.69 0.00 0.00 178.15 178.86 2w3s h GLY 662 N 0.78 0.35 0.93 5.37 0.00 -0.75 0.00 103.07 109.76 2w3s h GLY 662 Ca 0.40 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.75 2w3s h GLY 662 CO -0.25 -0.07 0.11 1.46 0.00 0.00 0.00 176.54 177.79 2w3s h GLN 663 N 0.12 0.29 -0.13 4.80 1.08 -0.21 -1.22 115.11 119.84 2w3s h GLN 663 Ca 0.16 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.35 2w3s h GLN 663 Cb 0.22 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.57 2w3s h GLN 663 CO -0.26 0.29 -0.04 0.82 -0.95 0.00 0.00 178.83 178.68 2w3s h ILE 664 N 0.21 0.85 -0.54 2.54 2.04 -1.02 0.64 117.51 122.24 2w3s h ILE 664 Ca 0.07 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.95 2w3s h ILE 664 Cb 0.09 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2w3s h ILE 664 CO -0.01 0.00 0.33 -0.33 0.00 0.00 0.00 178.15 178.14 2w3s h GLU 665 N -0.01 0.64 -0.48 2.37 5.08 -0.86 0.30 114.58 121.62 2w3s h GLU 665 Ca 0.06 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 2w3s h GLU 665 Cb 0.11 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2w3s h GLU 665 CO -0.14 0.42 0.00 0.78 -1.00 0.00 0.00 179.01 179.08 2w3s h GLY 666 N 0.66 0.92 0.90 -3.84 0.00 -0.87 -2.81 103.07 98.02 2w3s h GLY 666 Ca 0.22 -0.68 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2w3s h GLY 666 CO -0.09 0.62 -0.05 0.00 0.00 0.00 0.00 176.54 177.02 2w3s h ALA 667 N 0.93 0.42 -0.15 3.60 0.00 0.63 -2.67 119.26 122.02 2w3s h ALA 667 Ca 0.14 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2w3s h ALA 667 Cb 0.51 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2w3s h ALA 667 CO 0.02 0.23 0.05 -0.92 0.00 0.00 0.00 179.25 178.64 2w3s h TYR 668 N 0.36 0.09 -0.23 0.00 3.20 -0.97 -0.02 116.97 119.40 2w3s h TYR 668 Ca 0.08 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 2w3s h TYR 668 Cb 0.53 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2w3s h TYR 668 CO 0.05 0.04 -0.01 0.28 -1.64 0.00 0.00 178.16 176.88 2w3s h VAL 669 N 0.12 1.15 -0.00 1.81 2.07 -1.44 0.64 116.25 120.60 2w3s h VAL 669 Ca 0.07 -0.61 -0.24 0.00 0.82 0.00 0.00 66.70 66.74 2w3s h VAL 669 Cb 0.04 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2w3s h VAL 669 CO -0.07 0.20 -0.96 -0.61 0.02 0.00 0.00 177.57 176.15 2w3s h GLN 670 N 0.34 0.50 0.40 1.57 4.15 -1.09 -0.75 115.11 120.22 2w3s h GLN 670 Ca 0.08 -0.53 -0.02 0.00 0.77 0.00 0.00 58.65 58.95 2w3s h GLN 670 Cb 0.25 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.09 2w3s h GLN 670 CO 0.01 1.17 -0.19 0.78 -1.93 0.00 0.00 178.83 178.66 2w3s h GLY 671 N 1.01 -0.57 0.15 2.39 0.00 -0.31 -1.13 103.07 104.60 2w3s h GLY 671 Ca -0.09 0.21 0.14 0.00 0.00 0.00 0.00 47.33 47.59 2w3s h GLY 671 CO 0.17 -0.21 0.27 0.00 0.00 0.00 0.00 176.54 176.78 2w3s h ALA 672 N -0.37 1.01 -0.91 3.60 0.00 -0.99 -1.69 119.26 119.90 2w3s h ALA 672 Ca -0.06 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2w3s h ALA 672 Cb 0.54 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 2w3s h ALA 672 CO 0.09 -0.23 0.57 0.78 0.00 0.00 0.00 179.25 180.46 2w3s h GLY 673 N 0.41 1.39 1.87 0.00 0.00 -0.99 -1.44 103.07 104.30 2w3s h GLY 673 Ca 0.40 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.32 2w3s h GLY 673 CO -0.41 0.27 0.08 -0.25 0.00 0.00 0.00 176.54 176.24 2w3s h TRP 674 N 1.03 0.12 -0.60 5.60 7.01 -0.26 -2.75 115.95 126.10 2w3s h TRP 674 Ca 0.40 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.40 2w3s h TRP 674 Cb 0.20 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 2w3s h TRP 674 CO -0.02 0.08 0.00 1.28 -2.79 0.00 0.00 178.44 176.98 2w3s n LEU 675 N -4.52 4.78 0.00 0.65 4.77 -0.56 -4.55 117.00 117.57 2w3s n LEU 675 Ca -0.01 -2.54 0.00 0.00 -0.03 0.00 0.00 56.01 53.43 2w3s n LEU 675 Cb 0.10 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2w3s n LEU 675 CO 0.34 0.78 0.00 0.35 -1.33 0.00 0.00 177.39 177.53 2w3s n THR 676 N 0.92 0.00 