#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e1f n ARG 14 N 0.00 0.17 0.10 -0.14 1.74 -1.26 -4.84 116.66 112.43 3e1f n ARG 14 Ca 0.00 0.03 0.12 0.00 -0.77 0.00 0.00 57.85 57.23 3e1f n ARG 14 Cb 0.00 -1.70 0.04 0.00 -1.02 0.00 0.00 32.46 29.77 3e1f n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3e1f h ASP 15 N 11.14 0.00 -0.02 0.55 3.32 -1.95 -3.32 116.42 126.14 3e1f h ASP 15 Ca -0.10 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.89 3e1f h ASP 15 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.91 3e1f h ASP 15 CO 1.21 0.03 0.00 -2.67 -1.72 0.00 0.00 179.24 176.08 3e1f n TRP 16 N -2.57 0.02 -2.14 4.55 2.14 -1.26 -3.21 117.44 114.97 3e1f n TRP 16 Ca 0.01 -0.01 -0.02 0.00 2.07 0.00 0.00 57.50 59.55 3e1f n TRP 16 Cb 0.53 0.00 0.09 0.00 -0.81 0.00 0.00 31.31 31.12 3e1f n TRP 16 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 3e1f n GLU 17 N -0.65 1.58 -3.47 -2.67 1.02 -1.25 0.68 120.64 115.88 3e1f n GLU 17 Ca 0.13 -3.15 -0.21 0.00 -0.02 0.00 0.00 57.16 53.91 3e1f n GLU 17 Cb 0.08 -1.30 -0.12 0.00 -0.02 0.00 0.00 31.44 30.08 3e1f n GLU 17 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3e1f s ASN 18 N -3.06 2.13 0.00 1.62 2.47 -1.20 -4.70 114.94 112.20 3e1f s ASN 18 Ca 0.38 -0.75 0.06 0.00 0.42 0.00 0.00 52.86 52.97 3e1f s ASN 18 Cb 0.38 0.21 0.31 0.00 -1.45 0.00 0.00 41.25 40.70 3e1f s ASN 18 CO -0.07 -0.38 1.00 -0.81 -3.72 0.00 0.00 177.10 173.12 3e1f n PRO 19 N 5.30 0.10 0.15 0.43 -0.04 -1.26 -1.18 135.00 138.50 3e1f n PRO 19 Ca -0.04 0.19 0.09 0.00 -0.04 0.00 0.00 63.50 63.70 3e1f n PRO 19 Cb 0.46 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.48 3e1f n PRO 19 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3e1f h GLY 20 N 0.98 0.00 -7.70 0.55 0.00 -1.94 -3.37 103.07 91.59 3e1f h GLY 20 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 3e1f h GLY 20 CO 0.00 0.00 -0.67 0.14 0.00 0.00 0.00 176.54 176.01 3e1f s VAL 21 N -3.18 3.07 -0.75 4.60 1.01 -0.32 -4.91 120.40 119.91 3e1f s VAL 21 Ca 0.03 -1.54 0.08 0.00 0.00 0.00 0.00 61.98 60.55 3e1f s VAL 21 Cb 0.07 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.61 3e1f s VAL 21 CO 0.74 -0.25 0.58 0.35 0.00 0.00 0.00 175.10 176.52 3e1f n THR 22 N 4.62 0.00 -3.60 3.92 -2.24 -1.26 -4.76 114.28 110.95 3e1f n THR 22 Ca -0.10 -0.43 -0.04 0.00 -2.27 0.00 0.00 64.05 61.21 3e1f n THR 22 Cb 0.43 1.10 -0.02 0.00 -2.10 0.00 0.00 70.33 69.75 3e1f n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3e1f s GLN 23 N -1.08 0.60 -0.22 -0.78 1.03 -1.26 -1.43 119.66 116.53 3e1f s GLN 23 Ca 0.07 -0.27 -0.04 0.00 0.04 0.00 0.00 55.36 55.16 3e1f s GLN 23 Cb 0.06 0.24 0.11 0.00 0.03 0.00 0.00 33.01 33.46 3e1f s GLN 23 CO 0.18 -0.27 0.36 -0.51 -2.54 0.00 0.00 175.29 172.51 3e1f s LEU 24 N -2.56 -0.56 -0.82 2.60 1.43 0.02 -4.86 118.68 113.93 3e1f s LEU 24 Ca 0.10 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.61 3e1f s LEU 24 Cb 0.00 1.07 0.00 0.00 0.03 0.00 0.00 46.19 47.29 3e1f s LEU 24 CO -0.05 -0.28 0.00 0.59 0.23 0.00 0.00 176.35 176.85 3e1f n ASN 25 N 5.37 -4.11 -4.75 2.29 3.02 -1.26 -1.12 115.26 114.69 3e1f n ASN 25 Ca -0.05 0.19 -0.40 0.00 -0.03 0.00 0.00 54.58 54.29 3e1f n ASN 25 Cb 0.50 -2.29 -0.06 0.00 -0.61 0.00 0.00 39.78 37.33 3e1f n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3e1f s ARG 26 N -2.49 4.72 0.80 3.52 3.52 -1.26 -4.63 118.95 123.14 3e1f s ARG 26 Ca 0.00 1.37 -0.12 0.00 -0.13 0.00 0.00 55.73 56.85 3e1f s ARG 26 Cb 0.00 -3.30 0.07 0.00 -1.56 0.00 0.00 34.95 30.16 3e1f s ARG 26 CO 0.00 0.45 1.10 -0.51 -0.81 0.00 0.00 175.30 175.53 3e1f s LEU 27 N -0.83 2.56 0.43 -0.88 1.43 0.22 -4.98 118.68 116.62 3e1f s LEU 27 Ca 0.41 1.25 -0.25 0.00 -1.03 0.00 0.00 54.13 54.50 3e1f s LEU 27 Cb -0.24 -3.84 -0.08 0.00 0.03 0.00 0.00 46.19 42.06 3e1f s LEU 27 CO 0.29 -1.98 1.26 0.00 0.23 0.00 0.00 176.35 176.15 3e1f s ALA 28 N -3.19 3.14 0.86 4.21 0.00 -1.26 -4.64 121.76 120.87 3e1f s ALA 28 Ca 0.61 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 53.61 3e1f s ALA 28 Cb -0.14 -3.46 0.11 0.00 0.00 0.00 0.00 23.12 19.63 3e1f s ALA 28 CO 0.54 -0.81 1.10 0.00 0.00 0.00 0.00 175.76 176.59 3e1f s ALA 29 N -1.34 1.75 -0.15 0.00 0.00 -1.26 -5.01 121.76 115.76 3e1f s ALA 29 Ca 0.60 0.22 -0.34 0.00 0.00 0.00 0.00 51.96 52.43 3e1f s ALA 29 Cb -0.35 -3.28 0.14 0.00 0.00 0.00 0.00 23.12 19.62 3e1f s ALA 29 CO 0.45 -2.24 1.30 -3.38 0.00 0.00 0.00 175.76 171.89 3e1f s HIS 30 N -2.84 -0.06 0.96 0.00 -3.43 -1.26 -4.87 115.29 103.79 3e1f s HIS 30 Ca 0.63 0.01 -0.11 0.00 -0.80 0.00 0.00 55.06 54.80 3e1f s HIS 30 Cb -0.19 0.52 0.15 0.00 -1.43 0.00 0.00 32.58 31.63 3e1f s HIS 30 CO 0.57 -0.16 1.01 -2.30 -2.00 0.00 0.00 174.74 171.87 3e1f n PRO 31 N -0.24 -0.70 -1.67 -0.38 -0.02 -1.11 -4.39 135.00 126.48 3e1f n PRO 31 Ca -0.02 -0.15 -0.47 0.00 -2.02 0.00 0.00 63.50 60.84 3e1f n PRO 31 Cb 0.60 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 3e1f n PRO 31 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3e1f n PRO 32 N -3.97 2.19 -4.27 0.52 -0.02 -1.26 -5.00 135.00 123.19 3e1f n PRO 32 Ca 0.10 0.80 -0.23 0.00 -2.02 0.00 0.00 63.50 62.15 3e1f n PRO 32 Cb 0.53 -2.60 -0.07 0.00 -0.02 0.00 0.00 33.50 31.34 3e1f n PRO 32 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3e1f s PHE 33 N 2.17 2.71 0.00 6.00 0.08 -1.26 -4.80 117.98 122.88 3e1f s PHE 33 Ca 0.84 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 57.65 3e1f s PHE 33 Cb -0.67 -1.25 0.00 0.00 -0.57 0.00 0.00 43.02 40.53 3e1f s PHE 33 CO 0.43 0.59 0.00 0.00 -0.10 0.00 0.00 175.22 176.14 3e1f n ALA 34 N -0.93 0.00 -3.77 5.36 0.00 -1.26 -5.07 120.51 114.85 3e1f n ALA 34 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.04 3e1f n ALA 34 Cb 0.59 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.08 3e1f n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3e1f n SER 35 N 0.00 -4.87 -4.77 0.00 2.88 -1.26 -4.35 113.62 101.25 3e1f n SER 35 Ca 0.00 -1.07 -0.36 0.00 -1.33 0.00 0.00 58.87 56.11 3e1f n SER 35 Cb 0.00 -3.05 0.00 0.00 -0.75 0.00 0.00 64.21 60.42 3e1f n SER 35 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3e1f s TRP 36 N -3.50 2.68 -0.58 0.66 0.51 -0.69 -4.58 118.94 113.45 3e1f s TRP 36 Ca 0.46 1.53 0.10 0.00 -2.12 0.00 0.00 56.10 56.08 3e1f s TRP 36 Cb -0.18 -3.35 0.30 0.00 -0.81 0.00 0.00 33.47 29.43 3e1f s TRP 36 CO 0.88 -1.66 1.24 0.54 -0.51 0.00 0.00 176.95 177.44 3e1f n ARG 37 N -1.10 2.83 -3.61 4.98 5.12 -1.26 -1.10 116.66 122.51 3e1f n ARG 37 Ca 0.11 -2.14 -0.19 0.00 -1.93 0.00 0.00 57.85 53.69 3e1f n ARG 37 Cb 0.50 -1.35 -0.15 0.00 -1.16 0.00 0.00 32.46 30.29 3e1f n ARG 37 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3e1f s ASN 38 N -1.28 1.23 0.48 0.55 3.04 -1.26 -4.93 114.94 112.76 3e1f s ASN 38 Ca 0.24 0.00 0.19 0.00 0.04 0.00 0.00 52.86 53.32 3e1f s ASN 38 Cb 0.15 0.19 1.19 0.00 -1.54 0.00 0.00 41.25 41.24 3e1f s ASN 38 CO 0.11 -0.29 1.99 0.28 -3.04 0.00 0.00 177.10 176.15 3e1f h SER 39 N 8.36 0.21 -0.33 -4.21 0.02 -1.96 -1.38 113.55 114.26 3e1f h SER 39 Ca -0.14 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.70 3e1f h SER 39 Cb 1.13 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 3e1f h SER 39 CO 0.21 0.12 -0.22 -0.08 -1.14 0.00 0.00 176.83 175.72 3e1f h GLU 40 N 0.22 0.82 -0.47 3.45 4.57 -1.99 -1.16 114.58 120.02 3e1f h GLU 40 Ca 0.27 -0.33 -0.08 0.00 -1.18 0.00 0.00 59.36 58.03 3e1f h GLU 40 Cb 0.75 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 3e1f h GLU 40 CO -0.05 0.96 -0.04 0.93 -1.18 0.00 0.00 179.01 179.63 3e1f h GLU 41 N 0.72 0.80 0.04 1.92 4.39 -1.64 -2.40 114.58 118.40 3e1f h GLU 41 Ca 0.10 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 3e1f h GLU 41 Cb 0.74 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3e1f h GLU 41 CO 0.06 0.83 -0.02 0.00 -1.16 0.00 0.00 179.01 178.72 3e1f h ALA 42 N 1.22 -0.05 -0.91 3.43 0.00 -1.14 -1.27 119.26 120.55 3e1f h ALA 42 Ca 0.14 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.98 3e1f h ALA 42 Cb 0.50 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 3e1f h ALA 42 CO 0.03 -0.42 0.58 -0.09 0.00 0.00 0.00 179.25 179.34 3e1f h ARG 43 N -0.28 1.04 -0.11 0.00 2.43 -1.14 -1.60 114.38 114.71 3e1f h ARG 43 Ca -0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3e1f h ARG 43 Cb 0.25 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3e1f h ARG 43 CO 0.01 0.69 0.00 0.25 -1.51 0.00 0.00 179.97 179.41 3e1f n THR 44 N -4.56 0.14 -4.01 0.20 -2.24 -0.91 -4.93 114.28 97.98 3e1f n THR 44 Ca 0.13 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 61.34 3e1f n THR 44 Cb 0.15 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 3e1f n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3e1f n ASP 45 N 0.04 -3.29 -4.91 3.42 2.03 -0.60 -4.96 116.55 108.28 3e1f n ASP 45 Ca 0.16 -0.90 -0.28 0.00 0.52 0.00 0.00 54.79 54.30 3e1f n ASP 45 Cb 0.27 -3.39 -0.02 0.00 -0.72 0.00 0.00 41.12 37.26 3e1f n ASP 45 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3e1f s ARG 46 N -6.66 3.60 0.69 -0.67 0.52 -0.58 -5.04 118.95 110.82 3e1f s ARG 46 Ca 0.53 0.07 -0.17 0.00 -0.52 0.00 0.00 55.73 55.64 3e1f s ARG 46 Cb -0.28 -2.53 -0.12 0.00 0.52 0.00 0.00 34.95 32.54 3e1f s ARG 46 CO 0.87 0.04 -0.12 -2.30 0.02 0.00 0.00 175.30 173.81 3e1f n PRO 47 N -1.53 0.08 -5.10 3.54 -0.02 -1.26 -4.80 135.00 125.92 3e1f n PRO 47 Ca -0.01 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.19 3e1f n PRO 47 Cb 0.55 -1.23 -0.16 0.00 -0.02 0.00 0.00 33.50 32.64 3e1f n PRO 47 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3e1f s SER 48 N -1.13 3.39 0.48 2.55 0.15 -1.26 -5.00 113.70 112.88 3e1f s SER 48 Ca 0.55 -0.46 0.22 0.00 0.70 0.00 0.00 55.95 56.96 3e1f s SER 48 Cb -0.38 -1.25 1.24 0.00 -1.71 0.00 0.00 66.02 63.93 3e1f s SER 48 CO 0.68 0.20 2.03 1.56 1.20 0.00 0.00 173.24 178.91 3e1f h GLN 49 N 6.41 0.00 -0.21 5.44 1.08 -1.90 -2.10 115.11 123.82 3e1f h GLN 49 Ca -0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 3e1f h GLN 49 Cb 1.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 3e1f h GLN 49 CO 0.49 0.16 0.00 1.04 -0.95 0.00 0.00 178.83 179.57 3e1f n GLN 50 N -3.93 1.49 -3.64 1.46 3.00 -1.26 -4.57 117.38 109.93 3e1f n GLN 50 Ca -0.02 -0.76 -0.29 0.00 -0.01 0.00 0.00 57.00 55.92 3e1f n GLN 50 Cb 0.25 -1.17 -0.13 0.00 0.00 0.00 0.00 30.24 29.19 3e1f n GLN 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 3e1f s LEU 51 N -1.02 2.21 0.21 1.08 2.96 -0.79 -1.16 118.68 122.17 3e1f s LEU 51 Ca 0.15 -2.49 -0.08 0.00 -0.22 0.00 0.00 54.13 51.49 3e1f s LEU 51 Cb 0.08 -0.86 -0.07 0.00 0.50 0.00 0.00 46.19 45.84 3e1f s LEU 51 CO 0.10 -0.28 0.50 -0.13 -1.32 0.00 0.00 176.35 175.22 3e1f s ARG 52 N 0.57 3.74 -0.16 1.98 0.52 -0.06 -4.75 118.95 120.79 3e1f s ARG 52 Ca 0.18 0.15 -0.07 0.00 -0.52 0.00 0.00 55.73 55.47 3e1f s ARG 52 Cb -0.24 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.48 3e1f s ARG 52 CO 0.00 0.35 0.07 0.45 0.02 0.00 0.00 175.30 176.20 3e1f s SER 53 N -2.44 5.75 -0.26 0.23 0.15 -1.26 -0.54 113.70 115.34 3e1f s SER 53 Ca 0.45 0.18 0.13 0.00 0.70 0.00 0.00 55.95 57.41 3e1f s SER 53 Cb -0.11 -1.91 0.77 0.00 -1.71 0.00 0.00 66.02 63.06 3e1f s SER 53 CO 0.23 0.25 1.73 0.18 1.20 0.00 0.00 173.24 176.83 3e1f n LEU 54 N 3.01 5.64 -4.81 3.45 4.77 0.55 -4.94 117.00 124.67 3e1f n LEU 54 Ca -0.17 -3.03 -0.33 0.00 -0.03 0.00 0.00 56.01 52.45 3e1f n LEU 54 Cb 0.53 -0.69 0.01 0.00 -2.33 0.00 0.00 43.42 40.94 3e1f n LEU 54 CO 0.33 0.69 0.71 0.20 -1.33 0.00 0.00 177.39 178.00 3e1f s ASN 55 N -1.00 5.81 0.00 -1.43 -0.87 -1.25 -4.83 114.94 111.36 3e1f s ASN 55 Ca 0.54 1.79 0.00 0.00 -1.57 0.00 0.00 52.86 53.62 3e1f s ASN 55 Cb 0.42 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 39.12 3e1f s ASN 55 CO 0.14 -1.15 0.00 0.61 -2.57 0.00 0.00 177.10 174.13 3e1f n GLY 56 N -1.06 0.46 3.68 0.66 0.00 -0.72 -5.00 105.19 103.21 3e1f n GLY 56 Ca 0.09 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.43 3e1f n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3e1f s GLU 57 N -2.00 4.21 0.43 1.61 2.02 -1.26 -0.16 118.70 123.55 3e1f s GLU 57 Ca 0.00 0.30 0.04 0.00 0.02 0.00 0.00 54.97 55.33 3e1f s GLU 57 Cb 0.00 -3.52 -0.04 0.00 0.10 0.00 0.00 34.13 30.67 3e1f s GLU 57 CO 0.00 -0.02 0.04 -1.58 0.02 0.00 0.00 175.26 173.72 3e1f s TRP 58 N 1.22 2.07 -0.19 1.61 0.52 0.21 -4.92 118.94 119.47 3e1f s TRP 58 Ca 0.22 -0.92 -0.08 0.00 0.02 0.00 0.00 56.10 55.33 3e1f s TRP 58 Cb -0.15 -1.53 -0.04 0.00 -1.15 0.00 0.00 33.47 30.60 3e1f s TRP 58 CO 0.09 0.17 0.07 1.03 0.02 0.00 0.00 176.95 178.33 3e1f s ARG 59 N -3.80 3.98 0.01 4.98 1.81 0.17 -0.64 118.95 125.45 3e1f s ARG 59 Ca 0.24 -0.34 0.03 0.00 -1.72 0.00 0.00 55.73 53.94 3e1f s ARG 59 Cb 0.06 -3.26 -0.01 0.00 -0.45 0.00 0.00 34.95 31.29 3e1f s ARG 59 CO 0.12 0.23 -0.09 0.12 -0.68 0.00 0.00 175.30 175.00 3e1f s PHE 60 N 0.49 0.81 -0.09 -0.53 5.36 0.28 -0.31 117.98 123.99 3e1f s PHE 60 Ca 0.04 -0.24 -0.06 0.00 -0.96 0.00 0.00 56.93 55.71 3e1f s PHE 60 Cb -0.13 -0.50 0.04 0.00 -0.34 0.00 0.00 43.02 42.09 3e1f s PHE 60 CO 0.01 -0.01 0.22 0.00 -1.46 0.00 0.00 175.22 173.97 3e1f s ALA 61 N -0.53 -0.52 0.13 11.12 0.00 -0.81 -0.98 121.76 130.18 3e1f s ALA 61 Ca 0.00 0.81 -0.08 0.00 0.00 0.00 0.00 51.96 52.69 3e1f s ALA 61 Cb -0.05 -0.50 -0.06 0.00 0.00 0.00 0.00 23.12 22.50 3e1f s ALA 61 CO 0.00 -0.16 0.42 -0.46 0.00 0.00 0.00 175.76 175.57 3e1f s TRP 62 N 0.80 3.51 0.03 0.00 -0.00 -1.26 -0.80 118.94 121.22 3e1f s TRP 62 Ca -0.06 0.73 -0.02 0.00 -0.00 0.00 0.00 56.10 56.75 3e1f s TRP 62 Cb -0.07 -2.13 -0.02 0.00 -0.00 0.00 0.00 33.47 31.25 3e1f s TRP 62 CO -0.05 0.44 0.01 -0.06 -0.00 0.00 0.00 176.95 177.28 3e1f s PHE 63 N -1.58 0.27 -0.17 5.86 0.08 -0.44 -4.97 117.98 117.03 3e1f s PHE 63 Ca 0.39 -0.57 0.29 0.00 0.12 0.00 0.00 56.93 57.16 3e1f s PHE 63 Cb -0.13 -0.20 1.06 0.00 -0.57 0.00 0.00 43.02 43.18 3e1f s PHE 63 CO 0.21 -0.26 1.85 -1.00 -0.10 0.00 0.00 175.22 175.92 3e1f h PRO 64 N 4.22 0.00 -1.97 0.24 0.13 -1.86 -1.16 132.00 131.61 3e1f h PRO 64 Ca -0.32 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.94 3e1f h PRO 64 Cb 1.19 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.15 3e1f h PRO 64 CO 0.46 0.00 0.56 0.00 -0.23 0.00 0.00 178.00 178.80 3e1f s ALA 65 N -3.47 -1.89 0.46 -0.56 0.00 -1.20 -1.84 121.76 113.25 3e1f s ALA 65 Ca 0.04 1.25 0.12 0.00 0.00 0.00 0.00 51.96 53.37 3e1f s ALA 65 Cb 0.08 0.05 1.06 0.00 0.00 0.00 0.00 23.12 24.32 3e1f s ALA 65 CO 0.54 -0.58 2.09 -1.00 0.00 0.00 0.00 175.76 176.82 3e1f h PRO 66 N 2.13 0.28 0.00 0.00 0.13 -1.87 -1.54 132.00 131.13 3e1f h PRO 66 Ca -0.19 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3e1f h PRO 66 Cb 1.21 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3e1f h PRO 66 CO 0.29 0.18 0.00 0.39 -0.23 0.00 0.00 178.00 178.64 3e1f n GLU 67 N -4.50 0.06 0.00 0.86 4.71 -1.26 -1.17 120.64 119.34 3e1f n GLU 67 Ca 0.01 0.27 0.11 0.00 -0.01 0.00 0.00 57.16 57.54 3e1f n GLU 67 Cb 0.10 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.06 3e1f n GLU 67 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3e1f n ALA 68 N -1.32 3.24 -2.46 0.62 0.00 -0.58 -4.90 120.51 115.10 3e1f n ALA 68 Ca 0.02 -0.65 -0.43 0.00 0.00 0.00 0.00 53.44 52.38 3e1f n ALA 68 Cb 0.04 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 3e1f n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3e1f s VAL 69 N -2.31 4.10 0.19 0.00 1.01 -0.31 -4.98 120.40 118.09 3e1f s VAL 69 Ca 0.21 1.18 -0.31 0.00 0.00 0.00 0.00 61.98 63.05 3e1f s VAL 69 Cb 0.18 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 32.15 3e1f s VAL 69 CO 0.49 -0.71 1.58 -2.16 0.00 0.00 0.00 175.10 174.29 3e1f s PRO 70 N 4.47 4.20 0.25 2.72 0.04 -1.26 -4.92 135.00 140.50 3e1f s PRO 70 Ca 0.55 2.41 -0.04 0.00 0.04 0.00 0.00 61.00 63.96 3e1f s PRO 70 Cb -0.13 -3.13 0.50 0.00 0.04 0.00 0.00 34.50 31.78 3e1f s PRO 70 CO 0.28 -0.61 1.69 1.49 0.04 0.00 0.00 177.00 179.88 3e1f h GLU 71 N 6.51 0.28 -1.00 4.56 4.57 -2.00 -1.21 114.58 126.30 3e1f h GLU 71 Ca -0.43 -0.02 0.41 0.00 -1.18 0.00 0.00 59.36 58.15 3e1f h GLU 71 Cb 1.21 -0.06 -0.18 0.00 -0.16 0.00 0.00 28.75 29.55 3e1f h GLU 71 CO 0.90 0.18 0.53 0.66 -1.18 0.00 0.00 179.01 180.11 3e1f h SER 72 N 0.29 0.31 -1.00 1.04 4.64 -1.91 0.21 113.55 117.12 3e1f h SER 72 Ca 0.44 0.26 0.23 0.00 -0.47 0.00 0.00 61.79 62.25 3e1f h SER 72 Cb 0.76 0.27 -0.10 0.00 -0.31 0.00 0.00 62.40 63.02 3e1f h SER 72 CO -0.52 -0.43 0.63 -0.25 -0.87 0.00 0.00 176.83 175.40 3e1f h TRP 73 N 0.01 0.80 -0.41 4.77 7.01 -1.27 0.81 115.95 127.67 3e1f h TRP 73 Ca 0.84 0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.90 3e1f h TRP 73 Cb 2.21 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 29.02 3e1f h TRP 73 CO -0.02 0.12 0.27 -0.07 -2.79 0.00 0.00 178.44 175.96 3e1f h LEU 74 N 0.52 0.36 0.00 0.65 3.38 -0.76 -3.29 115.31 116.17 3e1f h LEU 74 Ca 0.58 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.47 3e1f h LEU 74 Cb 1.25 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3e1f h LEU 74 CO -0.33 0.25 -1.29 -0.62 0.09 0.00 0.00 178.44 176.54 3e1f n GLU 75 N -4.48 2.89 -4.88 1.13 1.02 -0.35 -2.97 120.64 113.00 3e1f n GLU 75 Ca 0.04 -0.01 -0.27 0.00 -0.02 0.00 0.00 57.16 56.90 3e1f n GLU 75 Cb 0.17 -1.11 -0.16 0.00 -0.02 0.00 0.00 31.44 30.31 3e1f n GLU 75 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3e1f n ASP 77 N 3.43 3.38 -4.73 0.00 2.03 -1.26 -3.60 116.55 115.80 3e1f n ASP 77 Ca -0.20 1.16 -0.41 0.00 0.52 0.00 0.00 54.79 55.86 3e1f n ASP 77 Cb 0.52 -1.53 -0.04 0.00 -0.72 0.00 0.00 41.12 39.36 3e1f n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3e1f s LEU 78 N -0.48 4.44 0.27 -2.67 1.43 -1.26 -4.92 118.68 115.49 3e1f s LEU 78 Ca 0.63 1.94 0.11 0.00 -1.03 0.00 0.00 54.13 55.78 3e1f s LEU 78 Cb -0.55 -3.59 0.32 0.00 0.03 0.00 0.00 46.19 42.40 3e1f s LEU 78 CO 0.52 -0.25 1.59 -0.65 0.23 0.00 0.00 176.35 177.78 3e1f h PRO 79 N 5.88 0.00 0.00 1.29 0.11 -2.02 -2.77 132.00 134.49 3e1f h PRO 79 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3e1f h PRO 79 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3e1f h PRO 79 CO 0.75 0.63 0.00 -0.85 -0.21 0.00 0.00 178.00 178.32 3e1f n GLU 80 N -3.72 0.13 -1.06 1.05 0.28 -1.26 -4.77 120.64 111.30 3e1f n GLU 80 Ca -0.01 0.48 -0.29 0.00 -0.16 0.00 0.00 57.16 57.18 3e1f n GLU 80 Cb 0.64 -1.82 0.18 0.00 1.43 0.00 0.00 31.44 31.87 3e1f n GLU 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3e1f s ALA 81 N -3.33 0.91 0.30 -1.84 0.00 -1.05 -4.98 121.76 111.78 3e1f s ALA 81 Ca 0.02 -0.20 0.09 0.00 0.00 0.00 0.00 51.96 51.87 3e1f s ALA 81 Cb 0.07 -3.17 -0.06 0.00 0.00 0.00 0.00 23.12 19.96 3e1f s ALA 81 CO 0.27 -2.86 -0.11 -0.51 0.00 0.00 0.00 175.76 172.56 3e1f s ASP 82 N -3.27 3.26 -0.25 0.00 1.11 -0.15 -4.92 116.67 112.45 3e1f s ASP 82 Ca 0.65 -1.15 -0.09 0.00 0.18 0.00 0.00 52.55 52.14 3e1f s ASP 82 Cb -0.20 -0.26 -0.04 0.00 1.07 0.00 0.00 42.92 43.49 3e1f s ASP 82 CO 0.59 -0.20 0.13 -0.89 1.18 0.00 0.00 175.17 175.98 3e1f s THR 83 N -2.76 4.97 0.23 -1.27 2.01 -1.26 -0.56 115.64 116.99 3e1f s THR 83 Ca 0.30 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.38 3e1f s THR 83 Cb 0.01 -3.33 -0.05 0.00 0.01 0.00 0.00 72.50 69.14 3e1f s THR 83 CO 0.14 0.32 -0.00 0.68 -0.69 0.00 0.00 174.62 175.06 3e1f s VAL 84 N 1.42 0.99 0.14 3.82 -7.23 0.18 -4.92 120.40 114.79 3e1f s VAL 84 Ca 0.06 -2.03 -0.19 0.00 -1.81 0.00 0.00 61.98 58.01 3e1f s VAL 84 Cb -0.15 -2.33 -0.07 0.00 0.56 0.00 0.00 36.38 34.39 3e1f s VAL 84 CO 0.06 -0.33 0.63 -0.69 -0.31 0.00 0.00 175.10 174.46 3e1f s VAL 85 N -3.45 4.67 -0.01 1.32 1.01 -1.26 0.68 120.40 123.36 3e1f s VAL 85 Ca 0.28 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.53 3e1f s VAL 85 Cb 0.06 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 3e1f s VAL 85 CO 0.08 0.41 -0.13 -0.69 0.00 0.00 0.00 175.10 174.77 3e1f s VAL 86 N -1.28 1.06 0.79 2.92 1.01 0.77 -4.17 120.40 121.50 3e1f s VAL 86 Ca 0.35 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 3e1f s VAL 86 Cb -0.18 -0.89 0.06 0.00 0.00 0.00 0.00 36.38 35.37 3e1f s VAL 86 CO 0.21 0.30 1.09 -2.16 0.00 0.00 0.00 175.10 174.53 3e1f s PRO 87 N -0.27 2.15 0.00 2.72 0.04 -1.26 -1.75 135.00 136.62 3e1f s PRO 87 Ca 0.04 0.86 0.00 0.00 0.04 0.00 0.00 61.00 61.94 3e1f s PRO 87 Cb -0.06 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.58 3e1f s PRO 87 CO -0.00 -1.63 0.00 -1.13 0.04 0.00 0.00 177.00 174.27 3e1f n SER 88 N -3.47 0.00 -4.29 6.66 3.41 0.33 -4.91 113.62 111.34 3e1f n SER 88 Ca 0.08 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.34 3e1f n SER 88 Cb 0.55 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.35 3e1f n SER 88 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3e1f s ASN 89 N 0.00 4.08 0.53 4.04 -0.87 -1.26 -3.36 114.94 118.10 3e1f s ASN 89 Ca 0.00 -0.42 0.33 0.00 -1.57 0.00 0.00 52.86 51.20 3e1f s ASN 89 Cb 0.00 -1.68 1.79 0.00 -0.02 0.00 0.00 41.25 41.34 3e1f s ASN 89 CO 0.00 0.02 2.00 4.11 -2.57 0.00 0.00 177.10 180.66 3e1f h TRP 90 N 7.82 0.00 -0.47 2.20 0.09 -1.93 0.21 115.95 123.87 3e1f h TRP 90 Ca -0.39 0.00 -0.07 0.00 0.09 0.00 0.00 58.89 58.52 3e1f h TRP 90 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.39 3e1f h TRP 90 CO 0.55 0.00 0.03 1.96 0.09 0.00 0.00 178.44 181.07 3e1f h GLN 91 N 0.00 0.81 0.00 0.12 7.50 -1.82 -1.79 115.11 119.93 3e1f h GLN 91 Ca 0.00 -0.24 0.00 0.00 0.50 0.00 0.00 58.65 58.91 3e1f h GLN 91 Cb 0.14 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.59 3e1f h GLN 91 CO 0.00 0.84 0.00 0.52 -1.50 0.00 0.00 178.83 178.69 3e1f h MET 92 N 0.66 0.00 -0.02 1.46 2.86 -0.87 0.16 114.93 119.18 3e1f h MET 92 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3e1f h MET 92 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3e1f h MET 92 CO 0.02 0.00 -0.15 0.72 1.06 0.00 0.00 176.91 178.56 3e1f n HIS 93 N -2.50 0.00 -0.84 -0.22 8.25 -0.73 -4.96 115.22 114.22 3e1f n HIS 93 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3e1f n HIS 93 Cb 0.12 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.21 3e1f n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3e1f n GLY 94 N 1.32 0.59 0.24 -1.41 0.00 0.54 -4.94 105.19 101.55 3e1f n GLY 94 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 3e1f n GLY 94 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3e1f h TYR 95 N 0.00 0.00 -2.04 1.61 0.05 -1.59 -3.46 116.97 111.55 3e1f h TYR 95 Ca 0.00 0.00 0.20 0.00 0.05 0.00 0.00 58.73 58.98 3e1f h TYR 95 Cb 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 37.62 3e1f h TYR 95 CO 0.00 0.17 0.60 0.16 -1.05 0.00 0.00 178.16 178.04 3e1f s ASP 96 N -6.15 -0.20 0.23 3.88 1.47 -1.26 -5.04 116.67 109.59 3e1f s ASP 96 Ca -0.01 -0.19 -0.26 0.00 1.18 0.00 0.00 52.55 53.27 3e1f s ASP 96 Cb 0.12 0.35 -0.09 0.00 -0.34 0.00 0.00 42.92 42.96 3e1f s ASP 96 CO 0.61 -0.62 0.85 0.00 0.68 0.00 0.00 175.17 176.68 3e1f s ALA 97 N -2.96 3.37 0.14 2.11 0.00 -1.26 -4.30 121.76 118.86 3e1f s ALA 97 Ca 0.10 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 52.21 3e1f s ALA 97 Cb 0.00 -3.05 -0.07 0.00 0.00 0.00 0.00 23.12 20.00 3e1f s ALA 97 CO -0.03 0.25 0.90 -1.25 0.00 0.00 0.00 175.76 175.63 3e1f s PRO 98 N -1.46 4.69 -0.10 0.00 0.04 -1.26 -4.99 135.00 131.92 3e1f s PRO 98 Ca 0.41 1.36 -0.05 0.00 0.04 0.00 0.00 61.00 62.77 3e1f s PRO 98 Cb -0.22 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 3e1f s PRO 98 CO 0.27 0.36 0.07 0.42 0.04 0.00 0.00 177.00 178.15 3e1f s ILE 99 N -0.49 4.93 -0.31 0.56 1.01 -1.13 -4.63 121.20 121.15 3e1f s ILE 99 Ca 0.42 -0.01 0.02 0.00 0.00 0.00 0.00 60.65 61.09 3e1f s ILE 99 Cb -0.24 -3.12 0.08 0.00 0.01 0.00 0.00 42.46 39.20 3e1f s ILE 99 CO 0.29 0.61 -0.01 -0.47 0.00 0.00 0.00 174.94 175.36 3e1f s TYR 100 N -0.95 3.49 -0.01 3.97 5.04 -1.26 0.13 117.35 127.76 3e1f s TYR 100 Ca 0.14 -2.56 0.02 0.00 -2.44 0.00 0.00 57.07 52.23 3e1f s TYR 100 Cb -0.12 -2.44 -0.00 0.00 0.35 0.00 0.00 41.96 39.76 3e1f s TYR 100 CO 0.03 -0.91 -0.06 -0.08 -1.34 0.00 0.00 175.55 173.19 3e1f s THR 101 N 1.04 0.51 0.00 4.34 -1.32 -1.26 -1.80 115.64 117.15 3e1f s THR 101 Ca 0.01 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.24 3e1f s THR 101 Cb -0.20 -0.45 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 3e1f s THR 101 CO -0.06 0.16 0.01 -3.20 -2.21 0.00 0.00 174.62 169.33 3e1f n ASN 102 N 3.12 0.00 -0.08 8.08 2.85 -1.26 -4.15 115.26 123.82 3e1f n ASN 102 Ca -0.15 0.01 -0.11 0.00 -0.11 0.00 0.00 54.58 54.22 3e1f n ASN 102 Cb 0.56 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.53 3e1f n ASN 102 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 3e1f h VAL 103 N 0.00 0.44 -1.76 3.44 2.07 -1.93 -3.35 116.25 115.16 3e1f h VAL 103 Ca 0.00 -1.50 -0.66 0.00 0.82 0.00 0.00 66.70 65.36 3e1f h VAL 103 Cb 0.00 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.78 3e1f h VAL 103 CO 0.00 0.15 1.10 0.41 0.02 0.00 0.00 177.57 179.25 3e1f n THR 104 N -4.57 0.45 -1.52 2.57 -1.04 -1.26 -3.90 114.28 105.01 3e1f n THR 104 Ca -0.15 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.05 61.33 3e1f n THR 104 Cb 0.39 -1.69 0.02 0.00 -1.82 0.00 0.00 70.33 67.23 3e1f n THR 104 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3e1f n TYR 105 N 6.91 0.14 0.28 -1.42 4.01 -1.26 -4.86 117.16 120.96 3e1f n TYR 105 Ca 0.27 0.56 0.17 0.00 -0.16 0.00 0.00 57.90 58.73 3e1f n TYR 105 Cb 0.24 -2.08 0.62 0.00 -0.31 0.00 0.00 39.34 37.82 3e1f n TYR 105 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3e1f h PRO 106 N 0.95 0.00 -5.41 -0.72 0.13 -1.94 -3.45 132.00 121.56 3e1f h PRO 106 Ca -0.43 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.05 3e1f h PRO 106 Cb 1.38 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.41 3e1f h PRO 106 CO 0.53 0.00 -0.42 0.96 -0.23 0.00 0.00 178.00 178.83 3e1f s ILE 107 N -3.60 1.21 0.02 -3.56 -4.36 -1.26 -5.01 121.20 104.64 3e1f s ILE 107 Ca 0.02 -1.81 -0.30 0.00 -0.26 0.00 0.00 60.65 58.29 3e1f s ILE 107 Cb 0.09 -2.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.74 3e1f s ILE 107 CO 0.55 0.00 0.99 -0.89 0.24 0.00 0.00 174.94 175.83 3e1f s THR 108 N -2.87 4.77 -0.59 8.37 2.01 -1.26 -4.97 115.64 121.10 3e1f s THR 108 Ca 0.12 2.03 -0.27 0.00 0.31 0.00 0.00 61.69 63.87 3e1f s THR 108 Cb -0.01 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.21 3e1f s THR 108 CO 0.08 0.18 1.53 -0.69 -0.69 0.00 0.00 174.62 175.03 3e1f s VAL 109 N 0.87 3.64 -0.47 3.82 1.01 -1.26 -4.77 120.40 123.24 3e1f s VAL 109 Ca 0.52 0.49 0.06 0.00 0.00 0.00 0.00 61.98 63.05 3e1f s VAL 109 Cb -0.22 -4.35 0.26 0.00 0.00 0.00 0.00 36.38 32.08 3e1f s VAL 109 CO 0.28 -1.18 0.97 -3.20 0.00 0.00 0.00 175.10 171.98 3e1f n ASN 110 N 10.40 -2.68 -4.72 3.32 5.15 -1.26 -5.12 115.26 120.34 3e1f n ASN 110 Ca 0.13 -3.36 -0.41 0.00 -0.60 0.00 0.00 54.58 50.34 3e1f n ASN 110 Cb 0.50 1.82 0.00 0.00 -0.53 0.00 0.00 39.78 41.58 3e1f n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3e1f n PRO 111 N 1.27 2.19 -0.82 1.20 -0.04 -1.26 -0.63 135.00 136.91 3e1f n PRO 111 Ca 0.08 0.77 0.05 0.00 -0.04 0.00 0.00 63.50 64.36 3e1f n PRO 111 Cb 0.65 -2.45 0.35 0.00 -0.04 0.00 0.00 33.50 32.01 3e1f n PRO 111 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3e1f n PRO 112 N 0.28 4.39 -2.88 0.54 -0.04 -1.26 -5.11 135.00 130.92 3e1f n PRO 112 Ca 0.05 -2.80 -0.38 0.00 -0.04 0.00 0.00 63.50 60.32 3e1f n PRO 112 Cb 0.38 -2.18 -0.06 0.00 -0.04 0.00 0.00 33.50 31.60 3e1f n PRO 112 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3e1f s PHE 113 N -2.59 3.77 0.33 0.54 0.08 0.20 -4.29 117.98 116.02 3e1f s PHE 113 Ca 0.49 1.70 0.10 0.00 0.12 0.00 0.00 56.93 59.33 3e1f s PHE 113 Cb 0.37 -2.84 -0.06 0.00 -0.57 0.00 0.00 43.02 39.92 3e1f s PHE 113 CO 0.14 0.33 -0.10 0.14 -0.10 0.00 0.00 175.22 175.63 3e1f s VAL 114 N -1.44 2.36 0.39 -0.44 -7.23 -1.26 -4.54 120.40 108.23 3e1f s VAL 114 Ca 0.45 -2.22 -0.25 0.00 -1.81 0.00 0.00 61.98 58.15 3e1f s VAL 114 Cb -0.20 -2.60 -0.12 0.00 0.56 0.00 0.00 36.38 34.02 3e1f s VAL 114 CO 0.25 -0.24 0.91 -2.65 -0.31 0.00 0.00 175.10 173.05 3e1f n PRO 115 N -0.78 1.16 0.03 4.82 -0.02 -1.26 -4.88 135.00 134.07 3e1f n PRO 115 Ca -0.05 0.41 -0.03 0.00 -2.02 0.00 0.00 63.50 61.82 3e1f n PRO 115 Cb 0.63 -1.87 0.22 0.00 -0.02 0.00 0.00 33.50 32.46 3e1f n PRO 115 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3e1f h THR 116 N 1.47 1.26 -2.17 3.45 1.35 -1.99 -3.29 112.91 112.99 3e1f h THR 116 Ca -0.42 -1.22 -0.69 0.00 -0.55 0.00 0.00 66.41 63.54 3e1f h THR 116 Cb 1.35 1.33 -0.16 0.00 -1.73 0.00 0.00 68.15 68.94 3e1f h THR 116 CO 0.57 0.39 1.03 -1.61 -0.25 0.00 0.00 175.52 175.64 3e1f s GLU 117 N -4.52 3.68 -0.38 4.72 2.02 -1.26 -4.76 118.70 118.20 3e1f s GLU 117 Ca -0.07 -1.81 -0.06 0.00 0.02 0.00 0.00 54.97 53.06 3e1f s GLU 117 Cb 0.14 -5.01 0.07 0.00 0.10 0.00 0.00 34.13 29.43 3e1f s GLU 117 CO 0.78 -1.84 0.17 1.21 0.02 0.00 0.00 175.26 175.61 3e1f s ASN 118 N 3.70 5.37 -0.32 -0.19 3.84 -0.77 -4.94 114.94 121.64 3e1f s ASN 118 Ca 0.36 -1.49 -0.37 0.00 0.21 0.00 0.00 52.86 51.57 3e1f s ASN 118 Cb -0.04 -1.88 -0.13 0.00 -0.55 0.00 0.00 41.25 38.65 3e1f s ASN 118 CO -0.08 -0.45 2.02 -2.65 -2.79 0.00 0.00 177.10 173.16 3e1f n PRO 119 N 4.78 1.11 -4.01 0.43 -0.02 -1.25 -3.27 135.00 132.77 3e1f n PRO 119 Ca -0.09 0.35 -0.35 0.00 -2.02 0.00 0.00 63.50 61.39 3e1f n PRO 119 Cb 0.43 -2.29 -0.13 0.00 -0.02 0.00 0.00 33.50 31.49 3e1f n PRO 119 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3e1f s THR 120 N 5.78 3.89 -0.27 3.45 2.01 -0.44 -1.24 115.64 128.83 3e1f s THR 120 Ca 1.06 -0.33 -0.12 0.00 0.31 0.00 0.00 61.69 62.61 3e1f s THR 120 Cb -0.96 -2.77 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 3e1f s THR 120 CO 0.56 0.42 0.21 -0.83 -0.69 0.00 0.00 174.62 174.29 3e1f s GLY 121 N 1.15 1.94 -0.51 4.40 0.00 0.10 -1.32 107.32 113.08 3e1f s GLY 121 Ca 0.03 -1.00 -0.16 0.00 0.00 0.00 0.00 44.72 43.58 3e1f s GLY 121 CO 0.01 0.65 0.49 0.00 0.00 0.00 0.00 173.10 174.25 3e1f s TYR 123 N 1.85 3.47 0.03 0.00 1.51 -0.33 -1.93 117.35 121.95 3e1f s TYR 123 Ca 0.06 0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 56.52 3e1f s TYR 123 Cb -0.26 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.63 3e1f s TYR 123 CO 0.06 0.61 -0.02 -1.54 -1.11 0.00 0.00 175.55 173.54 3e1f s SER 124 N -0.78 0.32 -0.16 2.29 1.04 0.58 0.34 113.70 117.33 3e1f s SER 124 Ca 0.13 -0.67 -0.08 0.00 0.48 0.00 0.00 55.95 55.81 3e1f s SER 124 Cb -0.12 0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.21 3e1f s SER 124 CO 0.03 -0.41 0.38 -0.22 0.98 0.00 0.00 173.24 174.00 3e1f s LEU 125 N -1.99 -0.13 -0.22 2.42 2.96 -0.55 -0.66 118.68 120.51 3e1f s LEU 125 Ca -0.08 0.84 -0.08 0.00 -0.22 0.00 0.00 54.13 54.60 3e1f s LEU 125 Cb -0.03 1.22 -0.04 0.00 0.50 0.00 0.00 46.19 47.84 3e1f s LEU 125 CO -0.04 -0.20 0.08 -0.89 -1.32 0.00 0.00 176.35 173.98 3e1f s THR 126 N 1.65 4.58 0.18 3.68 2.01 -1.26 -0.37 115.64 126.12 3e1f s THR 126 Ca -0.08 -0.09 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 3e1f s THR 126 Cb -0.10 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.30 3e1f s THR 126 CO -0.12 0.38 0.37 0.72 -0.69 0.00 0.00 174.62 175.28 3e1f s PHE 127 N 1.14 0.25 0.19 4.92 -0.71 -0.55 -4.96 117.98 118.25 3e1f s PHE 127 Ca 0.05 -0.61 0.11 0.00 -1.04 0.00 0.00 56.93 55.44 3e1f s PHE 127 Cb -0.14 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 3e1f s PHE 127 CO 0.03 -0.81 -0.22 0.54 -1.34 0.00 0.00 175.22 173.42 3e1f s ASN 128 N -2.95 3.27 -0.10 1.98 2.20 -1.26 -0.01 114.94 118.07 3e1f s ASN 128 Ca 0.15 -0.88 0.01 0.00 -0.94 0.00 0.00 52.86 51.21 3e1f s ASN 128 Cb 0.02 -0.23 -0.02 0.00 -2.00 0.00 0.00 41.25 39.01 3e1f s ASN 128 CO 0.00 0.08 -0.11 -0.69 -2.94 0.00 0.00 177.10 173.44 3e1f s VAL 129 N -1.81 3.24 0.45 3.54 1.01 -0.98 -4.92 120.40 120.94 3e1f s VAL 129 Ca 0.20 -0.62 -0.25 0.00 0.00 0.00 0.00 61.98 61.32 3e1f s VAL 129 Cb -0.07 -2.34 -0.09 0.00 0.00 0.00 0.00 36.38 33.88 3e1f s VAL 129 CO 0.09 0.55 1.29 0.47 0.00 0.00 0.00 175.10 177.51 3e1f n ASP 130 N 3.00 2.60 0.24 3.32 8.00 -1.26 -2.51 116.55 129.95 3e1f n ASP 130 Ca -0.18 1.08 0.09 0.00 0.71 0.00 0.00 54.79 56.49 3e1f n ASP 130 Cb 0.53 -1.52 0.63 0.00 -0.02 0.00 0.00 41.12 40.73 3e1f n ASP 130 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3e1f h GLU 131 N 1.95 0.00 0.00 -1.24 4.81 -1.96 -2.51 114.58 115.63 3e1f h GLU 131 Ca -0.49 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.71 3e1f h GLU 131 Cb 1.30 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 3e1f h GLU 131 CO 0.59 0.15 -0.15 0.66 -0.73 0.00 0.00 179.01 179.54 3e1f h SER 132 N 0.00 0.00 1.24 1.04 4.64 -2.00 -2.41 113.55 116.07 3e1f h SER 132 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3e1f h SER 132 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 3e1f h SER 132 CO 0.02 0.15 -0.34 -0.50 -0.87 0.00 0.00 176.83 175.28 3e1f h TRP 133 N 0.00 0.00 -0.02 4.77 4.06 -1.75 -3.17 115.95 119.84 3e1f h TRP 133 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3e1f h TRP 133 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 3e1f h TRP 133 CO 0.00 0.34 -0.33 1.28 -3.56 0.00 0.00 178.44 176.17 3e1f n LEU 134 N -3.31 2.13 0.05 -4.49 4.77 -0.93 -4.08 117.00 111.14 3e1f n LEU 134 Ca 0.01 -0.75 0.12 0.00 -0.03 0.00 0.00 56.01 55.36 3e1f n LEU 134 Cb 0.58 -0.01 0.20 0.00 -2.33 0.00 0.00 43.42 41.86 3e1f n LEU 134 CO 0.37 0.38 0.40 0.00 -1.33 0.00 0.00 177.39 177.21 3e1f n GLN 135 N 0.24 0.25 -3.73 3.23 6.02 -1.06 -4.96 117.38 117.37 3e1f n GLN 135 Ca 0.11 0.08 -0.06 0.00 -0.01 0.00 0.00 57.00 57.11 3e1f n GLN 135 Cb 0.48 -1.66 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 3e1f n GLN 135 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3e1f s GLU 136 N -3.14 1.40 2.00 -1.09 -1.05 -1.25 -5.12 118.70 110.44 3e1f s GLU 136 Ca 0.07 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 3e1f s GLU 136 Cb 0.14 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.34 3e1f s GLU 136 CO 0.71 -0.63 0.00 0.41 0.95 0.00 0.00 175.26 176.69 3e1f n GLY 137 N -0.43 -0.39 3.53 -3.83 0.00 -1.26 -4.79 105.19 98.02 3e1f n GLY 137 Ca -0.07 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 3e1f n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3e1f s GLN 138 N 0.00 3.48 -0.23 1.61 0.74 0.17 -4.82 119.66 120.61 3e1f s GLN 138 Ca 0.00 -0.51 -0.00 0.00 0.05 0.00 0.00 55.36 54.90 3e1f s GLN 138 Cb 0.00 -2.86 0.03 0.00 1.10 0.00 0.00 33.01 31.27 3e1f s GLN 138 CO 0.00 0.35 -0.10 0.99 -0.55 0.00 0.00 175.29 175.98 3e1f s THR 139 N 0.06 2.58 0.24 -0.34 2.01 -1.26 -0.15 115.64 118.78 3e1f s THR 139 Ca 0.00 -1.05 0.10 0.00 0.31 0.00 0.00 61.69 61.04 3e1f s THR 139 Cb -0.13 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.05 3e1f s THR 139 CO 0.03 0.27 -0.17 0.00 -0.69 0.00 0.00 174.62 174.06 3e1f s ARG 140 N 1.29 1.48 -0.02 4.92 1.70 -0.00 -0.89 118.95 127.43 3e1f s ARG 140 Ca 0.01 -1.67 0.04 0.00 -0.47 0.00 0.00 55.73 53.64 3e1f s ARG 140 Cb -0.16 -1.41 -0.03 0.00 -0.57 0.00 0.00 34.95 32.78 3e1f s ARG 140 CO -0.07 0.25 -0.12 -1.50 -1.08 0.00 0.00 175.30 172.78 3e1f s ILE 141 N -2.76 3.23 -0.18 4.99 2.07 -0.13 -1.27 121.20 127.14 3e1f s ILE 141 Ca 0.26 -0.79 0.01 0.00 -1.41 0.00 0.00 60.65 58.71 3e1f s ILE 141 Cb -0.03 -2.32 0.04 0.00 0.13 0.00 0.00 42.46 40.28 3e1f s ILE 141 CO 0.10 0.50 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.90 3e1f s ILE 142 N -0.84 1.54 -0.49 2.00 1.01 0.91 -2.04 121.20 123.29 3e1f s ILE 142 Ca 0.14 -0.88 -0.15 0.00 0.00 0.00 0.00 60.65 59.76 3e1f s ILE 142 Cb -0.11 -1.60 0.09 0.00 0.01 0.00 0.00 42.46 40.85 3e1f s ILE 142 CO 0.03 0.21 0.41 -0.36 0.00 0.00 0.00 174.94 175.23 3e1f s PHE 143 N 1.45 3.26 0.24 3.97 0.40 -0.38 -0.14 117.98 126.78 3e1f s PHE 143 Ca 0.00 -1.14 0.36 0.00 -0.60 0.00 0.00 56.93 55.55 3e1f s PHE 143 Cb -0.15 -3.36 1.71 0.00 0.51 0.00 0.00 43.02 41.72 3e1f s PHE 143 CO -0.08 -0.88 2.08 -0.44 0.70 0.00 0.00 175.22 176.60 3e1f h ASP 144 N 8.75 0.00 -0.63 1.36 3.32 -1.40 -0.11 116.42 127.70 3e1f h ASP 144 Ca -0.28 0.00 0.20 0.00 0.02 0.00 0.00 57.03 56.97 3e1f h ASP 144 Cb 1.10 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.42 3e1f h ASP 144 CO 0.92 0.00 0.18 -0.83 -1.72 0.00 0.00 179.24 177.79 3e1f s GLY 145 N -4.07 -0.27 -0.12 2.75 0.00 -1.26 -3.50 107.32 100.86 3e1f s GLY 145 Ca -0.01 2.90 -0.01 0.00 0.00 0.00 0.00 44.72 47.61 3e1f s GLY 145 CO 0.46 3.51 -0.06 0.14 0.00 0.00 0.00 173.10 177.15 3e1f s VAL 146 N 2.66 0.95 -0.31 1.40 1.01 -1.25 -1.90 120.40 122.96 3e1f s VAL 146 Ca -0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.58 3e1f s VAL 146 Cb -0.08 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 3e1f s VAL 146 CO -0.15 0.31 0.17 0.21 0.00 0.00 0.00 175.10 175.65 3e1f s ASN 147 N 1.73 5.73 -0.00 3.32 3.84 0.04 -3.87 114.94 125.73 3e1f s ASN 147 Ca 0.04 -0.38 0.02 0.00 0.21 0.00 0.00 52.86 52.76 3e1f s ASN 147 Cb -0.13 -2.05 -0.03 0.00 -0.55 0.00 0.00 41.25 38.49 3e1f s ASN 147 CO -0.08 -0.17 0.09 -1.54 -2.79 0.00 0.00 177.10 172.62 3e1f n SER 148 N 5.02 0.54 -3.51 -4.21 3.41 -0.85 -0.58 113.62 113.45 3e1f n SER 148 Ca -0.14 -0.50 -0.13 0.00 -0.26 0.00 0.00 58.87 57.85 3e1f n SER 148 Cb 0.50 1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 65.42 3e1f n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3e1f s ALA 149 N -1.31 -1.42 0.00 7.33 0.00 -1.16 -3.46 121.76 121.73 3e1f s ALA 149 Ca 0.01 0.49 -0.28 0.00 0.00 0.00 0.00 51.96 52.18 3e1f s ALA 149 Cb 0.02 0.65 0.10 0.00 0.00 0.00 0.00 23.12 23.89 3e1f s ALA 149 CO 0.09 -0.65 0.84 -0.59 0.00 0.00 0.00 175.76 175.46 3e1f s PHE 150 N -3.22 -0.40 -0.01 0.00 -0.71 -0.74 -0.51 117.98 112.39 3e1f s PHE 150 Ca -0.01 0.34 0.05 0.00 -1.04 0.00 0.00 56.93 56.27 3e1f s PHE 150 Cb -0.00 0.52 -0.03 0.00 -1.21 0.00 0.00 43.02 42.30 3e1f s PHE 150 CO -0.08 -0.57 -0.13 -1.01 -1.34 0.00 0.00 175.22 172.08 3e1f s HIS 151 N -2.85 2.71 -0.06 3.49 3.76 0.02 -1.77 115.29 120.58 3e1f s HIS 151 Ca 0.02 -0.16 0.05 0.00 -0.15 0.00 0.00 55.06 54.83 3e1f s HIS 151 Cb -0.01 -1.57 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 3e1f s HIS 151 CO -0.07 0.25 -0.23 -1.17 -0.85 0.00 0.00 174.74 172.67 3e1f s LEU 152 N -1.12 2.04 -0.01 0.89 2.96 -0.54 -1.11 118.68 121.80 3e1f s LEU 152 Ca 0.14 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 3e1f s LEU 152 Cb -0.11 -1.31 -0.01 0.00 0.50 0.00 0.00 46.19 45.26 3e1f s LEU 152 CO 0.04 0.21 -0.17 0.26 -1.32 0.00 0.00 176.35 175.37 3e1f s TRP 153 N -0.02 1.52 -0.21 5.38 0.51 0.70 0.14 118.94 126.96 3e1f s TRP 153 Ca -0.07 -0.30 0.00 0.00 -2.12 0.00 0.00 56.10 53.62 3e1f s TRP 153 Cb -0.14 -0.97 0.05 0.00 -0.81 0.00 0.00 33.47 31.60 3e1f s TRP 153 CO 0.04 -0.01 -0.06 0.00 -0.51 0.00 0.00 176.95 176.42 3e1f n ASN 155 N 4.74 -4.68 0.00 0.00 3.02 0.36 -2.70 115.26 115.99 3e1f n ASN 155 Ca -0.12 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 3e1f n ASN 155 Cb 0.45 -4.85 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 3e1f n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3e1f n GLY 156 N -1.20 1.31 3.76 7.41 0.00 -1.16 -4.94 105.19 110.38 3e1f n GLY 156 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 3e1f n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3e1f s ARG 157 N 0.00 4.69 0.11 1.61 0.52 -1.10 -4.89 118.95 119.89 3e1f s ARG 157 Ca 0.00 1.30 -0.30 0.00 -0.52 0.00 0.00 55.73 56.21 3e1f s ARG 157 Cb 0.00 -3.28 -0.06 0.00 0.52 0.00 0.00 34.95 32.13 3e1f s ARG 157 CO 0.00 0.53 1.13 -0.46 0.02 0.00 0.00 175.30 176.51 3e1f s TRP 158 N -1.07 3.54 -0.18 -0.53 -0.00 -1.26 0.17 118.94 119.60 3e1f s TRP 158 Ca 0.38 1.49 -0.16 0.00 -0.00 0.00 0.00 56.10 57.81 3e1f s TRP 158 Cb -0.24 -3.32 -0.06 0.00 -0.00 0.00 0.00 33.47 29.84 3e1f s TRP 158 CO 0.29 -0.82 -0.32 0.28 -0.00 0.00 0.00 176.95 176.37 3e1f n VAL 159 N 3.18 1.47 -3.37 5.86 0.31 0.12 -4.89 118.33 121.00 3e1f n VAL 159 Ca 0.06 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 3e1f n VAL 159 Cb 0.47 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 3e1f n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3e1f n GLY 160 N 1.58 1.20 3.03 2.92 0.00 -1.15 -4.76 105.19 108.02 3e1f n GLY 160 Ca -0.19 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 3e1f n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3e1f s TYR 161 N -4.54 0.40 -0.06 1.61 5.04 -0.28 -1.46 117.35 118.06 3e1f s TYR 161 Ca 0.00 -0.75 -0.22 0.00 -2.44 0.00 0.00 57.07 53.66 3e1f s TYR 161 Cb 0.00 -0.29 0.05 0.00 0.35 0.00 0.00 41.96 42.07 3e1f s TYR 161 CO 0.00 -0.25 0.50 0.20 -1.34 0.00 0.00 175.55 174.66 3e1f s GLY 162 N -2.08 -0.37 0.24 8.97 0.00 -0.73 -0.80 107.32 112.56 3e1f s GLY 162 Ca -0.06 0.95 0.02 0.00 0.00 0.00 0.00 44.72 45.63 3e1f s GLY 162 CO -0.04 0.68 0.06 1.20 0.00 0.00 0.00 173.10 174.99 3e1f s GLN 163 N -0.96 1.36 0.00 2.90 -0.21 -0.51 -1.80 119.66 120.44 3e1f s GLN 163 Ca -0.10 -1.72 0.00 0.00 0.02 0.00 0.00 55.36 53.56 3e1f s GLN 163 Cb -0.03 -0.37 0.00 0.00 1.00 0.00 0.00 33.01 33.61 3e1f s GLN 163 CO 0.06 -0.22 0.00 -3.47 -2.12 0.00 0.00 175.29 169.54 3e1f n ASP 164 N -0.43 -1.00 0.13 5.90 -0.08 -1.22 -4.93 116.55 114.91 3e1f n ASP 164 Ca -0.02 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.33 3e1f n ASP 164 Cb 0.65 -0.50 0.37 0.00 2.34 0.00 0.00 41.12 43.98 3e1f n ASP 164 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3e1f n SER 165 N -0.07 0.35 -0.49 1.67 7.64 -1.25 -3.03 113.62 118.44 3e1f n SER 165 Ca 0.00 0.60 0.06 0.00 1.01 0.00 0.00 58.87 60.54 3e1f n SER 165 Cb 0.00 -0.60 0.05 0.00 -1.01 0.00 0.00 64.21 62.65 3e1f n SER 165 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3e1f n ARG 166 N -1.99 0.90 -4.33 1.43 5.12 -1.26 -3.97 116.66 112.57 3e1f n ARG 166 Ca -0.01 -1.21 -0.25 0.00 -1.93 0.00 0.00 57.85 54.45 3e1f n ARG 166 Cb 0.17 -1.24 -0.12 0.00 -1.16 0.00 0.00 32.46 30.11 3e1f n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3e1f s LEU 167 N -1.14 2.35 0.36 0.55 1.43 -1.17 -4.56 118.68 116.50 3e1f s LEU 167 Ca 0.15 -0.75 -0.28 0.00 -1.03 0.00 0.00 54.13 52.22 3e1f s LEU 167 Cb 0.11 -0.96 -0.10 0.00 0.03 0.00 0.00 46.19 45.28 3e1f s LEU 167 CO 0.18 0.06 1.26 -2.16 0.23 0.00 0.00 176.35 175.92 3e1f s PRO 168 N -2.21 4.24 -0.16 1.29 0.04 -1.23 -4.56 135.00 132.41 3e1f s PRO 168 Ca 0.11 2.10 -0.01 0.00 0.04 0.00 0.00 61.00 63.24 3e1f s PRO 168 Cb -0.09 -2.94 -0.01 0.00 0.04 0.00 0.00 34.50 31.50 3e1f s PRO 168 CO 0.06 -0.24 -0.11 -1.12 0.04 0.00 0.00 177.00 175.62 3e1f s SER 169 N -0.69 3.99 -0.06 6.66 0.01 -0.05 -4.95 113.70 118.60 3e1f s SER 169 Ca 0.52 -0.39 0.06 0.00 1.31 0.00 0.00 55.95 57.45 3e1f s SER 169 Cb -0.37 -1.63 -0.01 0.00 0.21 0.00 0.00 66.02 64.21 3e1f s SER 169 CO 0.48 0.09 -0.23 -1.61 0.41 0.00 0.00 173.24 172.38 3e1f s GLU 170 N 0.81 2.59 0.01 12.44 2.02 -1.26 -1.24 118.70 134.07 3e1f s GLU 170 Ca -0.04 -0.87 0.04 0.00 0.02 0.00 0.00 54.97 54.11 3e1f s GLU 170 Cb -0.15 -2.21 -0.01 0.00 0.10 0.00 0.00 34.13 31.85 3e1f s GLU 170 CO 0.01 0.40 -0.12 -0.06 0.02 0.00 0.00 175.26 175.51 3e1f s PHE 171 N -0.19 1.03 -0.50 1.61 0.40 -0.86 0.71 117.98 120.18 3e1f s PHE 171 Ca -0.02 -0.27 -0.26 0.00 -0.60 0.00 0.00 56.93 55.78 3e1f s PHE 171 Cb -0.14 -0.63 0.03 0.00 0.51 0.00 0.00 43.02 42.79 3e1f s PHE 171 CO 0.03 -0.00 0.99 0.34 0.70 0.00 0.00 175.22 177.28 3e1f s ASP 172 N -0.70 6.48 0.00 1.36 -1.08 -1.26 -0.96 116.67 120.51 3e1f s ASP 172 Ca 0.02 0.07 0.26 0.00 -0.52 0.00 0.00 52.55 52.37 3e1f s ASP 172 Cb -0.06 -2.47 0.60 0.00 -1.46 0.00 0.00 42.92 39.53 3e1f s ASP 172 CO 0.00 -1.16 1.47 0.18 0.52 0.00 0.00 175.17 176.18 3e1f n LEU 173 N 7.46 1.37 -0.27 -1.34 4.77 -0.07 -4.58 117.00 124.35 3e1f n LEU 173 Ca 0.06 -0.43 0.04 0.00 -0.03 0.00 0.00 56.01 55.66 3e1f n LEU 173 Cb 0.48 -0.08 0.10 0.00 -2.33 0.00 0.00 43.42 41.60 3e1f n LEU 173 CO 0.66 0.25 0.49 -1.20 -1.33 0.00 0.00 177.39 176.26 3e1f n SER 174 N -0.35 -0.27 -0.53 -1.43 7.64 -0.67 0.60 113.62 118.62 3e1f n SER 174 Ca 0.12 1.27 0.04 0.00 1.01 0.00 0.00 58.87 61.31 3e1f n SER 174 Cb 0.38 -0.38 0.12 0.00 -1.01 0.00 0.00 64.21 63.32 3e1f n SER 174 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3e1f n ALA 175 N -3.73 2.49 -0.01 -0.43 0.00 -1.26 -3.86 120.51 113.70 3e1f n ALA 175 Ca 0.12 -0.49 -0.00 0.00 0.00 0.00 0.00 53.44 53.07 3e1f n ALA 175 Cb 0.37 