1.43 -5.08 -2.24 -1.07 -0.70 114.28 107.54 2w3s n THR 676 Ca 0.25 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.18 2w3s n THR 676 Cb 0.92 0.00 0.67 0.00 -2.10 0.00 0.00 70.33 69.82 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 0.00 0.00 -3.04 4.28 -2.24 -1.23 -2.82 114.28 109.24 2w3s n THR 677 Ca 0.00 -0.04 -0.43 0.00 -2.27 0.00 0.00 64.05 61.32 2w3s n THR 677 Cb 0.00 -0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 67.92 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 -2.50 3.50 -0.03 -0.78 2.02 -1.06 -4.42 118.70 115.43 2w3s s GLU 678 Ca 0.29 -0.06 -0.01 0.00 0.02 0.00 0.00 54.97 55.21 2w3s s GLU 678 Cb 0.20 -3.89 0.03 0.00 0.10 0.00 0.00 34.13 30.58 2w3s s GLU 678 CO 0.47 -0.94 0.04 -2.00 0.02 0.00 0.00 175.26 172.85 2w3s s GLU 679 N 2.99 -0.02 -0.01 1.61 2.12 -1.26 -4.66 118.70 119.47 2w3s s GLU 679 Ca 0.27 0.27 -0.16 0.00 0.36 0.00 0.00 54.97 55.71 2w3s s GLU 679 Cb -0.13 -0.41 -0.06 0.00 0.26 0.00 0.00 34.13 33.79 2w3s s GLU 679 CO 0.19 -0.25 0.44 -0.51 -0.54 0.00 0.00 175.26 174.59 2w3s s LEU 680 N 1.61 4.45 -0.07 2.70 1.43 -1.26 -4.87 118.68 122.67 2w3s s LEU 680 Ca -0.02 0.97 -0.03 0.00 -1.03 0.00 0.00 54.13 54.03 2w3s s LEU 680 Cb -0.13 -2.64 0.04 0.00 0.03 0.00 0.00 46.19 43.49 2w3s s LEU 680 CO -0.03 0.26 0.10 -0.69 0.23 0.00 0.00 176.35 176.22 2w3s s VAL 681 N -0.78 -0.17 0.12 -1.59 1.01 -1.26 -4.92 120.40 112.81 2w3s s VAL 681 Ca 0.25 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.62 2w3s s VAL 681 Cb -0.17 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 2w3s s VAL 681 CO 0.13 0.13 0.12 0.26 0.00 0.00 0.00 175.10 175.75 2w3s s TRP 682 N 2.21 3.21 0.55 5.22 0.51 -1.26 0.62 118.94 130.00 2w3s s TRP 682 Ca 0.04 0.05 -0.07 0.00 -2.12 0.00 0.00 56.10 54.00 2w3s s TRP 682 Cb -0.12 -1.58 0.12 0.00 -0.81 0.00 0.00 33.47 31.07 2w3s s TRP 682 CO -0.05 0.52 0.74 -0.40 -0.51 0.00 0.00 176.95 177.26 2w3s n ASP 683 N 0.05 0.29 0.09 2.95 5.68 0.31 -4.89 116.55 121.04 2w3s n ASP 683 Ca -0.08 -1.41 0.13 0.00 -0.50 0.00 0.00 54.79 52.92 2w3s n ASP 683 Cb 0.53 -0.55 0.45 0.00 -1.14 0.00 0.00 41.12 40.42 2w3s n ASP 683 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2w3s n HIS 684 N -2.86 0.71 0.37 2.11 1.44 -1.26 -2.19 115.22 113.53 2w3s n HIS 684 Ca 0.10 0.23 0.10 0.00 -2.01 0.00 0.00 57.72 56.13 2w3s n HIS 684 Cb 0.35 -0.87 0.26 0.00 0.12 0.00 0.00 29.99 29.85 2w3s n HIS 684 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2w3s n GLY 686 N 1.37 0.61 3.70 0.00 0.00 -0.93 -4.30 105.19 105.64 2w3s n GLY 686 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.22 4.45 -0.07 1.61 0.52 -1.26 -4.45 118.95 119.53 2w3s s ARG 687 Ca 0.00 1.28 -0.30 0.00 -0.52 0.00 0.00 55.73 56.20 2w3s s ARG 687 Cb 0.00 -3.51 -0.05 0.00 0.52 0.00 0.00 34.95 31.91 2w3s s ARG 687 CO 0.00 -0.18 1.69 -1.17 0.02 0.00 0.00 175.30 175.66 2w3s s LEU 688 N 1.55 4.25 0.04 2.53 2.96 -1.26 -0.53 118.68 128.21 2w3s s LEU 688 Ca 0.47 2.18 0.19 0.00 -0.22 0.00 0.00 54.13 56.74 2w3s s LEU 688 Cb -0.19 -3.53 -0.16 0.00 0.50 0.00 0.00 46.19 42.81 2w3s s LEU 688 CO 0.20 -1.02 0.71 0.23 -1.32 0.00 0.00 176.35 175.16 2w3s n MET 689 N 7.29 0.63 -3.34 1.98 2.81 0.20 -4.54 117.12 122.15 2w3s n MET 689 Ca 0.18 0.11 -0.46 0.00 -1.81 0.00 0.00 57.70 55.72 2w3s n MET 689 Cb 0.43 -1.73 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 2w3s n MET 689 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2w3s s THR 690 N -3.03 5.68 -0.03 2.03 -4.23 -1.19 -4.81 115.64 110.06 2w3s s THR 690 Ca -0.04 -2.71 0.05 0.00 -1.18 0.00 0.00 61.69 57.81 2w3s s THR 690 Cb 0.09 -4.48 0.09 0.00 1.34 0.00 0.00 72.50 69.54 2w3s s THR 690 CO 0.83 -1.06 1.04 0.00 -0.54 0.00 0.00 174.62 174.88 2w3s n HIS 691 N 3.65 0.00 -3.91 3.99 1.44 -1.26 -4.79 115.22 114.34 2w3s n HIS 691 Ca 0.16 -0.24 -0.08 0.00 -2.01 0.00 0.00 57.72 55.55 2w3s n HIS 691 Cb 0.45 -0.08 -0.03 