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.80 3e1f n ALA 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3e1f n PHE 176 N 0.29 0.00 -2.62 0.00 3.01 0.20 -5.04 117.46 113.29 3e1f n PHE 176 Ca 0.09 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.23 3e1f n PHE 176 Cb 0.25 -0.19 -0.05 0.00 -0.01 0.00 0.00 39.48 39.49 3e1f n PHE 176 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3e1f s LEU 177 N -3.95 3.77 0.10 4.37 1.43 -0.94 -4.77 118.68 118.69 3e1f s LEU 177 Ca -0.02 1.53 0.05 0.00 -1.03 0.00 0.00 54.13 54.66 3e1f s LEU 177 Cb 0.02 -4.43 -0.04 0.00 0.03 0.00 0.00 46.19 41.78 3e1f s LEU 177 CO 0.20 -0.47 -0.12 0.00 0.23 0.00 0.00 176.35 176.19 3e1f s ARG 178 N -3.71 0.89 0.25 1.70 1.70 -1.26 -5.02 118.95 113.50 3e1f s ARG 178 Ca 0.59 -1.15 -0.30 0.00 -0.47 0.00 0.00 55.73 54.39 3e1f s ARG 178 Cb -0.10 -0.68 -0.11 0.00 -0.57 0.00 0.00 34.95 33.49 3e1f s ARG 178 CO 0.25 0.12 1.57 0.00 -1.08 0.00 0.00 175.30 176.16 3e1f s ALA 179 N -2.17 3.74 0.00 7.88 0.00 -1.26 -4.51 121.76 125.44 3e1f s ALA 179 Ca 0.05 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.49 3e1f s ALA 179 Cb -0.05 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3e1f s ALA 179 CO 0.01 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.30 3e1f n GLY 180 N 2.63 -0.62 3.64 0.00 0.00 -1.04 -4.92 105.19 104.87 3e1f n GLY 180 Ca 0.10 -1.72 -0.44 0.00 0.00 0.00 0.00 46.02 43.95 3e1f n GLY 180 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3e1f n GLU 181 N 0.00 1.74 -3.88 1.61 1.02 -1.26 -2.31 120.64 117.55 3e1f n GLU 181 Ca 0.00 0.61 -0.10 0.00 -0.02 0.00 0.00 57.16 57.65 3e1f n GLU 181 Cb 0.00 -2.11 -0.09 0.00 -0.02 0.00 0.00 31.44 29.22 3e1f n GLU 181 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3e1f s ASN 182 N -0.30 0.09 -0.04 1.62 0.01 0.99 -4.77 114.94 112.55 3e1f s ASN 182 Ca 0.60 -0.42 0.02 0.00 -0.71 0.00 0.00 52.86 52.34 3e1f s ASN 182 Cb -0.65 0.25 0.01 0.00 0.41 0.00 0.00 41.25 41.28 3e1f s ASN 182 CO 0.59 -0.52 -0.07 -0.60 -1.51 0.00 0.00 177.10 174.99 3e1f s ARG 183 N -2.47 0.96 -0.12 -0.60 3.52 -1.26 -1.49 118.95 117.49 3e1f s ARG 183 Ca -0.06 -0.21 -0.05 0.00 -0.13 0.00 0.00 55.73 55.28 3e1f s ARG 183 Cb -0.02 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.43 3e1f s ARG 183 CO -0.04 0.00 0.07 -0.51 -0.81 0.00 0.00 175.30 174.02 3e1f s LEU 184 N 0.60 3.95 -0.17 -0.88 1.43 0.50 -0.49 118.68 123.62 3e1f s LEU 184 Ca -0.09 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 3e1f s LEU 184 Cb -0.12 -1.95 0.03 0.00 0.03 0.00 0.00 46.19 44.18 3e1f s LEU 184 CO 0.01 0.34 -0.12 0.00 0.23 0.00 0.00 176.35 176.81 3e1f s ALA 185 N -0.64 1.94 -0.26 4.21 0.00 0.08 -1.48 121.76 125.61 3e1f s ALA 185 Ca 0.12 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 51.03 3e1f s ALA 185 Cb -0.12 -1.17 0.07 0.00 0.00 0.00 0.00 23.12 21.90 3e1f s ALA 185 CO 0.02 -0.60 -0.06 0.08 0.00 0.00 0.00 175.76 175.20 3e1f s VAL 186 N 1.44 1.86 -0.40 0.00 1.01 0.15 -0.21 120.40 124.25 3e1f s VAL 186 Ca 0.02 -1.54 -0.19 0.00 0.00 0.00 0.00 61.98 60.28 3e1f s VAL 186 Cb -0.15 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.15 3e1f s VAL 186 CO -0.09 -0.15 0.53 -0.32 0.00 0.00 0.00 175.10 175.07 3e1f s MET 187 N 1.22 3.38 -0.26 2.72 1.75 -0.26 -1.18 119.30 126.67 3e1f s MET 187 Ca -0.05 -0.38 -0.08 0.00 -1.25 0.00 0.00 55.69 53.93 3e1f s MET 187 Cb -0.19 -3.89 -0.03 0.00 2.84 0.00 0.00 34.83 33.55 3e1f s MET 187 CO -0.07 -0.81 0.10 0.08 -0.65 0.00 0.00 175.02 173.68 3e1f s VAL 188 N 2.46 4.56 -0.15 10.11 1.01 0.10 -0.80 120.40 137.68 3e1f s VAL 188 Ca 0.18 -0.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.87 3e1f s VAL 188 Cb -0.15 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 3e1f s VAL 188 CO 0.15 0.30 0.44 -0.76 0.00 0.00 0.00 175.10 175.23 3e1f s LEU 189 N 1.65 4.22 0.17 3.92 1.43 0.33 0.00 118.68 130.41 3e1f s LEU 189 Ca 0.06 0.69 -0.11 0.00 -1.03 0.00 0.00 54.13 53.74 3e1f s LEU 189 Cb -0.15 -2.61 0.07 0.00 0.03 0.00 0.00 46.19 43.52 3e1f s LEU 189 CO 0.05 -0.03 1.68 -0.09 0.23 0.00 0.00 176.35 178.20 3e1f h ARG 190 N 6.97 0.97 -6.55 1.70 2.43 -1.42 -2.24 114.38 116.24 3e1f h ARG 190 Ca -0.39 -0.23 -0.66 0.00 -0.81 0.00 0.00 59.98 57.89 3e1f h ARG 190 Cb 1.17 -0.13 -0.16 0.00 -0.42 0.00 0.00 29.97 30.44 3e1f h ARG 190 CO 0.75 0.89 -0.74 -1.58 -1.51 0.00 0.00 179.97 177.77 3e1f s TRP 191 N -5.31 2.70 0.12 2.20 0.23 -1.26 -3.94 118.94 113.69 3e1f s TRP 191 Ca -0.12 -0.18 -0.26 0.00 -2.03 0.00 0.00 56.10 53.51 3e1f s TRP 191 Cb 0.13 -1.40 0.07 0.00 0.03 0.00 0.00 33.47 32.31 3e1f s TRP 191 CO 0.82 0.44 1.01 -1.54 0.96 0.00 0.00 176.95 178.64 3e1f s SER 192 N -2.33 -0.17 0.59 2.95 1.04 -1.26 -4.87 113.70 109.65 3e1f s SER 192 Ca 0.22 -0.34 0.29 0.00 0.48 0.00 0.00 55.95 56.59 3e1f s SER 192 Cb -0.11 0.43 1.70 0.00 0.10 0.00 0.00 66.02 68.15 3e1f s SER 192 CO 0.14 -0.80 2.16 -2.24 0.98 0.00 0.00 173.24 173.48 3e1f h ASP 193 N 2.00 0.00 0.76 7.02 3.04 0.07 0.36 116.42 129.66 3e1f h ASP 193 Ca -0.25 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 3e1f h ASP 193 Cb 1.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 3e1f h ASP 193 CO 0.26 0.00 0.00 1.23 -2.04 0.00 0.00 179.24 178.69 3e1f h GLY 194 N 0.00 0.00 2.00 7.15 0.00 -1.91 -2.30 103.07 108.01 3e1f h GLY 194 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3e1f h GLY 194 CO -0.00 0.00 -0.04 1.76 0.00 0.00 0.00 176.54 178.26 3e1f h SER 195 N 0.00 0.00 0.74 0.19 0.02 -0.63 -1.91 113.55 111.96 3e1f h SER 195 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3e1f h SER 195 Cb 0.38 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 3e1f h SER 195 CO 0.00 0.04 -0.09 1.88 -1.14 0.00 0.00 176.83 177.52 3e1f h TYR 196 N 0.00 0.00 -0.03 3.45 0.05 -1.55 -2.10 116.97 116.78 3e1f h TYR 196 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3e1f h TYR 196 Cb 0.32 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.06 3e1f h TYR 196 CO 0.00 0.09 0.00 1.28 -1.05 0.00 0.00 178.16 178.48 3e1f n LEU 197 N -3.29 2.76 -2.72 3.88 4.77 -0.73 -4.44 117.00 117.22 3e1f n LEU 197 Ca -0.00 -1.01 -0.30 0.00 -0.03 0.00 0.00 56.01 54.67 3e1f n LEU 197 Cb 0.30 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3e1f n LEU 197 CO 0.29 0.47 0.47 -0.62 -1.33 0.00 0.00 177.39 176.67 3e1f n GLU 198 N 1.18 3.41 -1.93 3.23 1.02 -0.79 0.14 120.64 126.91 3e1f n GLU 198 Ca 0.12 -4.45 -0.39 0.00 -0.02 0.00 0.00 57.16 52.43 3e1f n GLU 198 Cb 0.53 -2.26 0.04 0.00 -0.02 0.00 0.00 31.44 29.72 3e1f n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3e1f n ASP 199 N -0.41 7.35 -4.80 1.62 2.03 -0.51 -4.97 116.55 116.87 3e1f n ASP 199 Ca 0.40 -3.83 -0.34 0.00 0.52 0.00 0.00 54.79 51.54 3e1f n ASP 199 Cb 0.51 -1.02 -0.06 0.00 -0.72 0.00 0.00 41.12 39.83 3e1f n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3e1f s GLN 200 N -4.03 4.16 -1.20 -0.67 1.11 -1.26 -4.61 119.66 113.16 3e1f s GLN 200 Ca 0.52 1.26 -0.21 0.00 0.01 0.00 0.00 55.36 56.95 3e1f s GLN 200 Cb 0.44 -2.29 -0.03 0.00 -1.01 0.00 0.00 33.01 30.12 3e1f s GLN 200 CO -0.38 -0.10 1.88 -3.47 0.01 0.00 0.00 175.29 173.23 3e1f n ASP 201 N -0.48 3.70 -3.39 5.90 2.03 -1.26 -4.82 116.55 118.23 3e1f n ASP 201 Ca 0.07 -2.78 -0.11 0.00 0.52 0.00 0.00 54.79 52.49 3e1f n ASP 201 Cb 0.53 -1.68 -0.02 0.00 -0.72 0.00 0.00 41.12 39.23 3e1f n ASP 201 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3e1f s MET 202 N 5.37 1.92 0.23 -0.67 0.23 -1.26 -4.95 119.30 120.17 3e1f s MET 202 Ca 0.61 -1.45 -0.30 0.00 -1.03 0.00 0.00 55.69 53.52 3e1f s MET 202 Cb 0.03 0.53 -0.10 0.00 -1.53 0.00 0.00 34.83 33.76 3e1f s MET 202 CO 0.10 -0.84 1.51 -1.58 -2.03 0.00 0.00 175.02 172.18 3e1f s TRP 203 N -3.14 2.98 -0.60 3.16 0.52 -1.26 -4.27 118.94 116.33 3e1f s TRP 203 Ca 0.21 0.85 -0.20 0.00 0.02 0.00 0.00 56.10 56.98 3e1f s TRP 203 Cb -0.03 -3.90 0.08 0.00 -1.15 0.00 0.00 33.47 28.47 3e1f s TRP 203 CO 0.13 -3.10 0.79 1.03 0.02 0.00 0.00 176.95 175.83 3e1f s ARG 204 N 0.07 3.09 0.00 4.98 1.81 0.35 -4.94 118.95 124.32 3e1f s ARG 204 Ca 0.63 -1.04 0.00 0.00 -1.72 0.00 0.00 55.73 53.60 3e1f s ARG 204 Cb -0.44 -4.22 0.00 0.00 -0.45 0.00 0.00 34.95 29.84 3e1f s ARG 204 CO 0.40 -1.58 0.00 -1.33 -0.68 0.00 0.00 175.30 172.11 3e1f n MET 205 N 6.81 3.97 0.00 3.54 2.81 -1.26 -2.82 117.12 130.18 3e1f n MET 205 Ca -0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 3e1f n MET 205 Cb 0.44 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.95 3e1f n MET 205 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3e1f n SER 206 N 0.00 0.00 0.00 7.83 3.41 -1.26 -4.84 113.62 118.76 3e1f n SER 206 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3e1f n SER 206 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3e1f n SER 206 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3e1f n GLY 207 N -0.21 -0.45 3.42 5.00 0.00 0.26 -2.98 105.19 110.23 3e1f n GLY 207 Ca 0.00 -2.22 -0.45 0.00 0.00 0.00 0.00 46.02 43.35 3e1f n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3e1f s ILE 208 N -0.01 5.09 -2.44 -0.61 1.01 -1.23 -0.78 121.20 122.22 3e1f s ILE 208 Ca 0.00 -2.15 0.23 0.00 0.00 0.00 0.00 60.65 58.73 3e1f s ILE 208 Cb 0.00 -4.73 0.44 0.00 0.01 0.00 0.00 42.46 38.18 3e1f s ILE 208 CO 0.00 -1.40 1.52 2.22 0.00 0.00 0.00 174.94 177.28 3e1f n PHE 209 N 5.49 0.21 -4.11 3.97 -1.74 -0.80 -0.52 117.46 119.96 3e1f n PHE 209 Ca 0.25 -0.10 -0.15 0.00 -0.56 0.00 0.00 57.45 56.89 3e1f n PHE 209 Cb 0.46 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.35 3e1f n PHE 209 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 3e1f s ARG 210 N -1.79 0.59 0.22 3.97 0.52 -1.09 -4.47 118.95 116.90 3e1f s ARG 210 Ca 0.34 -0.73 -0.15 0.00 -0.52 0.00 0.00 55.73 54.67 3e1f s ARG 210 Cb 0.19 -0.44 -0.10 0.00 0.52 0.00 0.00 34.95 35.12 3e1f s ARG 210 CO 0.29 0.09 0.14 -0.25 0.02 0.00 0.00 175.30 175.59 3e1f n ASP 211 N 1.62 -1.57 -4.28 0.23 8.00 -1.26 -4.04 116.55 115.25 3e1f n ASP 211 Ca -0.21 0.59 -0.33 0.00 0.71 0.00 0.00 54.79 55.55 3e1f n ASP 211 Cb 0.55 -0.59 -0.16 0.00 -0.02 0.00 0.00 41.12 40.90 3e1f n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3e1f s VAL 212 N -0.97 2.53 0.28 2.53 1.01 -1.26 -1.45 120.40 123.08 3e1f s VAL 212 Ca 0.40 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.57 3e1f s VAL 212 Cb -0.47 -2.03 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 3e1f s VAL 212 CO 0.40 0.54 0.03 -0.44 0.00 0.00 0.00 175.10 175.62 3e1f s SER 213 N 0.47 2.14 -0.15 3.32 0.01 0.80 -0.33 113.70 119.96 3e1f s SER 213 Ca -0.13 -1.31 -0.01 0.00 1.31 0.00 0.00 55.95 55.82 3e1f s SER 213 Cb -0.17 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.06 3e1f s SER 213 CO 0.05 -0.56 -0.04 -0.22 0.41 0.00 0.00 173.24 172.89 3e1f s LEU 214 N -3.41 1.37 -0.08 2.44 2.96 0.30 -0.06 118.68 122.20 3e1f s LEU 214 Ca 0.33 -0.56 0.04 0.00 -0.22 0.00 0.00 54.13 53.72 3e1f s LEU 214 Cb 0.07 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 45.94 3e1f s LEU 214 CO 0.13 -0.19 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.56 3e1f s LEU 215 N 1.71 2.47 -0.18 -0.68 2.96 -0.39 -0.88 118.68 123.68 3e1f s LEU 215 Ca 0.02 -0.36 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 3e1f s LEU 215 Cb -0.15 -1.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 3e1f s LEU 215 CO -0.07 0.25 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.86 3e1f s HIS 216 N -0.19 2.93 0.16 5.38 5.65 -0.31 -0.82 115.29 128.08 3e1f s HIS 216 Ca -0.01 -0.74 0.11 0.00 0.25 0.00 0.00 55.06 54.67 3e1f s HIS 216 Cb -0.13 -2.00 -0.04 0.00 -1.18 0.00 0.00 32.58 29.22 3e1f s HIS 216 CO 0.03 -0.36 -0.25 0.15 -0.65 0.00 0.00 174.74 173.67 3e1f s LYS 217 N 0.95 1.42 0.93 2.88 -0.14 0.79 -4.77 119.74 121.80 3e1f s LYS 217 Ca -0.01 -1.41 -0.11 0.00 -1.36 0.00 0.00 55.97 53.07 3e1f s LYS 217 Cb -0.15 -1.80 0.15 0.00 -1.68 0.00 0.00 37.83 34.35 3e1f s LYS 217 CO 0.00 0.41 1.09 -2.14 -0.76 0.00 0.00 175.35 173.95 3e1f s PRO 218 N -2.35 1.00 0.03 -1.68 0.02 -1.26 0.43 135.00 131.18 3e1f s PRO 218 Ca 0.16 0.95 -0.25 0.00 0.02 0.00 0.00 61.00 61.88 3e1f s PRO 218 Cb -0.09 -1.77 -0.18 0.00 0.02 0.00 0.00 34.50 32.49 3e1f s PRO 218 CO 0.08 -2.46 1.48 1.15 -0.33 0.00 0.00 177.00 176.92 3e1f h THR 219 N -1.71 1.08 -3.15 0.99 2.02 -1.93 -3.33 112.91 106.88 3e1f h THR 219 Ca -0.50 -0.54 -0.61 0.00 0.77 0.00 0.00 66.41 65.53 3e1f h THR 219 Cb 1.28 1.44 -0.12 0.00 -1.74 0.00 0.00 68.15 69.01 3e1f h THR 219 CO 0.52 0.13 0.58 -0.89 0.37 0.00 0.00 175.52 176.24 3e1f s THR 220 N -5.20 4.36 0.34 3.16 2.01 -1.26 -4.04 115.64 115.02 3e1f s THR 220 Ca -0.15 0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.14 3e1f s THR 220 Cb 0.04 -4.56 -0.04 0.00 0.01 0.00 0.00 72.50 67.94 3e1f s THR 220 CO 0.65 -1.15 0.10 0.00 -0.69 0.00 0.00 174.62 173.52 3e1f s GLN 221 N 4.01 1.71 -0.37 4.92 -2.07 -0.75 -4.92 119.66 122.19 3e1f s GLN 221 Ca 0.30 -1.99 -0.20 0.00 -1.82 0.00 0.00 55.36 51.66 3e1f s GLN 221 Cb -0.13 -0.61 0.00 0.00 -1.09 0.00 0.00 33.01 31.19 3e1f s GLN 221 CO 0.19 -0.34 0.60 0.42 -1.32 0.00 0.00 175.29 174.84 3e1f s ILE 222 N -3.37 4.92 -1.11 3.63 1.01 -1.26 -1.31 121.20 123.71 3e1f s ILE 222 Ca 0.32 0.43 0.22 0.00 0.00 0.00 0.00 60.65 61.62 3e1f s ILE 222 Cb 0.06 -4.07 -0.15 0.00 0.01 0.00 0.00 42.46 38.31 3e1f s ILE 222 CO 0.15 -0.33 1.03 -1.54 0.00 0.00 0.00 174.94 174.25 3e1f n SER 223 N 5.99 1.00 0.00 3.58 3.41 -0.11 -4.94 113.62 122.54 3e1f n SER 223 Ca -0.02 -0.90 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 3e1f n SER 223 Cb 0.49 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.22 3e1f n SER 223 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3e1f n ASP 224 N -1.35 0.00 -3.70 4.04 2.03 -1.12 -4.93 116.55 111.52 3e1f n ASP 224 Ca 0.05 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.24 3e1f n ASP 224 Cb 0.34 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.65 3e1f n ASP 224 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 3e1f s PHE 225 N -1.89 -0.59 -0.14 -0.67 -0.71 -1.26 -0.58 117.98 112.14 3e1f s PHE 225 Ca 0.00 1.35 0.01 0.00 -1.04 0.00 0.00 56.93 57.25 3e1f s PHE 225 Cb 0.00 0.24 -0.00 0.00 -1.21 0.00 0.00 43.02 42.05 3e1f s PHE 225 CO 0.00 -0.30 -0.16 -1.01 -1.34 0.00 0.00 175.22 172.41 3e1f s HIS 226 N 0.69 2.76 -0.19 3.49 3.76 -0.14 -4.83 115.29 120.84 3e1f s HIS 226 Ca -0.04 -0.95 -0.07 0.00 -0.15 0.00 0.00 55.06 53.86 3e1f s HIS 226 Cb -0.05 -1.85 -0.04 0.00 1.11 0.00 0.00 32.58 31.75 3e1f s HIS 226 CO -0.05 -0.40 0.06 0.08 -0.85 0.00 0.00 174.74 173.58 3e1f s VAL 227 N 0.64 4.67 0.05 -0.90 1.01 -1.26 -1.61 120.40 123.00 3e1f s VAL 227 Ca -0.09 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 61.87 3e1f s VAL 227 Cb -0.16 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 3e1f s VAL 