0.00 0.12 0.00 0.00 29.99 30.45 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 -0.56 -0.81 0.43 1.59 0.00 -1.26 -4.15 121.76 117.00 2w3s s ALA 692 Ca 0.09 -0.53 0.13 0.00 0.00 0.00 0.00 51.96 51.65 2w3s s ALA 692 Cb 0.08 0.94 0.93 0.00 0.00 0.00 0.00 23.12 25.08 2w3s s ALA 692 CO -0.01 -0.95 1.97 -1.35 0.00 0.00 0.00 175.76 175.42 2w3s h PRO 693 N 2.11 0.06 -0.05 0.00 0.11 -1.98 0.22 132.00 132.48 2w3s h PRO 693 Ca -0.22 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.77 2w3s h PRO 693 Cb 1.25 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2w3s h PRO 693 CO 0.29 0.24 -0.47 0.66 -0.21 0.00 0.00 178.00 178.51 2w3s h SER 694 N 0.06 0.12 0.04 -2.05 4.64 -2.02 -3.30 113.55 111.03 2w3s h SER 694 Ca 0.01 -0.05 -0.30 0.00 -0.47 0.00 0.00 61.79 60.98 2w3s h SER 694 Cb 0.35 -0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 62.35 2w3s h SER 694 CO 0.02 0.57 -2.27 0.35 -0.87 0.00 0.00 176.83 174.64 2w3s n THR 695 N -3.98 1.15 -4.14 2.95 -2.24 -1.10 -4.89 114.28 102.03 2w3s n THR 695 Ca -0.02 -0.79 -0.35 0.00 -2.27 0.00 0.00 64.05 60.63 2w3s n THR 695 Cb 0.50 -0.41 -0.12 0.00 -2.10 0.00 0.00 70.33 68.21 2w3s n THR 695 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2w3s s TYR 696 N -2.69 3.09 -0.41 4.78 5.04 0.75 -4.87 117.35 123.04 2w3s s TYR 696 Ca -0.09 -0.26 0.04 0.00 -2.44 0.00 0.00 57.07 54.32 2w3s s TYR 696 Cb 0.08 -2.05 0.11 0.00 0.35 0.00 0.00 41.96 40.44 2w3s s TYR 696 CO 0.84 -0.08 0.14 0.15 -1.34 0.00 0.00 175.55 175.27 2w3s s LYS 697 N 0.67 1.61 0.42 4.97 3.01 -1.26 -4.42 119.74 124.74 2w3s s LYS 697 Ca 0.00 -2.12 -0.05 0.00 -1.01 0.00 0.00 55.97 52.79 2w3s s LYS 697 Cb -0.14 -3.13 -0.04 0.00 -1.01 0.00 0.00 37.83 33.51 2w3s s LYS 697 CO 0.02 -1.02 0.72 0.96 0.51 0.00 0.00 175.35 176.54 2w3s s ILE 698 N 0.47 4.93 -0.27 2.17 -4.36 -1.26 -3.67 121.20 119.20 2w3s s ILE 698 Ca 0.14 0.17 -0.39 0.00 -0.26 0.00 0.00 60.65 60.30 2w3s s ILE 698 Cb -0.22 -3.82 -0.15 0.00 1.25 0.00 0.00 42.46 39.52 2w3s s ILE 698 CO -0.06 -0.67 1.81 -2.65 0.24 0.00 0.00 174.94 173.61 2w3s n PRO 699 N -1.82 1.23 -2.10 0.37 -0.02 -1.26 -4.96 135.00 126.45 2w3s n PRO 699 Ca -0.00 0.44 -0.27 0.00 -2.02 0.00 0.00 63.50 61.65 2w3s n PRO 699 Cb 0.55 -2.18 0.07 0.00 -0.02 0.00 0.00 33.50 31.92 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 4.00 2.99 0.15 3.55 0.00 -1.26 -4.92 121.76 126.27 2w3s s ALA 700 Ca 0.99 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 51.92 2w3s s ALA 700 Cb -1.02 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 19.30 2w3s s ALA 700 CO 0.63 -1.32 1.55 0.35 0.00 0.00 0.00 175.76 176.97 2w3s h PHE 701 N -0.68 -1.59 0.00 0.00 3.57 -2.01 0.34 116.94 116.56 2w3s h PHE 701 Ca -0.45 0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2w3s h PHE 701 Cb 1.30 0.78 0.00 0.00 2.79 0.00 0.00 35.95 40.82 2w3s h PHE 701 CO 0.37 -0.44 0.00 -1.13 -2.23 0.00 0.00 178.31 174.88 2w3s n SER 702 N -5.36 0.00 0.15 0.41 3.41 -1.26 -1.80 113.62 109.17 2w3s n SER 702 Ca 0.00 -1.50 0.12 0.00 -0.26 0.00 0.00 58.87 57.24 2w3s n SER 702 Cb 0.33 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.53 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 -2.46 4.04 3.32 -0.67 -3.47 116.42 117.17 2w3s h ASP 703 Ca 0.00 -0.02 -0.61 0.00 0.02 0.00 0.00 57.03 56.43 2w3s h ASP 703 Cb 0.00 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.66 2w3s h ASP 703 CO 0.00 0.01 0.09 -2.11 -1.72 0.00 0.00 179.24 175.51 2w3s n ARG 704 N -2.67 1.28 -1.68 3.56 1.85 -0.75 -4.78 116.66 113.47 2w3s n ARG 704 Ca 0.04 0.45 -0.52 0.00 -1.00 0.00 0.00 57.85 56.83 2w3s n ARG 704 Cb 0.49 -1.82 -0.06 0.00 -1.05 0.00 0.00 32.46 30.02 2w3s n ARG 704 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2w3s n PRO 705 N 0.68 1.73 -0.29 2.89 -0.02 -1.26 -4.83 135.00 133.89 2w3s n PRO 705 Ca 0.10 0.63 0.23 0.00 -2.02 0.00 0.00 63.50 62.44 2w3s n PRO 705 Cb 