227 CO 0.03 0.44 -0.13 0.00 0.00 0.00 0.00 175.10 175.44 3e1f s ALA 228 N 0.58 1.07 -0.14 5.51 0.00 0.28 -4.89 121.76 124.17 3e1f s ALA 228 Ca 0.03 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.09 3e1f s ALA 228 Cb -0.13 -0.11 0.05 0.00 0.00 0.00 0.00 23.12 22.92 3e1f s ALA 228 CO 0.01 0.16 0.04 0.95 0.00 0.00 0.00 175.76 176.93 3e1f s THR 229 N -1.07 0.29 -0.06 0.00 -4.23 -1.26 -0.29 115.64 109.02 3e1f s THR 229 Ca -0.01 -0.20 0.03 0.00 -1.18 0.00 0.00 61.69 60.33 3e1f s THR 229 Cb -0.09 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 73.01 3e1f s THR 229 CO 0.02 -0.06 -0.13 -0.13 -0.54 0.00 0.00 174.62 173.77 3e1f s ARG 230 N 1.98 2.61 0.41 3.99 0.52 -0.88 -4.82 118.95 122.75 3e1f s ARG 230 Ca 0.02 -0.68 0.07 0.00 -0.52 0.00 0.00 55.73 54.62 3e1f s ARG 230 Cb -0.15 -2.42 -0.08 0.00 0.52 0.00 0.00 34.95 32.82 3e1f s ARG 230 CO -0.07 0.59 0.03 -0.06 0.02 0.00 0.00 175.30 175.82 3e1f s PHE 231 N -0.64 2.53 0.81 -0.53 0.40 -1.26 -0.28 117.98 119.00 3e1f s PHE 231 Ca 0.10 -0.66 -0.08 0.00 -0.60 0.00 0.00 56.93 55.68 3e1f s PHE 231 Cb -0.11 -1.80 0.13 0.00 0.51 0.00 0.00 43.02 41.75 3e1f s PHE 231 CO 0.01 0.41 1.12 0.54 0.70 0.00 0.00 175.22 178.01 3e1f s ASN 232 N -3.74 4.03 0.44 1.36 2.20 -0.96 -4.92 114.94 113.35 3e1f s ASN 232 Ca 0.36 0.12 0.18 0.00 -0.94 0.00 0.00 52.86 52.58 3e1f s ASN 232 Cb 0.09 -0.46 1.11 0.00 -2.00 0.00 0.00 41.25 39.99 3e1f s ASN 232 CO 0.19 -2.11 1.92 -2.24 -2.94 0.00 0.00 177.10 171.92 3e1f h ASP 233 N -0.97 0.33 -0.53 3.54 3.04 -2.01 -2.14 116.42 117.69 3e1f h ASP 233 Ca -0.42 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 3e1f h ASP 233 Cb 1.27 -0.04 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 3e1f h ASP 233 CO 0.46 0.17 0.00 -0.90 -2.04 0.00 0.00 179.24 176.92 3e1f n ASP 234 N -4.46 4.20 -2.55 4.15 5.75 -1.26 -4.96 116.55 117.43 3e1f n ASP 234 Ca 0.14 -2.42 -0.18 0.00 -0.01 0.00 0.00 54.79 52.32 3e1f n ASP 234 Cb 0.57 -0.50 -0.00 0.00 -1.03 0.00 0.00 41.12 40.16 3e1f n ASP 234 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3e1f n PHE 235 N 0.76 -1.31 0.01 2.11 3.01 -0.81 -4.85 117.46 116.39 3e1f n PHE 235 Ca 0.22 0.09 -0.06 0.00 1.01 0.00 0.00 57.45 58.72 3e1f n PHE 235 Cb 0.78 -3.61 -0.12 0.00 -0.01 0.00 0.00 39.48 36.53 3e1f n PHE 235 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3e1f h SER 236 N -0.24 0.00 -3.94 4.37 4.64 -1.93 -3.40 113.55 113.05 3e1f h SER 236 Ca -0.43 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.41 3e1f h SER 236 Cb 1.32 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.22 3e1f h SER 236 CO 0.50 0.89 -0.78 -0.13 -0.87 0.00 0.00 176.83 176.45 3e1f s ARG 237 N -2.70 1.11 -0.06 4.77 0.52 -1.26 0.20 118.95 121.53 3e1f s ARG 237 Ca -0.03 -1.26 -0.18 0.00 -0.52 0.00 0.00 55.73 53.74 3e1f s ARG 237 Cb 0.08 -1.12 0.04 0.00 0.52 0.00 0.00 34.95 34.47 3e1f s ARG 237 CO 0.82 0.23 0.41 0.00 0.02 0.00 0.00 175.30 176.78 3e1f s ALA 238 N -1.87 -1.03 -0.18 2.13 0.00 -0.25 -2.27 121.76 118.28 3e1f s ALA 238 Ca 0.10 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.79 3e1f s ALA 238 Cb -0.06 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.93 3e1f s ALA 238 CO 0.04 -0.27 -0.16 0.08 0.00 0.00 0.00 175.76 175.45 3e1f s VAL 239 N -0.91 2.42 -0.19 0.00 1.01 0.62 -0.60 120.40 122.75 3e1f s VAL 239 Ca -0.10 -0.83 -0.17 0.00 0.00 0.00 0.00 61.98 60.88 3e1f s VAL 239 Cb -0.04 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 3e1f s VAL 239 CO 0.04 0.51 0.46 -0.22 0.00 0.00 0.00 175.10 175.90 3e1f s LEU 240 N 1.17 4.16 -0.18 3.92 0.20 0.65 -2.07 118.68 126.53 3e1f s LEU 240 Ca 0.02 0.62 -0.01 0.00 0.69 0.00 0.00 54.13 55.44 3e1f s LEU 240 Cb -0.14 -2.62 0.00 0.00 -0.43 0.00 0.00 46.19 43.00 3e1f s LEU 240 CO -0.07 -0.11 -0.13 -0.70 -0.29 0.00 0.00 176.35 175.04 3e1f s GLU 241 N 1.38 3.21 -0.25 1.98 2.12 0.60 -0.56 118.70 127.19 3e1f s GLU 241 Ca 0.22 -0.73 0.02 0.00 0.36 0.00 0.00 54.97 54.84 3e1f s GLU 241 Cb -0.15 -2.72 0.06 0.00 0.26 0.00 0.00 34.13 31.58 3e1f s GLU 241 CO 0.09 -0.09 -0.10 0.00 -0.54 0.00 0.00 175.26 174.62 3e1f s ALA 242 N 1.10 2.39 -0.20 6.30 0.00 0.65 -0.55 121.76 131.44 3e1f s ALA 242 Ca 0.00 -1.64 -0.18 0.00 0.00 0.00 0.00 51.96 50.14 3e1f s ALA 242 Cb -0.14 -1.53 -0.03 0.00 0.00 0.00 0.00 23.12 21.41 3e1f s ALA 242 CO -0.04 -1.17 0.52 -2.00 0.00 0.00 0.00 175.76 173.07 3e1f s GLU 243 N 1.19 4.18 -0.04 0.00 2.12 -0.63 -0.54 118.70 124.98 3e1f s GLU 243 Ca -0.08 0.41 0.07 0.00 0.36 0.00 0.00 54.97 55.73 3e1f s GLU 243 Cb -0.19 -3.57 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 3e1f s GLU 243 CO -0.06 -0.17 -0.25 0.08 -0.54 0.00 0.00 175.26 174.33 3e1f s VAL 244 N 1.69 2.11 0.02 3.70 1.01 0.65 -0.96 120.40 128.62 3e1f s VAL 244 Ca 0.24 -1.06 0.07 0.00 0.00 0.00 0.00 61.98 61.23 3e1f s VAL 244 Cb -0.15 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 3e1f s VAL 244 CO 0.10 0.57 -0.22 -1.10 0.00 0.00 0.00 175.10 174.45 3e1f s GLN 245 N -0.35 1.64 0.34 2.72 -0.21 0.26 -1.22 119.66 122.84 3e1f s GLN 245 Ca 0.02 -0.89 0.05 0.00 0.02 0.00 0.00 55.36 54.56 3e1f s GLN 245 Cb -0.12 -1.68 -0.07 0.00 1.00 0.00 0.00 33.01 32.14 3e1f s GLN 245 CO 0.02 0.45 0.03 0.00 -2.12 0.00 0.00 175.29 173.67 3e1f s MET 246 N -0.87 1.73 0.13 2.91 0.23 -0.56 -0.93 119.30 121.93 3e1f s MET 246 Ca 0.09 -1.96 0.01 0.00 -1.03 0.00 0.00 55.69 52.80 3e1f s MET 246 Cb -0.09 -1.11 -0.04 0.00 -1.53 0.00 0.00 34.83 32.06 3e1f s MET 246 CO 0.01 -0.13 -0.00 0.00 -2.03 0.00 0.00 175.02 172.87 3e1f n GLY 248 N -0.10 -1.61 3.68 0.00 0.00 -1.26 -1.81 105.19 104.10 3e1f n GLY 248 Ca -0.09 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 3e1f n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3e1f s GLU 249 N 0.00 4.32 0.00 1.61 2.56 -1.26 -4.99 118.70 120.94 3e1f s GLU 249 Ca 0.00 1.71 -0.23 0.00 0.00 0.00 0.00 54.97 56.45 3e1f s GLU 249 Cb 0.00 -3.61 -0.05 0.00 2.00 0.00 0.00 34.13 32.47 3e1f s GLU 249 CO 0.00 -0.52 0.69 -0.51 -0.56 0.00 0.00 175.26 174.36 3e1f s LEU 250 N 2.52 4.41 -0.01 2.70 1.43 -1.26 -4.94 118.68 123.53 3e1f s LEU 250 Ca 0.57 1.28 -0.09 0.00 -1.03 0.00 0.00 54.13 54.86 3e1f s LEU 250 Cb -0.25 -3.08 0.01 0.00 0.03 0.00 0.00 46.19 42.90 3e1f s LEU 250 CO 0.21 0.02 0.18 -0.13 0.23 0.00 0.00 176.35 176.87 3e1f s ARG 251 N 0.08 0.50 0.34 1.70 1.81 -1.26 -5.06 118.95 117.06 3e1f s ARG 251 Ca 0.35 -0.28 0.05 0.00 -1.72 0.00 0.00 55.73 54.13 3e1f s ARG 251 Cb -0.19 0.22 0.61 0.00 -0.45 0.00 0.00 34.95 35.13 3e1f s ARG 251 CO 0.20 -0.12 1.85 -0.44 -0.68 0.00 0.00 175.30 176.10 3e1f h ASP 252 N 4.33 0.41 0.10 0.23 5.19 -1.99 -1.94 116.42 122.75 3e1f h ASP 252 Ca -0.30 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 3e1f h ASP 252 Cb 1.19 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.59 3e1f h ASP 252 CO 0.40 0.55 0.00 0.00 -3.12 0.00 0.00 179.24 177.07 3e1f n TYR 253 N -4.24 0.00 -2.65 4.55 0.18 -1.26 -4.72 117.16 109.03 3e1f n TYR 253 Ca 0.00 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.42 3e1f n TYR 253 Cb 0.29 -0.16 -0.05 0.00 -0.38 0.00 0.00 39.34 39.04 3e1f n TYR 253 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3e1f s LEU 254 N -2.31 4.23 0.08 -3.48 1.43 -0.73 0.67 118.68 118.56 3e1f s LEU 254 Ca 0.12 1.95 -0.11 0.00 -1.03 0.00 0.00 54.13 55.06 3e1f s LEU 254 Cb 0.06 -4.11 0.01 0.00 0.03 0.00 0.00 46.19 42.19 3e1f s LEU 254 CO 0.13 -0.30 0.25 -0.13 0.23 0.00 0.00 176.35 176.53 3e1f s ARG 255 N -2.31 0.84 -0.04 1.70 1.81 0.97 -4.21 118.95 117.71 3e1f s ARG 255 Ca 0.54 -0.76 0.02 0.00 -1.72 0.00 0.00 55.73 53.81 3e1f s ARG 255 Cb -0.20 0.35 0.01 0.00 -0.45 0.00 0.00 34.95 34.66 3e1f s ARG 255 CO 0.26 -0.28 -0.08 0.08 -0.68 0.00 0.00 175.30 174.60 3e1f s VAL 256 N -3.33 0.78 -0.21 3.52 1.01 -0.64 -0.99 120.40 120.54 3e1f s VAL 256 Ca 0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.69 3e1f s VAL 256 Cb 0.02 -0.73 0.05 0.00 0.00 0.00 0.00 36.38 35.72 3e1f s VAL 256 CO -0.08 0.27 -0.04 -0.89 0.00 0.00 0.00 175.10 174.35 3e1f s THR 257 N 0.61 1.26 -0.25 3.92 2.01 -0.73 -1.76 115.64 120.71 3e1f s THR 257 Ca -0.10 -0.94 -0.12 0.00 0.31 0.00 0.00 61.69 60.84 3e1f s THR 257 Cb -0.13 -1.53 -0.05 0.00 0.01 0.00 0.00 72.50 70.80 3e1f s THR 257 CO 0.01 -0.04 0.22 -0.69 -0.69 0.00 0.00 174.62 173.43 3e1f s VAL 258 N 1.53 5.31 -0.04 3.82 1.01 -0.27 -2.28 120.40 129.48 3e1f s VAL 258 Ca -0.03 0.27 0.06 0.00 0.00 0.00 0.00 61.98 62.28 3e1f s VAL 258 Cb -0.17 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 3e1f s VAL 258 CO -0.07 0.29 -0.21 -0.94 0.00 0.00 0.00 175.10 174.17 3e1f s SER 259 N 1.30 2.61 -0.23 3.32 1.04 -0.97 -1.25 113.70 119.51 3e1f s SER 259 Ca 0.09 -0.43 -0.09 0.00 0.48 0.00 0.00 55.95 56.01 3e1f s SER 259 Cb -0.15 -0.63 -0.04 0.00 0.10 0.00 0.00 66.02 65.31 3e1f s SER 259 CO 0.07 0.21 0.10 -0.22 0.98 0.00 0.00 173.24 174.39 3e1f s LEU 260 N -0.16 3.77 -0.13 2.42 2.96 -0.14 -1.73 118.68 125.67 3e1f s LEU 260 Ca -0.01 -0.03 -0.00 0.00 -0.22 0.00 0.00 54.13 53.86 3e1f s LEU 260 Cb -0.12 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 3e1f s LEU 260 CO 0.02 0.04 -0.12 0.26 -1.32 0.00 0.00 176.35 175.24 3e1f s TRP 261 N 1.17 2.84 -0.56 5.38 0.52 0.78 -1.58 118.94 127.49 3e1f s TRP 261 Ca 0.05 -0.56 -0.03 0.00 0.02 0.00 0.00 56.10 55.58 3e1f s TRP 261 Cb -0.14 -1.85 0.15 0.00 -1.15 0.00 0.00 33.47 30.48 3e1f s TRP 261 CO 0.04 -0.16 0.37 -1.14 0.02 0.00 0.00 176.95 176.09 3e1f s GLN 262 N 0.28 2.41 7.35 4.98 2.00 -0.33 -0.23 119.66 136.11 3e1f s GLN 262 Ca -0.09 -2.31 0.00 0.00 -2.00 0.00 0.00 55.36 50.97 3e1f s GLN 262 Cb -0.15 -3.70 0.00 0.00 0.80 0.00 0.00 33.01 29.96 3e1f s GLN 262 CO 0.05 -1.15 0.00 0.41 -0.50 0.00 0.00 175.29 174.10 3e1f n GLY 263 N 3.85 2.47 0.02 2.59 0.00 -1.26 -1.64 105.19 111.22 3e1f n GLY 263 Ca 0.04 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.88 3e1f n GLY 263 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3e1f n GLU 264 N 13.09 0.09 -2.92 1.61 -0.58 -1.26 -4.89 120.64 125.77 3e1f n GLU 264 Ca 0.00 0.03 -0.33 0.00 -0.42 0.00 0.00 57.16 56.44 3e1f n GLU 264 Cb 0.00 -1.56 -0.06 0.00 -0.57 0.00 0.00 31.44 29.25 3e1f n GLU 264 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3e1f s THR 265 N -3.05 4.54 -0.53 2.62 2.01 -0.65 -5.04 115.64 115.55 3e1f s THR 265 Ca 0.10 1.19 -0.02 0.00 0.31 0.00 0.00 61.69 63.27 3e1f s THR 265 Cb 0.17 -3.62 0.14 0.00 0.01 0.00 0.00 72.50 69.19 3e1f s THR 265 CO 0.67 -0.30 0.33 -1.58 -0.69 0.00 0.00 174.62 173.05 3e1f s GLN 266 N -3.21 2.28 0.38 4.92 0.74 -1.26 -1.19 119.66 122.32 3e1f s GLN 266 Ca 0.58 -2.25 0.07 0.00 0.05 0.00 0.00 55.36 53.82 3e1f s GLN 266 Cb -0.10 -3.64 0.76 0.00 1.10 0.00 0.00 33.01 31.14 3e1f s GLN 266 CO 0.17 -1.13 1.95 -0.39 -0.55 0.00 0.00 175.29 175.35 3e1f h VAL 267 N 5.74 1.16 -2.70 1.34 -1.51 -1.65 -3.46 116.25 115.17 3e1f h VAL 267 Ca -0.06 -0.59 0.06 0.00 -1.23 0.00 0.00 66.70 64.88 3e1f h VAL 267 Cb 0.99 0.93 -0.11 0.00 -2.13 0.00 0.00 31.29 30.97 3e1f h VAL 267 CO 0.70 0.20 0.33 0.00 -1.23 0.00 0.00 177.57 177.58 3e1f s ALA 268 N -5.02 -1.59 -0.28 5.19 0.00 -1.20 -4.99 121.76 113.87 3e1f s ALA 268 Ca -0.07 0.41 -0.25 0.00 0.00 0.00 0.00 51.96 52.06 3e1f s ALA 268 Cb 0.16 0.72 0.11 0.00 0.00 0.00 0.00 23.12 24.10 3e1f s ALA 268 CO 0.74 -0.85 0.95 0.45 0.00 0.00 0.00 175.76 177.05 3e1f s SER 269 N -2.74 -0.54 0.01 0.00 0.15 -1.26 -0.97 113.70 108.35 3e1f s SER 269 Ca 0.06 1.03 0.01 0.00 0.70 0.00 0.00 55.95 57.74 3e1f s SER 269 Cb -0.02 1.05 -0.01 0.00 -1.71 0.00 0.00 66.02 65.33 3e1f s SER 269 CO -0.06 -0.18 -0.03 -0.83 1.20 0.00 0.00 173.24 173.35 3e1f s GLY 270 N 0.33 0.22 0.04 9.45 0.00 -0.38 -5.00 107.32 111.98 3e1f s GLY 270 Ca 0.02 -0.39 0.04 0.00 0.00 0.00 0.00 44.72 44.39 3e1f s GLY 270 CO -0.05 -0.42 -0.12 -1.59 0.00 0.00 0.00 173.10 170.92 3e1f s THR 271 N -0.80 0.95 -0.07 0.90 2.01 -1.26 -1.12 115.64 116.25 3e1f s THR 271 Ca -0.07 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.65 3e1f s THR 271 Cb -0.06 -0.89 0.11 0.00 0.01 0.00 0.00 72.50 71.67 3e1f s THR 271 CO -0.00 -0.08 0.89 0.00 -0.69 0.00 0.00 174.62 174.74 3e1f s ALA 272 N -0.93 -1.85 0.54 7.40 0.00 -0.72 -5.01 121.76 121.18 3e1f s ALA 272 Ca -0.01 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.17 3e1f s ALA 272 Cb -0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 3e1f s ALA 272 CO 0.01 -0.48 0.87 -1.25 0.00 0.00 0.00 175.76 174.91 3e1f s PRO 273 N -1.98 3.40 0.72 0.00 0.04 -1.26 -1.62 135.00 134.29 3e1f s PRO 273 Ca -0.01 0.27 -0.15 0.00 0.04 0.00 0.00 61.00 61.16 3e1f s PRO 273 Cb -0.01 -2.28 0.03 0.00 0.04 0.00 0.00 34.50 32.28 3e1f s PRO 273 CO -0.02 -0.41 1.19 -0.06 0.04 0.00 0.00 177.00 177.75 3e1f s PHE 274 N -2.90 2.15 0.00 0.56 0.08 -1.26 -4.84 117.98 111.77 3e1f s PHE 274 Ca 0.51 1.59 0.00 0.00 0.12 0.00 0.00 56.93 59.15 3e1f s PHE 274 Cb -0.10 -3.42 0.00 0.00 -0.57 0.00 0.00 43.02 38.92 3e1f s PHE 274 CO 0.47 -2.44 0.00 0.41 -0.10 0.00 0.00 175.22 173.56 3e1f n GLY 275 N 0.24 1.64 3.21 4.36 0.00 0.15 -4.95 105.19 109.84 3e1f n GLY 275 Ca 0.13 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 3e1f n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 276 N 0.00 -2.09 3.85 -0.02 0.00 0.08 -4.81 105.19 102.20 3e1f n GLY 276 Ca 0.00 -1.60 -0.31 0.00 0.00 0.00 0.00 46.02 44.12 3e1f n GLY 276 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3e1f s GLU 277 N -5.35 3.01 0.09 1.61 1.03 -1.26 -4.68 118.70 113.16 3e1f s GLU 277 Ca 0.64 0.75 -0.31 0.00 0.03 0.00 0.00 54.97 56.08 3e1f s GLU 277 Cb -0.04 -2.01 -0.09 0.00 -0.80 0.00 0.00 34.13 31.19 3e1f s GLU 277 CO 0.47 -0.99 1.59 0.42 -1.33 0.00 0.00 175.26 175.42 3e1f s ILE 278 N -3.16 2.99 -0.05 1.83 1.01 -1.26 -4.37 121.20 118.19 3e1f s ILE 278 Ca 0.57 0.55 0.09 0.00 0.00 0.00 0.00 60.65 61.86 3e1f s ILE 278 Cb -0.13 -3.35 -0.13 0.00 0.01 0.00 0.00 42.46 38.86 3e1f s ILE 278 CO 0.54 0.01 0.12 2.30 0.00 0.00 0.00 174.94 177.91 3e1f n ILE 279 N 4.46 0.30 -3.59 2.92 -5.35 0.67 -4.94 119.36 113.84 3e1f n ILE 279 Ca 0.15 -0.29 -0.07 0.00 -0.27 0.00 0.00 62.75 62.27 3e1f n ILE 279 Cb 0.40 -0.24 0.02 0.00 -1.74 0.00 0.00 39.64 38.08 3e1f n ILE 279 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3e1f n ASP 280 N -2.08 -1.63 0.26 7.28 5.68 -1.00 -5.03 116.55 120.04 3e1f n ASP 280 Ca -0.08 -2.16 0.16 0.00 -0.50 0.00 0.00 54.79 52.21 3e1f n ASP 280 Cb 0.51 2.73 0.73 0.00 -1.14 0.00 0.00 41.12 43.96 3e1f n ASP 280 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3e1f h GLU 281 N 0.00 0.00 -0.11 0.11 3.07 -2.05 0.63 114.58 116.23 3e1f h GLU 281 Ca -0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 3e1f h GLU 281 Cb 0.89 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.80 3e1f h GLU 281 CO 0.31 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.46 3e1f n ARG 282 N -3.09 1.91 0.00 2.33 5.12 -1.26 -5.05 116.66 116.61 3e1f n ARG 282 Ca 0.01 -1.34 0.00 0.00 -1.93 0.00 0.00 57.85 54.59 3e1f n ARG 282 Cb 0.52 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.36 3e1f n ARG 282 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3e1f n GLY 283 N 1.23 0.58 2.15 -0.13 0.00 0.21 -5.05 105.19 104.18 3e1f n GLY 283 Ca 0.17 -1.48 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 3e1f n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 284 N 0.00 2.43 3.57 -0.02 0.00 -1.26 -0.23 105.19 109.68 3e1f n GLY 284 Ca 0.00 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 3e1f n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3e1f s TYR 285 N -3.74 2.46 -0.40 1.61 1.51 -1.26 -4.83 117.35 112.70 3e1f s TYR 285 Ca 0.18 0.37 0.26 0.00 -1.01 0.00 0.00 57.07 56.87 3e1f s TYR 285 Cb -0.01 -4.50 0.95 0.00 -0.11 0.00 0.00 41.96 38.29 3e1f s TYR 285 CO 0.13 -1.78 1.78 0.00 -1.11 0.00 0.00 175.55 174.57 3e1f h ALA 286 N 10.09 1.00 -0.96 3.71 0.00 -1.94 0.30 119.26 131.46 3e1f h ALA 286 Ca -0.26 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.18 3e1f h ALA 286 Cb 1.07 0.00 -0.28 0.00 0.00 0.00 0.00 17.79 18.57 3e1f h ALA 286 CO 1.20 0.00 0.60 -0.40 0.00 0.00 0.00 179.25 180.65 3e1f n ASP 287 N -2.55 3.91 -3.87 0.00 5.75 -1.26 -3.38 116.55 115.15 3e1f n ASP 287 Ca 0.03 -3.55 -0.09 0.00 -0.01 0.00 0.00 54.79 51.16 3e1f n ASP 287 Cb 0.34 -0.83 -0.06 0.00 -1.03 0.00 0.00 41.12 39.54 3e1f n ASP 287 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3e1f s ARG 288 N -3.25 1.14 -0.18 0.11 0.52 -1.13 -1.50 118.95 114.67 3e1f s ARG 288 Ca 0.57 -1.04 -0.28 0.00 -0.52 0.00 0.00 55.73 54.47 3e1f s ARG 288 Cb 0.47 0.41 0.08 0.00 0.52 0.00 0.00 34.95 36.43 3e1f s ARG 288 CO 0.11 -0.43 0.74 0.54 0.02 0.00 0.00 175.30 176.28 3e1f s VAL 289 N -3.92 0.00 -0.12 3.52 0.11 -0.36 0.29 120.40 119.92 3e1f s VAL 289 Ca 0.12 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.20 3e1f s VAL 289 Cb 0.03 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.88 3e1f s VAL 289 CO -0.03 0.00 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.63 3e1f s THR 290 N -0.30 2.21 -0.08 5.04 2.01 -1.26 -0.25 115.64 123.02 3e1f s THR 290 Ca -0.04 -0.94 -0.04 0.00 0.31 0.00 0.00 61.69 60.98 3e1f s THR 290 Cb -0.03 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 3e1f s THR 290 CO 0.04 0.55 0.09 -0.76 -0.69 0.00 0.00 174.62 173.84 3e1f s LEU 291 N 0.59 4.02 -0.19 4.42 2.01 0.30 -4.92 118.68 124.91 3e1f s LEU 291 Ca -0.12 0.29 -0.01 0.00 0.01 0.00 0.00 54.13 54.30 3e1f s LEU 291 Cb -0.17 -2.07 0.05 0.00 0.01 0.00 0.00 46.19 44.02 3e1f s LEU 291 CO 0.03 0.36 -0.03 -0.13 1.01 0.00 0.00 176.35 177.59 3e1f s ARG 292 N -1.19 1.31 -0.04 1.70 0.52 -1.26 -0.25 118.95 119.74 3e1f s ARG 292 Ca 0.17 -0.63 -0.00 0.00 -0.52 0.00 0.00 55.73 54.74 3e1f s ARG 292 Cb -0.12 -2.20 -0.03 0.00 0.52 0.00 0.00 34.95 33.12 3e1f s ARG 292 CO 0.06 -0.53 0.01 -0.51 0.02 0.00 0.00 175.30 174.35 3e1f s LEU 293 N 1.61 3.58 0.18 2.53 1.43 0.28 -4.93 118.68 123.37 3e1f s LEU 293 Ca -0.02 0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 53.08 3e1f s LEU 293 Cb -0.17 -1.94 -0.07 0.00 0.03 0.00 0.00 46.19 44.05 3e1f s LEU 293 CO -0.07 0.33 0.48 0.20 0.23 0.00 0.00 176.35 177.51 3e1f s ASN 294 N -1.24 6.60 -0.11 2.29 0.01 -1.26 -0.26 114.94 120.96 3e1f s ASN 294 Ca 0.17 0.81 -0.04 0.00 -0.71 0.00 0.00 52.86 53.09 3e1f s ASN 294 Cb -0.11 -2.18 0.06 0.00 0.41 0.00 0.00 41.25 39.42 3e1f s ASN 294 CO 0.07 0.00 0.14 -0.69 -1.51 0.00 0.00 177.10 175.11 3e1f s VAL 295 N -1.70 -0.22 0.06 1.60 1.01 0.23 -4.78 120.40 116.60 3e1f s VAL 295 Ca 0.43 0.19 -0.14 0.00 0.00 0.00 0.00 61.98 62.46 3e1f s VAL 295 Cb -0.12 -0.39 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 3e1f s VAL 295 CO 0.22 0.01 0.46 -1.61 0.00 0.00 0.00 175.10 174.18 3e1f s GLU 296 N 2.25 3.94 -1.06 2.72 0.41 -1.26 -1.10 118.70 124.61 3e1f s GLU 296 Ca 0.04 0.43 -0.21 0.00 -0.41 0.00 0.00 54.97 54.82 3e1f s GLU 296 Cb -0.13 -3.11 0.03 0.00 -1.78 0.00 0.00 34.13 29.13 3e1f s GLU 296 CO -0.07 0.61 0.66 0.09 -0.49 0.00 0.00 175.26 176.05 3e1f n ASN 297 N 1.37 -4.48 -4.79 -0.19 3.02 0.53 -4.88 115.26 105.82 3e1f n ASN 297 Ca -0.10 -1.16 -0.33 0.00 -0.03 0.00 0.00 54.58 52.96 3e1f n ASN 297 Cb 0.52 -1.75 0.01 0.00 -0.61 0.00 0.00 39.78 37.95 3e1f n ASN 297 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3e1f s PRO 298 N -6.41 3.34 -0.62 3.52 0.04 -1.26 -4.97 135.00 128.65 3e1f s PRO 298 Ca 0.30 1.30 -0.25 0.00 0.04 0.00 0.00 61.00 62.39 3e1f s PRO 298 Cb -0.16 -2.03 0.04 0.00 0.04 0.00 0.00 34.50 32.39 3e1f s PRO 298 CO 0.94 -0.81 1.07 0.15 0.04 0.00 0.00 177.00 178.39 3e1f s LYS 299 N -3.84 3.30 0.48 4.56 1.02 -1.26 -5.01 119.74 119.00 3e1f s LYS 299 Ca 0.66 -0.24 -0.22 0.00 0.02 0.00 0.00 55.97 56.18 3e1f s LYS 299 Cb -0.18 -4.10 -0.07 0.00 -0.52 0.00 0.00 37.83 32.97 3e1f s LYS 299 CO 0.33 -1.73 1.18 -0.51 -0.92 0.00 0.00 175.35 173.70 3e1f s LEU 300 N 4.56 3.94 -0.00 3.17 1.43 -1.26 -4.38 118.68 126.14 3e1f s LEU 300 Ca 0.33 2.33 -0.10 0.00 -1.03 0.00 0.00 54.13 55.65 3e1f s LEU 300 Cb -0.11 -4.31 -0.05 0.00 0.03 0.00 0.00 46.19 41.74 3e1f s LEU 300 CO 0.18 -1.04 0.32 0.86 0.23 0.00 0.00 176.35 176.90 3e1f s TRP 301 N -1.56 3.64 0.24 0.29 -0.00 0.20 -4.04 118.94 117.71 3e1f s TRP 301 Ca 0.66 0.76 -0.22 0.00 -0.00 0.00 0.00 56.10 57.30 3e1f s TRP 301 Cb -0.29 -2.12 0.05 0.00 -0.00 0.00 0.00 33.47 31.10 3e1f s TRP 301 CO 0.34 0.63 0.85 -1.54 -0.00 0.00 0.00 176.95 177.23 3e1f s SER 302 N -1.37 -0.17 0.47 5.86 1.04 -0.90 -4.63 113.70 114.00 3e1f s SER 302 Ca 0.25 -0.61 0.28 0.00 0.48 0.00 0.00 55.95 56.35 3e1f s SER 302 Cb -0.14 0.64 0.88 0.00 0.10 0.00 0.00 66.02 67.50 3e1f s SER 302 CO 0.13 -1.20 1.80 0.00 0.98 0.00 0.00 173.24 174.96 3e1f h ALA 303 N 2.00 1.00 -0.00 5.32 0.00 -1.90 -2.32 119.26 123.36 3e1f h ALA 303 Ca -0.23 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3e1f h ALA 303 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3e1f h ALA 303 CO 0.27 0.00 -0.07 0.93 0.00 0.00 0.00 179.25 180.39 3e1f h GLU 304 N 0.00 0.05 -2.93 0.00 5.08 -1.94 -3.43 114.58 111.41 3e1f h GLU 304 Ca 0.00 -0.05 -0.57 0.00 -1.00 0.00 0.00 59.36 57.74 3e1f h GLU 304 Cb 0.72 0.01 -0.40 0.00 0.50 0.00 0.00 28.75 29.59 3e1f h GLU 304 CO 0.00 0.82 -0.79 0.42 -1.00 0.00 0.00 179.01 178.46 3e1f s ILE 305 N -3.09 0.40 -0.86 3.13 1.01 -1.17 -4.97 121.20 115.65 3e1f s ILE 305 Ca -0.17 -1.41 -0.06 0.00 0.00 0.00 0.00 60.65 59.01 3e1f s ILE 305 Cb -0.01 -1.31 -0.06 0.00 0.01 0.00 0.00 42.46 41.10 3e1f s ILE 305 CO 0.70 -0.81 2.14 -0.81 0.00 0.00 0.00 174.94 176.15 3e1f n PRO 306 N 4.59 2.05 -1.88 2.79 -0.04 -0.88 -2.11 135.00 139.51 3e1f n PRO 306 Ca 0.02 -1.40 -0.42 0.00 -0.04 0.00 0.00 63.50 61.65 3e1f n PRO 306 Cb 0.40 -2.41 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 3e1f n PRO 306 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3e1f s ASN 307 N 3.31 6.54 0.22 3.54 0.01 -1.26 -4.88 114.94 122.43 3e1f s ASN 307 Ca 0.40 2.35 0.11 0.00 -0.71 0.00 0.00 52.86 55.01 3e1f s ASN 307 Cb 0.11 -2.53 -0.05 0.00 0.41 0.00 0.00 41.25 39.19 3e1f s ASN 307 CO -0.03 -1.01 -0.21 -0.76 -1.51 0.00 0.00 177.10 173.57 3e1f s LEU 308 N 4.36 2.50 0.36 0.60 1.43 -1.26 -4.16 118.68 122.51 3e1f s LEU 308 Ca 0.79 -0.94 0.05 0.00 -1.03 0.00 0.00 54.13 53.01 3e1f s LEU 308 Cb -0.36 -1.07 -0.07 0.00 0.03 0.00 0.00 46.19 44.72 3e1f s LEU 308 CO 0.34 0.05 0.04 -0.31 0.23 0.00 0.00 176.35 176.70 3e1f s TYR 309 N -2.11 2.15 -0.16 0.29 1.51 0.12 -4.80 117.35 114.34 3e1f s TYR 309 Ca 0.24 -0.87 0.02 0.00 -1.01 0.00 0.00 57.07 55.44 3e1f s TYR 309 Cb -0.06 -1.46 0.02 0.00 -0.11 0.00 0.00 41.96 40.34 3e1f s TYR 309 CO 0.11 0.16 -0.20 0.50 -1.11 0.00 0.00 175.55 175.00 3e1f s ARG 310 N -3.82 2.93 -0.24 -0.62 6.06 0.68 -0.15 118.95 123.79 3e1f s ARG 310 Ca 0.35 -0.81 -0.09 0.00 -2.50 0.00 0.00 55.73 52.68 3e1f s ARG 310 Cb 0.09 -2.47 -0.04 0.00 0.06 0.00 0.00 34.95 32.59 3e1f s ARG 310 CO 0.16 -0.14 0.12 0.00 -2.50 0.00 0.00 175.30 172.94 3e1f s ALA 311 N 1.13 3.38 -0.23 6.12 0.00 -0.27 -0.16 121.76 131.74 3e1f s ALA 311 Ca 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 50.95 3e1f s ALA 311 Cb -0.14 -2.19 0.02 0.00 0.00 0.00 0.00 23.12 20.81 3e1f s ALA 311 CO -0.09 -0.32 -0.10 0.08 0.00 0.00 0.00 175.76 175.34 3e1f s VAL 312 N 1.31 2.71 -0.34 0.00 1.01 -0.71 -1.69 120.40 122.70 3e1f s VAL 312 Ca 0.06 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 3e1f s VAL 312 Cb -0.15 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 3e1f s VAL 312 CO 0.05 0.31 0.40 -0.69 0.00 0.00 0.00 175.10 175.17 3e1f s VAL 313 N 1.33 5.13 -0.19 2.92 1.01 0.34 -2.30 120.40 128.64 3e1f s VAL 313 Ca 0.02 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 3e1f s VAL 313 Cb -0.15 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 3e1f s VAL 313 CO -0.07 -0.09 -0.05 -1.61 0.00 0.00 0.00 175.10 173.28 3e1f s GLU 314 N 2.11 3.47 -0.34 2.72 2.02 -0.96 0.10 118.70 127.82 3e1f s GLU 314 Ca 0.14 -0.60 -0.13 0.00 0.02 0.00 0.00 54.97 54.39 3e1f s GLU 314 Cb -0.16 -2.92 -0.02 0.00 0.10 0.00 0.00 34.13 31.13 3e1f s GLU 314 CO 0.12 0.01 0.27 -1.17 0.02 0.00 0.00 175.26 174.50 3e1f s LEU 315 N 0.95 4.50 0.00 1.80 2.96 0.12 -1.77 118.68 127.23 3e1f s LEU 315 Ca -0.00 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 3e1f s LEU 315 Cb -0.15 -2.18 0.00 0.00 0.50 0.00 0.00 46.19 44.36 3e1f s LEU 315 CO 0.01 -0.26 0.17 0.00 -1.32 0.00 0.00 176.35 174.95 3e1f n HIS 316 N 5.17 -0.70 -4.09 5.38 1.44 -0.16 0.11 115.22 122.37 3e1f n HIS 316 Ca -0.12 -0.91 -0.24 0.00 -2.01 0.00 0.00 57.72 54.44 3e1f n HIS 316 Cb 0.50 0.18 -0.05 0.00 0.12 0.00 0.00 29.99 30.74 3e1f n HIS 316 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 3e1f s THR 317 N -2.56 4.55 0.44 0.61 -4.23 0.15 -0.02 115.64 114.57 3e1f s THR 317 Ca 0.12 -1.20 0.15 0.00 -1.18 0.00 0.00 61.69 59.57 3e1f s THR 317 Cb -0.00 -3.39 0.34 0.00 1.34 0.00 0.00 72.50 70.78 3e1f s THR 317 CO 0.08 -0.23 1.97 0.00 -0.54 0.00 0.00 174.62 175.90 3e1f h ALA 318 N 1.92 2.05 0.00 3.99 0.00 -0.06 0.87 119.26 128.03 3e1f h ALA 318 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3e1f h ALA 318 Cb 1.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3e1f h ALA 318 CO 0.62 -0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.27 3e1f n ASP 319 N -4.47 0.00 0.00 0.00 3.85 -1.26 -4.84 116.55 109.83 3e1f n ASP 319 Ca 0.11 -1.46 0.00 0.00 -0.71 0.00 0.00 54.79 52.73 3e1f n ASP 319 Cb 0.41 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.18 3e1f n ASP 319 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3e1f n GLY 320 N 0.28 0.76 3.66 6.12 0.00 0.30 -5.06 105.19 111.25 3e1f n GLY 320 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3e1f n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3e1f s THR 321 N -2.31 4.92 0.17 2.61 2.01 -1.22 -4.82 115.64 116.99 3e1f s THR 321 Ca 0.00 1.49 -0.30 0.00 0.31 0.00 0.00 61.69 63.19 3e1f s THR 321 Cb 0.00 -4.08 -0.08 0.00 0.01 0.00 0.00 72.50 68.36 3e1f s THR 321 CO 0.00 0.04 1.23 -0.22 -0.69 0.00 0.00 174.62 174.99 3e1f s LEU 322 N 2.13 4.43 -0.25 4.42 2.96 -1.26 -0.68 118.68 130.43 3e1f s LEU 322 Ca 0.35 2.24 0.00 0.00 -0.22 0.00 0.00 54.13 56.50 3e1f s LEU 322 Cb -0.16 -3.60 -0.16 0.00 0.50 0.00 0.00 46.19 42.77 3e1f s LEU 322 CO 0.11 -0.43 -0.23 -0.38 -1.32 0.00 0.00 176.35 174.10 3e1f n ILE 323 N 2.82 1.44 -3.63 6.68 5.41 0.30 -4.94 119.36 127.44 3e1f n ILE 323 Ca 0.06 -0.53 -0.03 0.00 1.00 0.00 0.00 62.75 63.25 3e1f n ILE 323 Cb 0.44 -1.44 -0.03 0.00 -0.71 0.00 0.00 39.64 37.91 3e1f n ILE 323 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 3e1f s GLU 324 N -2.50 0.11 -0.00 0.38 2.12 -0.81 -4.88 118.70 113.11 3e1f s GLU 324 Ca -0.34 -0.02 -0.00 0.00 0.36 0.00 0.00 54.97 54.97 3e1f s GLU 324 Cb 0.09 0.05 -0.00 0.00 0.26 0.00 0.00 34.13 34.53 3e1f s GLU 324 CO 0.57 -0.04 0.01 0.00 -0.54 0.00 0.00 175.26 175.25 3e1f s ALA 325 N -1.72 -0.01 0.21 6.30 0.00 -0.26 0.10 121.76 126.38 3e1f s ALA 325 Ca 0.10 -0.06 0.08 0.00 0.00 0.00 0.00 51.96 52.08 3e1f s ALA 325 Cb -0.01 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 3e1f s ALA 325 CO -0.05 -0.03 -0.15 -1.21 0.00 0.00 0.00 175.76 174.33 3e1f s GLU 326 N -0.22 1.34 0.31 0.00 0.41 0.11 -1.70 118.70 118.96 3e1f s GLU 326 Ca -0.02 -1.59 -0.16 0.00 -0.41 0.00 0.00 54.97 52.78 3e1f s GLU 326 Cb -0.02 -1.15 0.02 0.00 -1.78 0.00 0.00 34.13 31.21 3e1f s GLU 326 CO -0.00 0.19 0.66 0.00 -0.49 0.00 0.00 175.26 175.63 3e1f s ALA 327 N -2.94 -0.69 0.03 5.21 0.00 -1.26 0.13 121.76 122.24 3e1f s ALA 327 Ca 0.23 -0.67 -0.27 0.00 0.00 0.00 0.00 51.96 51.24 3e1f s ALA 327 Cb -0.01 0.88 0.09 0.00 0.00 0.00 0.00 23.12 24.08 3e1f s ALA 327 CO 0.07 -0.96 0.80 0.00 0.00 0.00 0.00 175.76 175.67 3e1f s ASP 329 N -2.41 7.42 -0.05 0.00 1.01 -1.26 -1.11 116.67 120.27 3e1f s ASP 329 Ca 0.03 1.84 0.06 0.00 0.71 0.00 0.00 52.55 55.19 3e1f s ASP 329 Cb -0.01 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 3e1f s ASP 329 CO -0.09 0.02 -0.25 -0.69 0.21 0.00 0.00 175.17 174.38 3e1f s VAL 330 N -1.45 2.00 -0.22 -1.27 1.01 0.79 -4.74 120.40 116.52 3e1f s VAL 330 Ca 0.46 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.41 3e1f s VAL 330 Cb -0.21 -1.69 0.05 0.00 0.00 0.00 0.00 36.38 34.53 3e1f s VAL 330 CO 0.26 0.56 -0.10 -0.83 0.00 0.00 0.00 175.10 174.99 3e1f s GLY 331 N -0.22 1.39 -0.46 4.51 0.00 -1.26 0.12 107.32 111.41 3e1f s GLY 331 Ca -0.02 -1.41 -0.28 0.00 0.00 0.00 0.00 44.72 43.02 3e1f s GLY 331 CO 0.03 0.71 1.67 -1.36 0.00 0.00 0.00 173.10 174.15 3e1f s PHE 332 N 1.30 1.97 -0.08 1.90 0.40 -1.26 -4.74 117.98 117.47 3e1f s PHE 332 Ca -0.04 0.65 -0.19 0.00 -0.60 0.00 0.00 56.93 56.75 3e1f s PHE 332 Cb -0.18 -4.20 0.04 0.00 0.51 0.00 0.00 43.02 39.19 3e1f s PHE 332 CO -0.07 -2.43 0.45 -0.98 0.70 0.00 0.00 175.22 172.89 3e1f s ARG 333 N 5.84 0.72 -0.16 0.44 3.03 -1.26 0.63 118.95 128.18 3e1f s ARG 333 Ca 0.68 0.20 0.01 0.00 2.03 0.00 0.00 55.73 58.65 3e1f s ARG 333 Cb -0.16 0.33 0.01 0.00 -1.03 0.00 0.00 34.95 34.10 3e1f s ARG 333 CO 0.29 -0.18 -0.18 -2.00 -1.13 0.00 0.00 175.30 172.10 3e1f s GLU 334 N -0.76 3.10 -0.19 3.89 2.12 -1.26 -4.90 118.70 120.69 3e1f s GLU 334 Ca -0.08 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.42 3e1f s GLU 334 Cb -0.03 -2.58 -0.01 0.00 0.26 0.00 0.00 34.13 31.76 3e1f s GLU 334 CO 0.04 -0.09 -0.06 0.08 -0.54 0.00 0.00 175.26 174.69 3e1f s VAL 335 N 1.03 3.33 -0.19 3.70 1.01 -1.26 0.24 120.40 128.26 3e1f s VAL 335 Ca -0.01 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.20 3e1f s VAL 335 Cb -0.15 -2.48 0.06 0.00 0.00 0.00 0.00 36.38 33.81 3e1f s VAL 335 CO -0.05 0.46 0.64 0.00 0.00 0.00 0.00 175.10 176.14 3e1f s ARG 336 N 1.10 0.81 -0.34 2.72 1.70 -0.47 -4.65 118.95 119.83 3e1f s ARG 336 Ca 0.01 0.72 -0.16 0.00 -0.47 0.00 0.00 55.73 55.83 3e1f s ARG 336 Cb -0.15 0.39 -0.01 0.00 -0.57 0.00 0.00 34.95 34.62 3e1f s ARG 336 CO -0.01 -0.14 0.40 0.42 -1.08 0.00 0.00 175.30 174.89 3e1f s ILE 337 N -0.04 5.13 -0.05 4.99 1.01 -1.26 0.21 121.20 131.19 3e1f s ILE 337 Ca -0.03 0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.77 3e1f s ILE 337 Cb -0.04 -3.85 0.02 0.00 0.01 0.00 0.00 42.46 38.60 3e1f s ILE 337 CO 0.03 -0.12 -0.05 -0.70 0.00 0.00 0.00 174.94 174.10 3e1f s GLU 338 N 2.11 0.94 -1.37 2.79 2.12 0.90 -4.82 118.70 121.38 3e1f s GLU 338 Ca 0.14 -0.14 -0.08 0.00 0.36 0.00 0.00 54.97 55.25 3e1f s GLU 338 Cb -0.16 -0.93 0.02 0.00 0.26 0.00 0.00 34.13 33.32 3e1f s GLU 338 CO 0.12 -0.08 1.08 -1.71 -0.54 0.00 0.00 175.26 174.13 3e1f n ASN 339 N 4.08 -4.95 0.00 -1.70 5.15 -1.26 -1.96 115.26 114.62 3e1f n ASN 339 Ca -0.24 -0.63 0.00 0.00 -0.60 0.00 0.00 54.58 53.12 3e1f n ASN 339 Cb 0.51 -4.