0.33 -2.40 0.55 0.00 -0.02 0.00 0.00 33.50 31.95 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 7.75 0.33 -5.16 -0.52 2.47 -1.57 -3.25 114.38 114.42 2w3s h ARG 706 Ca -0.47 -0.02 -0.67 0.00 -1.26 0.00 0.00 59.98 57.55 2w3s h ARG 706 Cb 1.29 -0.07 -0.34 0.00 -1.65 0.00 0.00 29.97 29.20 2w3s h ARG 706 CO 0.93 0.22 -0.87 0.42 0.56 0.00 0.00 179.97 181.23 2w3s s ILE 707 N -5.39 2.05 -0.40 2.04 1.01 -0.34 -5.00 121.20 115.18 2w3s s ILE 707 Ca -0.08 -0.97 0.03 0.00 0.00 0.00 0.00 60.65 59.64 2w3s s ILE 707 Cb 0.24 -1.82 0.11 0.00 0.01 0.00 0.00 42.46 41.00 2w3s s ILE 707 CO 0.79 0.55 0.14 0.12 0.00 0.00 0.00 174.94 176.54 2w3s s PHE 708 N 0.92 3.05 -0.28 3.97 5.99 -1.23 -0.23 117.98 130.17 2w3s s PHE 708 Ca -0.04 -2.79 -0.06 0.00 0.00 0.00 0.00 56.93 54.04 2w3s s PHE 708 Cb -0.15 -2.58 0.01 0.00 0.00 0.00 0.00 43.02 40.30 2w3s s PHE 708 CO -0.04 -0.86 0.05 -0.80 -0.00 0.00 0.00 175.22 173.57 2w3s s ASN 709 N 0.60 4.93 -0.08 6.13 0.01 -0.32 -5.02 114.94 121.19 2w3s s ASN 709 Ca 0.13 -0.67 0.05 0.00 -0.71 0.00 0.00 52.86 51.66 2w3s s ASN 709 Cb -0.21 -1.84 -0.00 0.00 0.41 0.00 0.00 41.25 39.61 2w3s s ASN 709 CO -0.07 -0.16 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.44 2w3s s VAL 710 N 1.48 1.96 -0.02 1.60 1.01 -1.26 0.87 120.40 126.04 2w3s s VAL 710 Ca 0.03 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2w3s s VAL 710 Cb -0.17 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.54 2w3s s VAL 710 CO 0.01 0.54 0.06 0.00 0.00 0.00 0.00 175.10 175.70 2w3s s ALA 711 N 0.16 -0.13 -0.15 5.51 0.00 0.25 -4.96 121.76 122.44 2w3s s ALA 711 Ca -0.12 0.08 -0.22 0.00 0.00 0.00 0.00 51.96 51.70 2w3s s ALA 711 Cb -0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 2w3s s ALA 711 CO 0.06 -0.05 0.66 -0.51 0.00 0.00 0.00 175.76 175.92 2w3s s LEU 712 N -0.19 4.21 -0.16 0.00 1.43 -1.26 -1.54 118.68 121.16 2w3s s LEU 712 Ca -0.02 0.97 -0.29 0.00 -1.03 0.00 0.00 54.13 53.76 2w3s s LEU 712 Cb -0.02 -2.97 -0.05 0.00 0.03 0.00 0.00 46.19 43.19 2w3s s LEU 712 CO 0.00 -0.22 1.92 0.86 0.23 0.00 0.00 176.35 179.14 2w3s s TRP 713 N 1.52 1.55 -0.39 0.29 -0.11 0.44 -4.83 118.94 117.42 2w3s s TRP 713 Ca 0.32 0.29 -0.05 0.00 1.22 0.00 0.00 56.10 57.89 2w3s s TRP 713 Cb -0.16 -4.04 0.09 0.00 -1.50 0.00 0.00 33.47 27.85 2w3s s TRP 713 CO 0.13 -4.00 0.17 0.34 -4.62 0.00 0.00 176.95 168.97 2w3s s ASP 714 N 5.80 5.30 -0.27 5.86 2.15 -1.26 -3.30 116.67 130.95 2w3s s ASP 714 Ca 0.86 -1.68 -0.15 0.00 0.43 0.00 0.00 52.55 52.01 2w3s s ASP 714 Cb -0.32 -1.85 0.09 0.00 -0.30 0.00 0.00 42.92 40.53 2w3s s ASP 714 CO 0.35 -0.48 0.66 -1.58 -0.17 0.00 0.00 175.17 173.95 2w3s s GLN 715 N 1.26 0.67 0.72 4.34 0.74 -1.24 -4.98 119.66 121.17 2w3s s GLN 715 Ca 0.03 1.23 -0.15 0.00 0.05 0.00 0.00 55.36 56.53 2w3s s GLN 715 Cb -0.22 0.23 0.04 0.00 1.10 0.00 0.00 33.01 34.15 2w3s s GLN 715 CO -0.01 -0.16 1.17 -2.14 -0.55 0.00 0.00 175.29 173.60 2w3s s PRO 716 N 1.81 2.25 0.34 1.67 0.02 -1.26 -3.19 135.00 136.64 2w3s s PRO 716 Ca -0.09 1.62 -0.27 0.00 0.02 0.00 0.00 61.00 62.28 2w3s s PRO 716 Cb -0.06 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 2w3s s PRO 716 CO -0.19 -1.72 1.13 1.21 -0.33 0.00 0.00 177.00 177.10 2w3s s ASN 717 N -2.27 6.94 0.19 2.53 3.84 -0.68 -4.80 114.94 120.69 2w3s s ASN 717 Ca 0.71 2.29 -0.08 0.00 0.21 0.00 0.00 52.86 55.99 2w3s s ASN 717 Cb -0.26 -2.62 0.10 0.00 -0.55 0.00 0.00 41.25 37.92 2w3s s ASN 717 CO 0.45 -0.38 1.66 0.03 -2.79 0.00 0.00 177.10 176.07 2w3s h ARG 718 N 3.23 1.06 -7.08 0.43 3.08 -1.93 -3.45 114.38 109.72 2w3s h ARG 718 Ca -0.48 -0.33 -0.48 0.00 0.07 0.00 0.00 59.98 58.76 2w3s h ARG 718 Cb 1.22 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 31.18 2w3s h ARG 718 CO 0.65 1.03 0.29 -1.21 -1.07 0.00 0.00 179.97 179.66 2w3s s GLU 719 N -5.03 3.90 -1.44 0.04 0.41 -1.26 -4.96 118.70 110.35 2w3s s GLU 719 Ca -0.12 0.80 -0.13 0.00 -0.41 0.00 0.00 54.97 55.11 2w3s s GLU 719 Cb 0.14 -2.22 0.05 0.00 -1.78 0.00 0.00 34.13 30.32 2w3s s GLU 719 CO 0.85 -0.19 2.20 0.39 -0.49 0.00 0.00 175.26 178.03 2w3s n GLU 720 N -1.47 2.94 -2.40 1.61 1.02 -1.26 -4.80 120.64 116.28 2w3s n GLU 720 Ca 0.05 -2.69 -0.24 0.00 -0.02 0.00 0.00 57.16 54.27 2w3s n GLU 720 Cb 0.54 -3.25 0.06 0.00 -0.02 0.00 0.00 31.44 28.77 2w3s n GLU 720 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2w3s s THR 721 N 2.89 2.43 -0.33 2.62 -4.23 -1.26 -4.98 115.64 112.78 2w3s s THR 721 Ca 0.47 -0.45 -0.33 0.00 -1.18 0.00 0.00 61.69 60.19 2w3s s THR 721 Cb 0.14 -2.97 -0.10 0.00 1.34 0.00 0.00 72.50 70.90 2w3s s THR 721 CO -0.08 0.00 2.21 0.00 -0.54 0.00 0.00 174.62 176.21 2w3s n ILE 722 N -2.69 0.22 -4.20 2.99 0.13 -1.26 -1.25 119.36 113.29 2w3s n ILE 722 Ca 0.09 -0.32 -0.36 0.00 -1.10 0.00 0.00 62.75 61.05 2w3s n ILE 722 Cb 0.60 -1.89 -0.04 0.00 -0.84 0.00 0.00 39.64 37.46 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 10.50 -1.56 -2.40 9.51 3.01 -1.26 -2.17 117.46 133.09 2w3s n PHE 723 Ca 0.39 0.70 -0.17 0.00 1.01 0.00 0.00 57.45 59.38 2w3s n PHE 723 Cb 0.29 -2.49 -0.01 0.00 -0.01 0.00 0.00 39.48 37.27 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 -4.14 -1.95 -1.77 -1.08 5.12 -0.38 -4.68 116.66 107.77 2w3s n ARG 724 Ca 0.08 0.81 -0.22 0.00 -1.93 0.00 0.00 57.85 56.59 2w3s n ARG 724 Cb 0.48 -5.43 0.14 0.00 -1.16 0.00 0.00 32.46 26.48 2w3s n ARG 724 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2w3s n SER 725 N -1.89 0.45 -3.83 0.55 3.41 -0.92 -0.92 113.62 110.48 2w3s n SER 725 Ca -0.20 -1.58 -0.12 0.00 -0.26 0.00 0.00 58.87 56.71 2w3s n SER 725 Cb 0.65 -0.71 -0.13 0.00 -0.26 0.00 0.00 64.21 63.76 2w3s n SER 725 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2w3s s LYS 726 N -5.06 0.13 0.12 4.33 1.02 -0.44 -4.67 119.74 115.17 2w3s s LYS 726 Ca 0.58 0.17 -0.35 0.00 0.02 0.00 0.00 55.97 56.39 2w3s s LYS 726 Cb -0.02 0.05 -0.16 0.00 -0.52 0.00 0.00 37.83 37.18 2w3s s LYS 726 CO 0.40 -0.02 1.34 0.00 -0.92 0.00 0.00 175.35 176.15 2w3s n ALA 727 N 3.09 -0.49 -0.12 5.17 0.00 -1.26 -4.59 120.51 122.31 2w3s n ALA 727 Ca -0.13 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2w3s n ALA 727 Cb 0.59 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2w3s n ALA 727 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2w3s n VAL 728 N 2.42 0.84 0.13 0.00 3.14 -1.26 -4.81 118.33 118.79 2w3s n VAL 728 Ca 0.17 -0.86 -0.14 0.00 -2.96 0.00 0.00 64.34 60.55 2w3s n VAL 728 Cb 0.22 0.59 -0.08 0.00 -1.06 0.00 0.00 33.84 33.51 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 -0.32 0.00 7.55 0.00 -1.90 -3.41 103.07 105.00 2w3s h GLY 729 Ca 0.00 0.12 -0.29 0.00 0.00 0.00 0.00 47.33 47.15 2w3s h GLY 729 CO 0.00 -0.12 -2.00 1.18 0.00 0.00 0.00 176.54 175.60 2w3s n GLU 730 N -5.15 0.39 -0.19 4.80 1.02 -1.26 -4.74 120.64 115.51 2w3s n GLU 730 Ca -0.09 0.15 0.01 0.00 -0.02 0.00 0.00 57.16 57.21 2w3s n GLU 730 Cb 0.20 -1.19 0.04 0.00 -0.02 0.00 0.00 31.44 30.47 2w3s n GLU 730 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2w3s n PRO 731 N -3.62 -0.09 0.05 3.49 -0.02 -1.26 0.45 135.00 133.99 2w3s n PRO 731 Ca -0.34 0.78 0.07 0.00 -2.02 0.00 0.00 63.50 61.99 2w3s n PRO 731 Cb 0.77 -1.16 0.32 0.00 -0.02 0.00 0.00 33.50 33.41 2w3s n PRO 731 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2w3s n PRO 732 N -4.78 0.06 -0.21 0.52 -0.04 -1.26 -2.04 135.00 127.26 2w3s n PRO 732 Ca 0.06 0.39 -0.04 0.00 -0.04 0.00 0.00 63.50 63.87 2w3s n PRO 732 Cb 0.22 -1.64 0.15 0.00 -0.04 0.00 0.00 33.50 32.19 2w3s n PRO 732 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2w3s h PHE 733 N 0.00 1.01 0.00 0.54 3.57 -0.19 -2.77 116.94 119.11 2w3s h PHE 733 Ca 0.00 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2w3s h PHE 733 Cb 0.20 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.63 2w3s h PHE 