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.03 3e1f n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3e1f n GLY 340 N -1.77 1.60 3.43 8.20 0.00 -1.26 -5.02 105.19 110.37 3e1f n GLY 340 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 3e1f n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e1f s LEU 341 N 0.00 2.52 -0.41 0.99 1.43 -0.83 -2.82 118.68 119.57 3e1f s LEU 341 Ca 0.00 -0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 52.50 3e1f s LEU 341 Cb 0.00 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.76 3e1f s LEU 341 CO 0.00 0.31 0.97 -0.22 0.23 0.00 0.00 176.35 177.64 3e1f s LEU 342 N -0.90 3.94 -0.13 1.79 2.96 -1.26 -0.07 118.68 125.00 3e1f s LEU 342 Ca 0.12 0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 54.45 3e1f s LEU 342 Cb -0.10 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.25 3e1f s LEU 342 CO 0.01 -0.98 0.02 -0.76 -1.32 0.00 0.00 176.35 173.32 3e1f s LEU 343 N 3.72 3.61 -0.27 -0.68 1.43 0.13 -2.21 118.68 124.41 3e1f s LEU 343 Ca 0.40 0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 3e1f s LEU 343 Cb -0.11 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.29 3e1f s LEU 343 CO 0.23 0.28 -0.06 -0.22 0.23 0.00 0.00 176.35 176.81 3e1f s LEU 344 N -0.27 3.45 -1.36 1.79 1.98 0.10 -1.36 118.68 123.01 3e1f s LEU 344 Ca 0.07 -1.12 -0.05 0.00 -2.89 0.00 0.00 54.13 50.13 3e1f s LEU 344 Cb -0.12 -1.65 0.02 0.00 0.66 0.00 0.00 46.19 45.10 3e1f s LEU 344 CO 0.02 -0.18 0.87 0.59 -1.89 0.00 0.00 176.35 175.76 3e1f n ASN 345 N 4.60 -2.83 0.00 3.68 3.02 0.14 -1.80 115.26 122.07 3e1f n ASN 345 Ca -0.15 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 3e1f n ASN 345 Cb 0.45 -4.26 0.00 0.00 -0.61 0.00 0.00 39.78 35.36 3e1f n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3e1f n GLY 346 N -1.60 2.89 3.75 7.41 0.00 -1.26 -5.00 105.19 111.38 3e1f n GLY 346 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 3e1f n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3e1f s LYS 347 N 0.00 3.03 -0.18 1.61 -0.14 -0.74 -4.97 119.74 118.35 3e1f s LYS 347 Ca 0.00 -0.45 -0.29 0.00 -1.36 0.00 0.00 55.97 53.87 3e1f s LYS 347 Cb 0.00 -2.84 -0.02 0.00 -1.68 0.00 0.00 37.83 33.29 3e1f s LYS 347 CO 0.00 0.67 1.33 -1.25 -0.76 0.00 0.00 175.35 175.34 3e1f s PRO 348 N -1.39 4.15 0.75 -1.68 0.04 -1.26 0.03 135.00 135.64 3e1f s PRO 348 Ca 0.19 1.65 -0.11 0.00 0.04 0.00 0.00 61.00 62.77 3e1f s PRO 348 Cb -0.12 -3.82 0.04 0.00 0.04 0.00 0.00 34.50 30.64 3e1f s PRO 348 CO 0.09 -0.82 1.08 -0.51 0.04 0.00 0.00 177.00 176.88 3e1f s LEU 349 N 3.79 2.85 -0.35 -3.56 1.43 -0.94 -4.96 118.68 116.95 3e1f s LEU 349 Ca 0.58 1.46 -0.01 0.00 -1.03 0.00 0.00 54.13 55.13 3e1f s LEU 349 Cb -0.22 -4.20 0.12 0.00 0.03 0.00 0.00 46.19 41.93 3e1f s LEU 349 CO 0.18 -1.72 0.18 -0.22 0.23 0.00 0.00 176.35 175.00 3e1f s LEU 350 N -5.67 1.32 -0.43 1.79 2.96 -1.26 -4.74 118.68 112.65 3e1f s LEU 350 Ca 0.59 -1.97 -0.27 0.00 -0.22 0.00 0.00 54.13 52.26 3e1f s LEU 350 Cb -0.14 -0.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 3e1f s LEU 350 CO 0.55 -0.35 1.93 -0.63 -1.32 0.00 0.00 176.35 176.52 3e1f s ILE 351 N 1.27 3.34 -1.13 6.68 -1.09 0.91 -4.90 121.20 126.29 3e1f s ILE 351 Ca 0.15 0.30 -0.08 0.00 -2.23 0.00 0.00 60.65 58.79 3e1f s ILE 351 Cb -0.21 -3.62 0.27 0.00 -1.58 0.00 0.00 42.46 37.33 3e1f s ILE 351 CO -0.12 -0.49 1.33 0.54 -1.23 0.00 0.00 174.94 174.97 3e1f n ARG 352 N 8.77 3.86 -4.13 2.79 1.74 -1.26 -1.85 116.66 126.57 3e1f n ARG 352 Ca 0.24 -4.36 -0.28 0.00 -0.77 0.00 0.00 57.85 52.68 3e1f n ARG 352 Cb 0.49 -2.61 -0.03 0.00 -1.02 0.00 0.00 32.46 29.29 3e1f n ARG 352 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3e1f s GLY 353 N 0.38 2.53 -0.04 -0.13 0.00 -0.68 -0.59 107.32 108.79 3e1f s GLY 353 Ca 0.33 -1.15 -0.19 0.00 0.00 0.00 0.00 44.72 43.71 3e1f s GLY 353 CO -0.00 -2.00 0.41 0.54 0.00 0.00 0.00 173.10 172.06 3e1f s VAL 354 N -2.77 0.04 0.15 1.40 0.11 -0.97 -0.86 120.40 117.50 3e1f s VAL 354 Ca 0.28 -0.31 -0.23 0.00 -2.93 0.00 0.00 61.98 58.79 3e1f s VAL 354 Cb -0.00 -0.71 -0.08 0.00 -1.53 0.00 0.00 36.38 34.06 3e1f s VAL 354 CO 0.17 -0.17 0.73 0.20 -3.33 0.00 0.00 175.10 172.69 3e1f s ASN 355 N -1.13 7.28 -0.17 3.54 0.01 0.57 -1.87 114.94 123.17 3e1f s ASN 355 Ca -0.12 1.54 -0.05 0.00 -0.71 0.00 0.00 52.86 53.53 3e1f s ASN 355 Cb -0.04 -2.46 0.06 0.00 0.41 0.00 0.00 41.25 39.22 3e1f s ASN 355 CO 0.05 0.20 0.08 -0.60 -1.51 0.00 0.00 177.10 175.33 3e1f s ARG 356 N -1.24 0.13 0.38 -0.60 3.52 -1.00 -0.35 118.95 119.78 3e1f s ARG 356 Ca 0.35 -0.10 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 3e1f s ARG 356 Cb -0.22 -1.79 -0.10 0.00 -1.56 0.00 0.00 34.95 31.28 3e1f s ARG 356 CO 0.24 -0.65 0.91 -1.01 -0.81 0.00 0.00 175.30 173.98 3e1f s HIS 357 N 2.11 3.42 -0.73 5.12 3.76 -1.26 -4.22 115.29 123.49 3e1f s HIS 357 Ca 0.02 1.58 -0.25 0.00 -0.15 0.00 0.00 55.06 56.26 3e1f s HIS 357 Cb -0.16 -2.81 0.05 0.00 1.11 0.00 0.00 32.58 30.77 3e1f s HIS 357 CO -0.09 0.02 1.15 -1.21 -0.85 0.00 0.00 174.74 173.77 3e1f s GLU 358 N -2.83 3.19 -0.02 1.40 2.02 -1.26 -4.91 118.70 116.30 3e1f s GLU 358 Ca 0.57 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.98 3e1f s GLU 358 Cb -0.12 -4.29 0.01 0.00 0.10 0.00 0.00 34.13 29.83 3e1f s GLU 358 CO 0.16 -2.00 -0.03 -1.58 0.02 0.00 0.00 175.26 171.83 3e1f s HIS 359 N 4.90 0.41 -0.07 1.61 2.46 -1.26 -4.54 115.29 118.80 3e1f s HIS 359 Ca 0.30 -0.07 0.02 0.00 0.47 0.00 0.00 55.06 55.79 3e1f s HIS 359 Cb -0.11 -0.36 0.01 0.00 -0.13 0.00 0.00 32.58 31.99 3e1f s HIS 359 CO 0.11 -0.08 -0.12 -1.58 -2.47 0.00 0.00 174.74 170.60 3e1f s HIS 360 N 0.44 1.48 0.50 3.88 2.46 0.98 -5.01 115.29 120.02 3e1f s HIS 360 Ca -0.05 -0.57 0.38 0.00 0.47 0.00 0.00 55.06 55.30 3e1f s HIS 360 Cb -0.08 -1.10 2.09 0.00 -0.13 0.00 0.00 32.58 33.36 3e1f s HIS 360 CO -0.01 -0.30 2.17 -1.00 -2.47 0.00 0.00 174.74 173.13 3e1f h PRO 361 N 7.09 0.00 0.00 2.88 0.13 -1.77 -1.95 132.00 138.38 3e1f h PRO 361 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3e1f h PRO 361 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3e1f h PRO 361 CO 0.47 0.00 -0.97 1.28 -0.23 0.00 0.00 178.00 178.55 3e1f n LEU 362 N -2.89 0.76 -0.99 1.56 4.77 -1.26 -1.65 117.00 117.30 3e1f n LEU 362 Ca -0.03 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.06 3e1f n LEU 362 Cb 0.11 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.46 3e1f n LEU 362 CO 0.17 0.13 0.72 1.41 -1.33 0.00 0.00 177.39 178.49 3e1f n HIS 363 N -2.09 0.53 0.00 -1.77 8.25 -1.20 -4.99 115.22 113.95 3e1f n HIS 363 Ca 0.00 -0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 3e1f n HIS 363 Cb 0.49 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.60 3e1f n HIS 363 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3e1f n GLY 364 N 1.40 3.06 1.62 -1.41 0.00 -0.74 -2.75 105.19 106.37 3e1f n GLY 364 Ca 0.19 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 3e1f n GLY 364 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3e1f n GLN 365 N 12.79 2.40 -3.65 1.61 6.02 -1.26 -0.01 117.38 135.28 3e1f n GLN 365 Ca 0.00 -3.43 -0.38 0.00 -0.01 0.00 0.00 57.00 53.18 3e1f n GLN 365 Cb 0.00 -2.02 -0.12 0.00 1.02 0.00 0.00 30.24 29.12 3e1f n GLN 365 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3e1f s VAL 366 N -3.83 4.84 0.27 5.09 1.01 -1.11 -4.90 120.40 121.77 3e1f s VAL 366 Ca 0.50 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.31 3e1f s VAL 366 Cb 0.43 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 33.41 3e1f s VAL 366 CO 0.01 0.21 0.55 -0.04 0.00 0.00 0.00 175.10 175.83 3e1f s MET 367 N 1.68 3.67 0.02 2.72 -1.94 -1.26 -4.77 119.30 119.42 3e1f s MET 367 Ca 0.06 0.08 -0.04 0.00 -1.71 0.00 0.00 55.69 54.09 3e1f s MET 367 Cb -0.16 -2.65 -0.01 0.00 2.01 0.00 0.00 34.83 34.02 3e1f s MET 367 CO 0.08 0.24 0.05 0.16 -0.01 0.00 0.00 175.02 175.53 3e1f s ASP 368 N -2.95 0.18 0.21 3.03 -4.77 -1.26 -5.00 116.67 106.12 3e1f s ASP 368 Ca 0.45 -0.47 -0.11 0.00 -3.30 0.00 0.00 52.55 49.13 3e1f s ASP 368 Cb -0.11 0.17 0.30 0.00 -1.09 0.00 0.00 42.92 42.19 3e1f s ASP 368 CO 0.28 -0.40 1.66 -0.08 0.70 0.00 0.00 175.17 177.34 3e1f h GLU 369 N 4.18 0.12 -0.28 2.11 4.81 -1.99 -2.42 114.58 121.11 3e1f h GLU 369 Ca -0.32 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.95 3e1f h GLU 369 Cb 1.19 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 3e1f h GLU 369 CO 0.45 0.08 -0.00 0.37 -0.73 0.00 0.00 179.01 179.18 3e1f h GLN 370 N 0.13 0.08 -0.87 1.92 4.15 -1.99 -0.02 115.11 118.51 3e1f h GLN 370 Ca 0.32 -0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 3e1f h GLN 370 Cb 0.53 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 3e1f h GLN 370 CO -0.52 0.05 0.43 1.15 -1.93 0.00 0.00 178.83 178.01 3e1f h THR 371 N 0.08 1.26 0.97 2.39 2.02 -1.90 -1.69 112.91 116.05 3e1f h THR 371 Ca 0.13 -0.71 -0.05 0.00 0.77 0.00 0.00 66.41 66.55 3e1f h THR 371 Cb 0.18 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.73 3e1f h THR 371 CO -0.23 0.31 -0.47 0.24 0.37 0.00 0.00 175.52 175.75 3e1f h MET 372 N 1.23 -1.26 -0.96 6.66 2.86 -0.91 -1.68 114.93 120.87 3e1f h MET 372 Ca 0.30 0.09 0.16 0.00 -2.06 0.00 0.00 59.70 58.19 3e1f h MET 372 Cb 0.10 0.29 -0.10 0.00 0.06 0.00 0.00 31.60 31.94 3e1f h MET 372 CO -0.04 -0.84 0.56 0.28 1.06 0.00 0.00 176.91 177.93 3e1f h VAL 373 N -1.34 0.75 0.64 -2.22 2.07 -0.99 -0.01 116.25 115.16 3e1f h VAL 373 Ca -0.13 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 3e1f h VAL 373 Cb 1.00 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3e1f h VAL 373 CO 0.22 0.14 -0.48 -0.61 0.02 0.00 0.00 177.57 176.86 3e1f h GLN 374 N 0.77 -1.04 -0.45 1.57 4.15 -1.16 -0.27 115.11 118.67 3e1f h GLN 374 Ca 0.53 0.07 0.09 0.00 0.77 0.00 0.00 58.65 60.11 3e1f h GLN 374 Cb 0.75 0.24 -0.09 0.00 0.21 0.00 0.00 27.48 28.58 3e1f h GLN 374 CO -0.35 -0.70 -0.17 -0.44 -1.93 0.00 0.00 178.83 175.24 3e1f h ASP 375 N -1.08 -0.59 -0.80 -0.69 3.32 -0.40 -1.02 116.42 115.15 3e1f h ASP 375 Ca -0.08 0.16 0.12 0.00 0.02 0.00 0.00 57.03 57.24 3e1f h ASP 375 Cb 0.90 0.35 -0.08 0.00 0.22 0.00 0.00 39.33 40.71 3e1f h ASP 375 CO 0.03 -0.20 0.42 0.40 -1.72 0.00 0.00 179.24 178.16 3e1f h ILE 376 N -0.07 0.81 -0.12 0.35 2.04 -0.73 0.85 117.51 120.63 3e1f h ILE 376 Ca 0.22 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 3e1f h ILE 376 Cb 0.41 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3e1f h ILE 376 CO -0.50 0.12 0.02 -0.07 0.00 0.00 0.00 178.15 177.71 3e1f h LEU 377 N 0.66 0.20 -0.45 1.44 3.38 0.03 -1.80 115.31 118.77 3e1f h LEU 377 Ca 0.41 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.18 3e1f h LEU 377 Cb 0.49 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 3e1f h LEU 377 CO -0.31 0.42 0.12 -0.07 0.09 0.00 0.00 178.44 178.69 3e1f h LEU 378 N -0.03 0.07 0.32 1.67 3.38 -0.46 0.21 115.31 120.47 3e1f h LEU 378 Ca 0.04 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3e1f h LEU 378 Cb 0.31 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3e1f h LEU 378 CO 0.00 0.07 -0.32 0.24 0.09 0.00 0.00 178.44 178.52 3e1f h MET 379 N 0.27 -0.65 -0.39 1.13 2.86 -0.74 -1.22 114.93 116.19 3e1f h MET 379 Ca 0.22 0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.88 3e1f h MET 379 Cb 0.25 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 3e1f h MET 379 CO -0.26 -0.43 0.13 0.87 1.06 0.00 0.00 176.91 178.28 3e1f h LYS 380 N -0.67 0.56 0.00 1.72 1.57 -1.04 -0.84 116.57 117.87 3e1f h LYS 380 Ca -0.02 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 3e1f h LYS 380 Cb 0.61 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3e1f h LYS 380 CO -0.06 0.49 -0.18 1.96 -0.57 0.00 0.00 179.45 181.09 3e1f h GLN 381 N 0.56 0.00 -0.76 3.15 4.20 -0.20 -2.42 115.11 119.63 3e1f h GLN 381 Ca 0.14 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 58.44 3e1f h GLN 381 Cb 0.16 0.00 -0.24 0.00 0.30 0.00 0.00 27.48 27.70 3e1f h GLN 381 CO -0.01 0.18 0.37 0.09 -0.67 0.00 0.00 178.83 178.79 3e1f n ASN 382 N -3.64 3.54 -3.75 1.46 3.02 -0.50 -4.95 115.26 110.45 3e1f n ASN 382 Ca -0.01 -3.69 -0.25 0.00 -0.03 0.00 0.00 54.58 50.60 3e1f n ASN 382 Cb 0.31 -0.77 0.04 0.00 -0.61 0.00 0.00 39.78 38.75 3e1f n ASN 382 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3e1f n ASN 383 N -1.12 -3.26 -4.82 6.41 3.02 -0.91 -3.90 115.26 110.68 3e1f n ASN 383 Ca 0.50 -0.75 -0.32 0.00 -0.03 0.00 0.00 54.58 53.98 3e1f n ASN 383 Cb 1.37 -4.20 -0.06 0.00 -0.61 0.00 0.00 39.78 36.28 3e1f n ASN 383 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3e1f s PHE 384 N -3.46 3.33 0.00 3.10 0.40 -0.43 -4.84 117.98 116.08 3e1f s PHE 384 Ca 0.33 0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.85 3e1f s PHE 384 Cb -0.16 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.65 3e1f s PHE 384 CO 0.80 0.56 0.18 0.27 0.70 0.00 0.00 175.22 177.73 3e1f n ASN 385 N 0.81 0.36 -3.84 1.36 0.23 0.24 -4.21 115.26 110.22 3e1f n ASN 385 Ca -0.10 -0.98 -0.10 0.00 -0.53 0.00 0.00 54.58 52.86 3e1f n ASN 385 Cb 0.52 0.01 -0.08 0.00 -2.08 0.00 0.00 39.78 38.15 3e1f n ASN 385 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3e1f s ALA 386 N -0.01 -0.37 -0.00 -2.53 0.00 -1.15 0.09 121.76 117.79 3e1f s ALA 386 Ca 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 51.96 51.58 3e1f s ALA 386 Cb 0.00 0.33 -0.00 0.00 0.00 0.00 0.00 23.12 23.45 3e1f s ALA 386 CO 0.00 -0.40 0.10 0.54 0.00 0.00 0.00 175.76 176.00 3e1f s VAL 387 N -2.87 0.07 -0.17 0.00 0.11 0.39 -2.29 120.40 115.63 3e1f s VAL 387 Ca -0.03 -0.57 -0.01 0.00 -2.93 0.00 0.00 61.98 58.44 3e1f s VAL 387 Cb 0.00 -0.34 -0.00 0.00 -1.53 0.00 0.00 36.38 34.51 3e1f s VAL 387 CO -0.06 -0.32 -0.12 -0.60 -3.33 0.00 0.00 