733 CO 0.00 0.78 0.00 1.28 -2.23 0.00 0.00 178.31 178.14 2w3s n LEU 734 N -4.29 0.00 0.03 0.59 4.32 -0.87 -2.17 117.00 114.61 2w3s n LEU 734 Ca 0.06 0.43 0.07 0.00 -0.02 0.00 0.00 56.01 56.55 2w3s n LEU 734 Cb 0.18 -0.43 0.32 0.00 -1.62 0.00 0.00 43.42 41.87 2w3s n LEU 734 CO 0.40 -0.21 0.73 0.18 -1.22 0.00 0.00 177.39 177.27 2w3s n LEU 735 N -1.43 0.16 0.23 2.23 4.77 -1.05 -2.55 117.00 119.37 2w3s n LEU 735 Ca 0.05 0.54 0.15 0.00 -0.03 0.00 0.00 56.01 56.73 2w3s n LEU 735 Cb 0.16 -0.53 0.56 0.00 -2.33 0.00 0.00 43.42 41.28 2w3s n LEU 735 CO 0.13 -0.37 0.94 1.23 -1.33 0.00 0.00 177.39 177.99 2w3s h GLY 736 N 2.03 0.00 0.75 -0.72 0.00 -1.63 -2.95 103.07 100.55 2w3s h GLY 736 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 2w3s h GLY 736 CO 0.00 0.00 -0.05 -2.22 0.00 0.00 0.00 176.54 174.27 2w3s h ILE 737 N 0.00 0.84 -0.40 2.60 2.04 -1.74 -1.54 117.51 119.31 2w3s h ILE 737 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 2w3s h ILE 737 Cb 0.57 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.42 2w3s h ILE 737 CO 0.00 0.00 0.12 -0.24 0.00 0.00 0.00 178.15 178.03 2w3s n SER 738 N -5.18 0.05 -0.03 1.72 2.88 -1.11 0.32 113.62 112.28 2w3s n SER 738 Ca -0.05 0.66 -0.13 0.00 -1.33 0.00 0.00 58.87 58.02 2w3s n SER 738 Cb 0.11 -0.29 -0.10 0.00 -0.75 0.00 0.00 64.21 63.18 2w3s n SER 738 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2w3s h ALA 739 N 0.79 0.03 -0.75 -1.46 0.00 -1.46 -2.51 119.26 113.90 2w3s h ALA 739 Ca 0.29 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2w3s h ALA 739 Cb 0.71 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2w3s h ALA 739 CO -0.33 -0.13 0.42 0.35 0.00 0.00 0.00 179.25 179.56 2w3s h PHE 740 N -0.50 1.01 -0.68 0.00 3.57 -0.11 -1.12 116.94 119.11 2w3s h PHE 740 Ca -0.00 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 2w3s h PHE 740 Cb 0.65 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 2w3s h PHE 740 CO 0.13 0.69 0.17 -0.07 -2.23 0.00 0.00 178.31 177.01 2w3s h LEU 741 N 1.05 1.03 -0.55 0.59 4.07 -1.17 -2.04 115.31 118.29 2w3s h LEU 741 Ca 0.27 -0.23 -0.13 0.00 0.08 0.00 0.00 57.88 57.87 2w3s h LEU 741 Cb 0.01 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.46 2w3s h LEU 741 CO -0.05 1.00 -0.21 0.00 -1.08 0.00 0.00 178.44 178.10 2w3s h ALA 742 N 1.08 0.74 -0.25 1.53 0.00 -0.92 -0.75 119.26 120.69 2w3s h ALA 742 Ca 0.21 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2w3s h ALA 742 Cb 0.36 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w3s h ALA 742 CO 0.00 0.67 0.16 1.25 0.00 0.00 0.00 179.25 181.33 2w3s h LEU 743 N 0.82 0.29 -1.41 0.00 5.85 -1.12 -1.51 115.31 118.24 2w3s h LEU 743 Ca 0.11 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 2w3s h LEU 743 Cb 0.77 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2w3s h LEU 743 CO 0.06 0.24 -0.07 -0.74 -0.34 0.00 0.00 178.44 177.59 2w3s h HIS 744 N 0.32 0.31 -0.50 1.25 -0.00 -1.09 -1.79 115.15 113.65 2w3s h HIS 744 Ca 0.09 -0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2w3s h HIS 744 Cb -0.01 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.28 2w3s h HIS 744 CO -0.05 0.38 0.15 0.22 -0.00 0.00 0.00 177.93 178.62 2w3s h ASP 745 N 0.29 0.68 -0.12 3.26 3.58 -0.40 -1.43 116.42 122.29 2w3s h ASP 745 Ca 0.06 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 2w3s h ASP 745 Cb 0.31 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2w3s h ASP 745 CO 0.01 0.66 0.05 0.00 -2.88 0.00 0.00 179.24 177.08 2w3s h ALA 746 N 1.44 0.15 -0.29 -0.78 0.00 -0.42 -3.13 119.26 116.22 2w3s h ALA 746 Ca 0.17 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.06 2w3s h ALA 746 Cb 0.23 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 2w3s h ALA 746 CO -0.01 -0.27 -0.16 0.00 0.00 0.00 0.00 179.25 178.81 2w3s n ALA 748 N -2.71 1.34 -0.25 0.00 0.00 -0.55 0.18 120.51 118.52 2w3s n ALA 748 Ca 0.00 -0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.52 2w3s n ALA 748 Cb 0.24 -1.00 0.21 0.00 0.00 0.00 0.00 19.45 18.90 2w3s n ALA 748 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3s n ALA 749 N -1.16 2.26 0.65 0.00 0.00 -0.85 -4.29 120.51 117.12 2w3s n ALA 749 Ca 0.00 -1.21 0.08 0.00 0.00 0.00 0.00 53.44 52.31 2w3s n ALA 749 Cb 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 19.45 18.93 2w3s n ALA 749 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w3s s GLY 751 N -1.33 -0.24 0.03 0.00 0.00 -1.24 -3.78 107.32 100.76 2w3s s GLY 751 Ca 0.18 0.28 0.25 0.00 0.00 0.00 0.00 44.72 45.43 2w3s s GLY 751 CO 0.21 4.38 1.42 -1.55 0.00 0.00 0.00 173.10 177.56 2w3s n PRO 752 N -0.81 0.08 -2.77 2.90 -0.04 -1.03 -4.84 135.00 128.49 2w3s n PRO 752 Ca 0.01 0.02 -0.30 0.00 -0.04 0.00 0.00 63.50 63.19 2w3s n PRO 752 Cb 0.60 -1.55 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 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 3.50 -0.06 0.54 3.76 -1.04 -5.02 115.29 113.92 2w3s s HIS 753 Ca 0.10 1.00 -0.30 0.00 -0.15 0.00 0.00 55.06 55.72 2w3s s HIS 753 Cb 0.17 -2.42 -0.06 0.00 1.11 0.00 0.00 32.58 31.37 2w3s s HIS 753 CO 0.69 -0.17 1.78 -0.46 -0.85 0.00 0.00 174.74 175.74 2w3s s TRP 754 N -2.49 1.73 0.27 1.40 -0.11 -1.26 -4.48 118.94 114.00 2w3s s TRP 754 Ca 0.51 0.08 0.22 0.00 1.22 0.00 0.00 56.10 58.12 2w3s s TRP 754 Cb -0.10 -4.02 1.02 0.00 -1.50 0.00 0.00 33.47 28.86 2w3s s TRP 754 CO 0.35 -4.25 1.89 -1.35 -4.62 0.00 0.00 176.95 168.97 2w3s h PRO 755 N 10.44 0.00 -6.93 5.86 0.11 -1.90 -3.40 132.00 136.18 2w3s h PRO 755 Ca -0.42 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.10 2w3s h PRO 755 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2w3s h PRO 755 CO 0.96 0.24 -1.02 -3.47 -0.21 0.00 0.00 178.00 174.50 2w3s n ASP 756 N -3.61 -4.20 -4.72 -2.05 2.03 -1.26 -4.42 116.55 98.32 2w3s n ASP 756 Ca -0.01 -1.28 -0.42 0.00 0.52 0.00 0.00 54.79 53.60 2w3s n ASP 756 Cb 0.38 -1.66 -0.03 0.00 -0.72 0.00 0.00 41.12 39.09 2w3s n ASP 756 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2w3s s LEU 757 N -7.29 4.38 0.22 -2.67 2.96 -1.26 -4.85 118.68 110.17 2w3s s LEU 757 Ca 0.46 2.41 -0.00 0.00 -0.22 0.00 0.00 54.13 56.78 2w3s s LEU 757 Cb -0.25 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.80 2w3s s LEU 757 CO 0.97 -0.64 0.41 -1.10 -1.32 0.00 0.00 176.35 174.66 2w3s s GLN 758 N 0.63 3.52 -0.12 1.98 -1.52 -1.26 -4.90 119.66 117.99 2w3s s GLN 758 Ca 0.62 -0.36 -0.04 0.00 -1.95 0.00 0.00 55.36 53.64 2w3s s GLN 758 Cb -0.38 -2.82 -0.04 0.00 -0.22 0.00 0.00 33.01 29.55 2w3s s GLN 758 CO 0.34 0.37 0.04 0.00 -0.25 0.00 0.00 175.29 175.79 2w3s s ALA 759 N -1.92 3.41 0.52 6.09 0.00 -0.57 -3.08 121.76 126.21 2w3s s ALA 759 Ca 0.38 -0.76 -0.20 0.00 0.00 0.00 0.00 51.96 51.38 2w3s s ALA 759 Cb -0.11 -1.67 -0.07 0.00 0.00 0.00 0.00 23.12 21.28 2w3s s ALA 759 CO 0.30 0.49 1.11 -1.25 0.00 0.00 0.00 175.76 176.41 2w3s s PRO 760 N -0.57 3.51 -1.49 0.00 0.04 -1.26 -2.33 135.00 132.89 2w3s s PRO 760 Ca 0.10 1.58 -0.12 0.00 0.04 0.00 0.00 61.00 62.60 2w3s s PRO 760 Cb -0.12 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.36 2w3s s PRO 760 CO 0.02 -0.71 2.44 0.00 0.04 0.00 0.00 177.00 178.78 2w3s n ALA 761 N -1.11 6.22 -0.50 8.56 0.00 0.13 -4.81 120.51 128.99 2w3s n ALA 761 Ca 0.11 -3.82 -0.29 0.00 0.00 0.00 0.00 53.44 49.44 2w3s n ALA 761 Cb 0.51 -3.41 0.25 0.00 0.00 0.00 0.00 19.45 16.79 2w3s n ALA 761 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2w3s n THR 762 N 4.35 0.00 -0.10 0.00 -2.24 -1.13 -4.60 114.28 110.56 2w3s n THR 762 Ca 0.60 -0.40 -0.05 0.00 -2.27 0.00 0.00 64.05 61.92 2w3s n THR 762 Cb 0.33 -0.97 0.01 0.00 -2.10 0.00 0.00 70.33 67.61 2w3s n THR 762 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2w3s h PRO 763 N -2.59 0.05 -0.56 -0.78 0.11 -1.88 0.12 132.00 126.48 2w3s h PRO 763 Ca -0.60 -0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.62 2w3s h PRO 763 Cb 1.33 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.32 2w3s h PRO 763 CO 0.48 0.03 -0.29 1.49 -0.21 0.00 0.00 178.00 179.50 2w3s h GLU 764 N 0.05 -0.14 0.00 1.05 4.81 -1.85 0.44 114.58 118.94 2w3s h GLU 764 Ca 0.18 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.34 2w3s h GLU 764 Cb 0.26 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2w3s h GLU 764 CO -0.33 -0.09 -0.38 0.00 -0.73 0.00 0.00 179.01 177.48 2w3s h ALA 765 N 1.11 1.36 -0.20 2.92 0.00 -1.75 -1.00 119.26 121.71 2w3s h ALA 765 Ca 0.24 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2w3s h ALA 765 Cb 0.53 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2w3s h ALA 765 CO -0.64 0.47 -0.24 0.28 0.00 0.00 0.00 179.25 179.12 2w3s h VAL 766 N 0.00 1.33 -0.49 0.00 2.07 0.45 -2.48 116.25 117.13 2w3s h VAL 766 Ca -0.00 -1.43 0.06 0.00 0.82 0.00 0.00 66.70 66.14 2w3s h VAL 766 Cb 0.68 1.81 -0.05 0.00 -1.52 0.00 0.00 31.29 32.20 2w3s h VAL 766 CO 0.05 0.44 0.20 0.25 0.02 0.00 0.00 177.57 178.52 2w3s h LEU 767 N 0.18 0.23 -0.36 2.57 5.85 0.28 0.14 115.31 124.20 2w3s h LEU 767 Ca 0.03 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2w3s h LEU 767 Cb 0.80 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 2w3s h LEU 767 CO 0.06 0.17 0.22 0.00 -0.34 0.00 0.00 178.44 178.55 2w3s h ALA 768 N 1.31 0.46 0.00 1.25 0.00 -1.23 0.31 119.26 121.36 2w3s h ALA 768 Ca 0.23 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2w3s h ALA 768 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2w3s h ALA 768 CO -0.21 -0.11 -0.31 0.00 0.00 0.00 0.00 179.25 178.61 2w3s h ALA 769 N 1.15 1.29 -0.08 0.00 0.00 -0.95 -1.57 119.26 119.11 2w3s h ALA 769 Ca 0.14 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2w3s h ALA 769 Cb -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2w3s h ALA 769 CO -0.05 0.39 -0.12 0.28 0.00 0.00 0.00 179.25 179.75 2w3s h VAL 770 N 0.00 1.39 -0.94 0.00 2.07 -0.12 -2.79 116.25 115.86 2w3s h VAL 770 Ca -0.00 -1.37 0.02 0.00 0.82 0.00 0.00 66.70 66.17 2w3s h VAL 770 Cb 0.63 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.46 2w3s h VAL 770 CO 0.04 0.38 0.62 0.03 0.02 0.00 0.00 177.57 178.66 2w3s h ARG 771 N -0.24 1.20 -0.32 1.57 3.08 -0.55 0.24 114.38 119.36 2w3s h ARG 771 Ca 0.01 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 60.02 2w3s h ARG 771 Cb 0.67 -0.27 -0.04 0.00 0.08 0.00 0.00 29.97 30.42 2w3s h ARG 771 CO 0.03 0.79 0.10 0.00 -1.07 0.00 0.00 179.97 179.82 2w3s h ARG 772 N 1.24 0.23 -0.61 0.04 3.08 -1.35 0.65 114.38 117.66 2w3s h ARG 772 Ca 0.36 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.34 2w3s h ARG 772 Cb -0.08 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 2w3s h ARG 772 CO -0.09 0.15 0.16 0.00 -1.07 0.00 0.00 179.97 179.12 2w3s h ALA 773 N 1.21 1.13 0.00 0.04 0.00 -0.93 0.28 119.26 121.00 2w3s h ALA 773 Ca 0.15 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2w3s h ALA 773 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2w3s h ALA 773 CO -0.16 0.59 -0.46 0.93 0.00 0.00 0.00 179.25 180.15 2w3s h GLU 774 N 0.90 0.00 -3.06 0.00 5.08 -0.82 -2.66 114.58 114.03 2w3s h GLU 774 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2w3s h GLU 774 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2w3s h GLU 774 CO -0.00 0.46 -0.02 0.41 -1.00 0.00 0.00 179.01 178.86 2w3s n GLY 775 N 0.08 0.80 2.67 -3.84 0.00 0.22 -4.89 105.19 100.23 2w3s n GLY 775 Ca -0.01 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 2w3s n GLY 775 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2w3s s ARG 776 N -3.03 0.03 0.00 1.61 1.70 -0.71 -5.01 118.95 113.54 2w3s s ARG 776 Ca 0.01 0.15 0.00 0.00 -0.47 0.00 0.00 55.73 55.42 2w3s s ARG 776 Cb -0.00 -1.22 0.00 0.00 -0.57 0.00 0.00 34.95 33.16 2w3s s ARG 776 CO 0.02 -0.53 0.00 0.00 -1.08 0.00 0.00 175.30 173.70