175.10 170.68 3e1f s ARG 388 N -1.06 3.28 -1.05 1.54 3.52 -0.78 -1.66 118.95 122.74 3e1f s ARG 388 Ca -0.12 -0.70 -0.10 0.00 -0.13 0.00 0.00 55.73 54.69 3e1f s ARG 388 Cb -0.07 -2.74 -0.07 0.00 -1.56 0.00 0.00 34.95 30.51 3e1f s ARG 388 CO 0.01 -0.03 2.23 0.00 -0.81 0.00 0.00 175.30 176.70 3e1f s SER 390 N 3.46 6.43 -0.40 0.00 1.04 -1.26 -0.35 113.70 122.62 3e1f s SER 390 Ca 0.48 1.82 0.10 0.00 0.48 0.00 0.00 55.95 58.83 3e1f s SER 390 Cb 0.12 -2.53 0.32 0.00 0.10 0.00 0.00 66.02 64.03 3e1f s SER 390 CO -0.02 -1.19 0.69 1.41 0.98 0.00 0.00 173.24 175.12 3e1f n HIS 391 N 8.19 0.40 -3.63 5.02 -0.00 -1.26 -4.15 115.22 119.78 3e1f n HIS 391 Ca 0.19 -3.77 -0.03 0.00 -0.00 0.00 0.00 57.72 54.10 3e1f n HIS 391 Cb 0.44 -0.41 -0.03 0.00 -0.00 0.00 0.00 29.99 30.00 3e1f n HIS 391 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3e1f s TYR 392 N -2.18 -0.06 0.30 4.41 -0.85 0.53 -4.28 117.35 115.22 3e1f s TYR 392 Ca 0.39 0.05 -0.30 0.00 -0.52 0.00 0.00 57.07 56.70 3e1f s TYR 392 Cb 0.29 0.50 -0.12 0.00 0.38 0.00 0.00 41.96 43.01 3e1f s TYR 392 CO -0.09 -0.08 1.44 -2.30 -1.52 0.00 0.00 175.55 173.00 3e1f n PRO 393 N 0.10 2.33 -2.23 -3.49 -0.02 -0.70 -4.63 135.00 126.34 3e1f n PRO 393 Ca 0.03 0.82 -0.26 0.00 -2.02 0.00 0.00 63.50 62.07 3e1f n PRO 393 Cb 0.57 -2.50 0.05 0.00 -0.02 0.00 0.00 33.50 31.60 3e1f n PRO 393 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3e1f s ASN 394 N 0.13 5.12 0.27 2.55 -0.87 -1.26 -4.81 114.94 116.08 3e1f s ASN 394 Ca 0.62 0.61 -0.30 0.00 -1.57 0.00 0.00 52.86 52.21 3e1f s ASN 394 Cb -0.56 -1.38 -0.13 0.00 -0.02 0.00 0.00 41.25 39.15 3e1f s ASN 394 CO 0.55 -1.40 1.35 1.57 -2.57 0.00 0.00 177.10 176.59 3e1f n HIS 395 N -2.82 2.14 -0.37 2.20 -0.00 -1.26 -4.86 115.22 110.25 3e1f n HIS 395 Ca 0.07 0.49 0.28 0.00 -0.00 0.00 0.00 57.72 58.56 3e1f n HIS 395 Cb 0.59 -2.43 0.57 0.00 -0.00 0.00 0.00 29.99 28.72 3e1f n HIS 395 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3e1f h PRO 396 N 3.59 0.26 -0.61 1.57 0.13 -1.96 -1.42 132.00 133.57 3e1f h PRO 396 Ca -0.45 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 3e1f h PRO 396 Cb 1.28 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 3e1f h PRO 396 CO 0.71 0.17 0.16 1.25 -0.23 0.00 0.00 178.00 180.06 3e1f h LEU 397 N 0.27 0.88 -0.52 1.56 5.85 -2.01 -3.18 115.31 118.16 3e1f h LEU 397 Ca 0.68 -0.16 0.10 0.00 0.84 0.00 0.00 57.88 59.34 3e1f h LEU 397 Cb 1.92 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 42.62 3e1f h LEU 397 CO -0.34 0.85 -0.19 -0.25 -0.34 0.00 0.00 178.44 178.17 3e1f h TRP 398 N 0.90 -0.45 -0.77 1.25 2.91 -1.61 -0.64 115.95 117.55 3e1f h TRP 398 Ca 0.20 0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.27 3e1f h TRP 398 Cb 0.31 0.28 -0.04 0.00 -0.51 0.00 0.00 29.16 29.20 3e1f h TRP 398 CO 0.02 -0.28 0.49 1.88 -1.03 0.00 0.00 178.44 179.52 3e1f h TYR 399 N -0.06 0.98 -0.79 2.65 -1.99 -1.69 -0.49 116.97 115.57 3e1f h TYR 399 Ca 0.25 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.97 3e1f h TYR 399 Cb 0.44 -0.33 -0.04 0.00 2.00 0.00 0.00 36.73 38.81 3e1f h TYR 399 CO -0.48 0.63 0.40 1.15 -0.00 0.00 0.00 178.16 179.86 3e1f h THR 400 N 1.05 1.24 -0.05 -2.88 2.02 -1.22 -1.05 112.91 112.01 3e1f h THR 400 Ca 0.28 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 3e1f h THR 400 Cb -0.09 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 3e1f h THR 400 CO -0.06 0.28 -0.02 -0.07 0.37 0.00 0.00 175.52 176.03 3e1f h LEU 401 N 1.10 0.11 -2.15 2.58 3.38 -0.18 -2.58 115.31 117.57 3e1f h LEU 401 Ca 0.27 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.88 3e1f h LEU 401 Cb 0.08 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3e1f h LEU 401 CO -0.04 0.47 0.07 0.00 0.09 0.00 0.00 178.44 179.04 3e1f h ASP 403 N 0.00 -0.23 0.07 0.00 5.19 -0.97 -1.71 116.42 118.78 3e1f h ASP 403 Ca 0.04 -0.19 -0.28 0.00 -0.62 0.00 0.00 57.03 55.98 3e1f h ASP 403 Cb 0.19 0.06 0.03 0.00 0.18 0.00 0.00 39.33 39.78 3e1f h ASP 403 CO -0.00 0.07 -1.15 0.03 -3.12 0.00 0.00 179.24 175.08 3e1f h ARG 404 N -0.55 0.65 0.00 3.56 3.08 -0.95 -3.32 114.38 116.84 3e1f h ARG 404 Ca -0.03 -0.79 -0.09 0.00 0.07 0.00 0.00 59.98 59.14 3e1f h ARG 404 Cb 0.41 0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3e1f h ARG 404 CO 0.05 1.35 -0.43 1.88 -1.07 0.00 0.00 179.97 181.75 3e1f h TYR 405 N 0.30 0.00 -0.88 3.04 0.05 -0.40 -3.44 116.97 115.63 3e1f h TYR 405 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.62 3e1f h TYR 405 Cb 1.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.56 3e1f h TYR 405 CO 0.11 0.43 0.00 0.41 -1.05 0.00 0.00 178.16 178.06 3e1f n GLY 406 N 1.11 -0.67 3.32 3.88 0.00 -0.74 -4.85 105.19 107.23 3e1f n GLY 406 Ca 0.02 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 3e1f n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e1f s LEU 407 N -0.07 -0.15 -0.02 0.99 1.43 -0.72 -4.70 118.68 115.44 3e1f s LEU 407 Ca 0.00 0.96 -0.30 0.00 -1.03 0.00 0.00 54.13 53.76 3e1f s LEU 407 Cb 0.00 1.47 -0.03 0.00 0.03 0.00 0.00 46.19 47.66 3e1f s LEU 407 CO 0.00 -0.19 1.08 -0.31 0.23 0.00 0.00 176.35 177.16 3e1f s TYR 408 N 1.32 3.48 -0.02 0.29 2.02 0.11 -4.68 117.35 119.88 3e1f s TYR 408 Ca -0.09 1.49 0.05 0.00 -0.37 0.00 0.00 57.07 58.15 3e1f s TYR 408 Cb -0.08 -3.27 -0.03 0.00 -0.40 0.00 0.00 41.96 38.19 3e1f s TYR 408 CO -0.12 -0.62 -0.17 0.08 -1.57 0.00 0.00 175.55 173.15 3e1f s VAL 409 N 1.47 2.81 -0.38 0.71 1.01 0.27 -0.47 120.40 125.83 3e1f s VAL 409 Ca 0.54 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 3e1f s VAL 409 Cb -0.23 -2.11 0.07 0.00 0.00 0.00 0.00 36.38 34.11 3e1f s VAL 409 CO 0.25 0.51 0.18 -0.69 0.00 0.00 0.00 175.10 175.35 3e1f s VAL 410 N -0.77 3.83 -0.26 2.92 1.01 -0.67 -1.29 120.40 125.17 3e1f s VAL 410 Ca 0.12 -1.42 -0.25 0.00 0.00 0.00 0.00 61.98 60.44 3e1f s VAL 410 Cb -0.10 -3.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 3e1f s VAL 410 CO 0.02 -0.40 0.83 -0.62 0.00 0.00 0.00 175.10 174.94 3e1f s ASP 411 N 1.76 6.80 -0.14 3.32 2.15 -0.68 -1.79 116.67 128.09 3e1f s ASP 411 Ca 0.02 0.94 0.01 0.00 0.43 0.00 0.00 52.55 53.95 3e1f s ASP 411 Cb -0.22 -2.43 -0.00 0.00 -0.30 0.00 0.00 42.92 39.97 3e1f s ASP 411 CO 0.01 -0.56 -0.16 -0.70 -0.17 0.00 0.00 175.17 173.59 3e1f s GLU 412 N 2.92 3.23 0.66 4.34 2.12 -1.26 -0.67 118.70 130.03 3e1f s GLU 412 Ca 0.35 -0.76 -0.18 0.00 0.36 0.00 0.00 54.97 54.75 3e1f s GLU 412 Cb -0.15 -2.57 -0.01 0.00 0.26 0.00 0.00 34.13 31.66 3e1f s GLU 412 CO 0.09 0.09 1.21 0.00 -0.54 0.00 0.00 175.26 176.11 3e1f n ALA 413 N 3.84 0.80 -2.39 6.30 0.00 -0.81 -1.73 120.51 126.52 3e1f n ALA 413 Ca -0.19 -0.04 -0.43 0.00 0.00 0.00 0.00 53.44 52.79 3e1f n ALA 413 Cb 0.52 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.70 3e1f n ALA 413 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3e1f n ASN 414 N -1.79 4.71 -3.45 0.00 5.15 -1.26 -4.01 115.26 114.60 3e1f n ASN 414 Ca 0.15 -2.92 -0.21 0.00 -0.60 0.00 0.00 54.58 51.00 3e1f n ASN 414 Cb 0.48 -1.68 -0.12 0.00 -0.53 0.00 0.00 39.78 37.94 3e1f n ASN 414 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3e1f s ILE 415 N 3.24 -0.28 -0.03 -1.44 1.01 -1.25 -4.74 121.20 117.70 3e1f s ILE 415 Ca 0.49 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.59 3e1f s ILE 415 Cb 0.06 -0.97 0.03 0.00 0.01 0.00 0.00 42.46 41.59 3e1f s ILE 415 CO 0.02 -0.54 -0.01 -0.70 0.00 0.00 0.00 174.94 173.71 3e1f s GLU 416 N 2.27 0.40 -0.08 2.79 2.12 0.12 -1.04 118.70 125.29 3e1f s GLU 416 Ca 0.09 0.04 0.22 0.00 0.36 0.00 0.00 54.97 55.68 3e1f s GLU 416 Cb -0.15 -0.55 0.43 0.00 0.26 0.00 0.00 34.13 34.13 3e1f s GLU 416 CO -0.33 -0.12 1.18 0.25 -0.54 0.00 0.00 175.26 175.69 3e1f n THR 417 N 4.11 0.70 0.26 -1.70 -2.24 -0.90 -1.42 114.28 113.10 3e1f n THR 417 Ca -0.26 -1.78 0.13 0.00 -2.27 0.00 0.00 64.05 59.87 3e1f n THR 417 Cb 0.50 0.67 0.56 0.00 -2.10 0.00 0.00 70.33 69.96 3e1f n THR 417 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3e1f h GLU 418 N 1.16 0.00 0.00 -0.78 4.81 -1.06 0.88 114.58 119.59 3e1f h GLU 418 Ca -0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3e1f h GLU 418 Cb 1.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.01 3e1f h GLU 418 CO 0.10 0.00 0.00 0.78 -0.73 0.00 0.00 179.01 179.16 3e1f h GLY 419 N 0.00 0.00 -1.10 1.92 0.00 -1.86 -3.46 103.07 98.57 3e1f h GLY 419 Ca 0.06 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.91 3e1f h GLY 419 CO -0.00 0.00 0.25 1.06 0.00 0.00 0.00 176.54 177.85 3e1f s MET 420 N -3.36 1.31 -0.16 4.80 -1.94 0.30 -4.81 119.30 115.44 3e1f s MET 420 Ca 0.05 0.83 -0.04 0.00 -1.71 0.00 0.00 55.69 54.82 3e1f s MET 420 Cb 0.07 -1.81 0.07 0.00 2.01 0.00 0.00 34.83 35.17 3e1f s MET 420 CO 0.61 -2.21 0.18 0.08 -0.01 0.00 0.00 175.02 173.67 3e1f s VAL 421 N -2.94 -0.26 0.91 -6.03 1.01 -1.26 -3.48 120.40 108.36 3e1f s VAL 421 Ca 0.63 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 62.51 3e1f s VAL 421 Cb -0.18 -0.55 0.14 0.00 0.00 0.00 0.00 36.38 35.79 3e1f s VAL 421 CO 0.57 -0.12 1.09 -2.16 0.00 0.00 0.00 175.10 174.49 3e1f s PRO 422 N 2.28 1.13 0.64 2.72 0.04 -1.26 -4.85 135.00 135.70 3e1f s PRO 422 Ca 0.05 0.71 0.27 0.00 0.04 0.00 0.00 61.00 62.07 3e1f s PRO 422 Cb -0.15 -1.80 1.43 0.00 0.04 0.00 0.00 34.50 34.02 3e1f s PRO 422 CO -0.10 -2.30 1.82 1.98 0.04 0.00 0.00 177.00 178.45 3e1f h MET 423 N -1.59 0.00 -0.46 4.56 4.05 -1.89 -0.35 114.93 119.26 3e1f h MET 423 Ca -0.50 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 58.84 3e1f h MET 423 Cb 1.30 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 32.05 3e1f h MET 423 CO 0.56 0.00 0.07 0.27 0.23 0.00 0.00 176.91 178.04 3e1f n ASN 424 N -3.13 4.35 -0.05 1.39 6.94 -1.26 -3.55 115.26 119.95 3e1f n ASN 424 Ca 0.02 -3.15 0.12 0.00 -0.02 0.00 0.00 54.58 51.56 3e1f n ASN 424 Cb 0.55 -0.64 0.52 0.00 -2.36 0.00 0.00 39.78 37.86 3e1f n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3e1f h ARG 425 N 2.37 0.34 0.01 -3.83 2.43 -1.38 -1.86 114.38 112.47 3e1f h ARG 425 Ca 0.10 -0.02 -0.32 0.00 -0.81 0.00 0.00 59.98 58.93 3e1f h ARG 425 Cb 1.82 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 31.25 3e1f h ARG 425 CO 0.44 0.22 -1.73 1.28 -1.51 0.00 0.00 179.97 178.67 3e1f n LEU 426 N -4.46 2.02 0.07 3.80 4.77 -1.26 -3.91 117.00 118.02 3e1f n LEU 426 Ca 0.09 0.35 0.05 0.00 -0.03 0.00 0.00 56.01 56.47 3e1f n LEU 426 Cb 0.37 -0.94 0.26 0.00 -2.33 0.00 0.00 43.42 40.77 3e1f n LEU 426 CO 0.34 0.45 0.65 0.35 -1.33 0.00 0.00 177.39 177.85 3e1f n THR 427 N -4.23 1.54 0.60 -5.08 -2.24 -1.17 -0.91 114.28 102.80 3e1f n THR 427 Ca -0.39 0.57 0.07 0.00 -2.27 0.00 0.00 64.05 62.03 3e1f n THR 427 Cb 0.79 -1.56 0.01 0.00 -2.10 0.00 0.00 70.33 67.47 3e1f n THR 427 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3e1f n ASP 428 N -1.82 1.54 -4.57 3.42 2.03 -0.71 -1.93 116.55 114.51 3e1f n ASP 428 Ca -0.00 -1.27 -0.42 0.00 0.52 0.00 0.00 54.79 53.62 3e1f n ASP 428 Cb 0.03 0.41 -0.07 0.00 -0.72 0.00 0.00 41.12 40.78 3e1f n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3e1f s ASP 429 N -1.62 6.43 0.65 1.67 -1.08 -0.09 -4.52 116.67 118.12 3e1f s ASP 429 Ca 0.12 0.18 0.34 0.00 -0.52 0.00 0.00 52.55 52.67 3e1f s ASP 429 Cb 0.11 -2.33 1.84 0.00 -1.46 0.00 0.00 42.92 41.08 3e1f s ASP 429 CO 0.32 -0.57 2.07 1.55 0.52 0.00 0.00 175.17 179.06 3e1f h PRO 430 N 8.42 0.00 0.00 4.34 0.13 -1.91 0.20 132.00 143.18 3e1f h PRO 430 Ca -0.26 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 3e1f h PRO 430 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3e1f h PRO 430 CO 0.83 0.00 -0.11 -0.09 -0.23 0.00 0.00 178.00 178.40 3e1f h ARG 431 N 0.00 0.00 -0.39 0.86 2.43 -1.92 -2.28 114.38 113.08 3e1f h ARG 431 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3e1f h ARG 431 Cb 0.50 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3e1f h ARG 431 CO -0.00 0.11 0.00 0.91 -1.51 0.00 0.00 179.97 179.48 3e1f n TRP 432 N -3.48 0.50 -0.30 2.20 7.02 0.05 -4.46 117.44 118.98 3e1f n TRP 432 Ca -0.01 -0.28 -0.01 0.00 -1.02 0.00 0.00 57.50 56.18 3e1f n TRP 432 Cb 0.26 -0.00 0.16 0.00 -2.42 0.00 0.00 31.31 29.32 3e1f n TRP 432 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3e1f h LEU 433 N 4.11 1.02 0.67 -0.99 5.85 -1.43 -2.60 115.31 121.94 3e1f h LEU 433 Ca 0.00 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 3e1f h LEU 433 Cb 0.93 -0.26 0.01 0.00 0.37 0.00 0.00 40.66 41.71 3e1f h LEU 433 CO 0.00 0.76 -0.32 -0.65 -0.34 0.00 0.00 178.44 177.89 3e1f h PRO 434 N 1.19 -0.87 -0.42 5.25 0.11 -1.78 0.12 132.00 135.60 3e1f h PRO 434 Ca 0.31 0.06 0.08 0.00 0.11 0.00 0.00 66.00 66.56 3e1f h PRO 434 Cb -0.09 0.20 -0.07 0.00 0.11 0.00 0.00 31.00 31.14 3e1f h PRO 434 CO -0.06 -0.56 -0.01 0.00 -0.21 0.00 0.00 178.00 177.15 3e1f h ALA 435 N -0.67 0.37 0.18 -0.75 0.00 -1.70 -2.43 119.26 114.26 3e1f h ALA 435 Ca -0.09 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3e1f h ALA 435 Cb 0.71 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3e1f h ALA 435 CO 0.15 -0.40 -0.09 0.52 0.00 0.00 0.00 179.25 179.44 3e1f h MET 436 N 0.09 -0.23 -1.00 0.00 2.86 -1.43 -3.07 114.93 112.15 3e1f h MET 436 Ca 0.21 0.02 0.18 0.00 -2.06 0.00 0.00 59.70 58.04 3e1f h MET 436 Cb 0.30 0.05 -0.18 0.00 0.06 0.00 0.00 31.60 31.84 3e1f h MET 436 CO -0.36 -0.12 -0.32 0.45 1.06 0.00 0.00 176.91 177.62 3e1f n SER 437 N -5.17 -0.51 0.24 1.22 2.88 0.41 -0.53 113.62 112.16 3e1f n SER 437 Ca -0.09 1.73 0.08 0.00 -1.33 0.00 0.00 58.87 59.27 3e1f n SER 437 Cb 0.13 -0.46 0.58 0.00 -0.75 0.00 0.00 64.21 63.72 3e1f n SER 437 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 3e1f h GLU 438 N 0.00 0.00 0.00 -1.46 5.08 -1.39 0.13 114.58 116.94 3e1f h GLU 438 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 3e1f h GLU 438 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3e1f h GLU 438 CO -1.01 0.19 0.00 0.00 -1.00 0.00 0.00 179.01 177.19 3e1f h ARG 439 N 0.00 0.00 0.00 2.33 3.08 -0.77 -2.54 114.38 116.48 3e1f h ARG 439 Ca -0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 3e1f h ARG 439 Cb 0.39 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3e1f h ARG 439 CO 0.02 0.00 -1.15 0.28 -1.07 0.00 0.00 179.97 178.05 3e1f n VAL 440 N -2.62 1.48 -0.24 2.04 0.31 -0.78 -4.12 118.33 114.41 3e1f n VAL 440 Ca 0.05 0.05 -0.03 0.00 -0.01 0.00 0.00 64.34 64.40 3e1f n VAL 440 Cb 0.45 -2.24 0.09 0.00 -0.91 0.00 0.00 33.84 31.23 3e1f n VAL 440 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3e1f h THR 441 N -1.00 1.05 0.00 2.52 1.35 -0.90 -2.12 112.91 113.80 3e1f h THR 441 Ca -0.17 -0.27 -0.04 0.00 -0.55 0.00 0.00 66.41 65.37 3e1f h THR 441 Cb 1.00 0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.59 3e1f h THR 441 CO -0.10 0.15 -0.20 0.03 -0.25 0.00 0.00 175.52 175.14 3e1f h ARG 442 N 0.80 0.00 -0.05 4.72 3.08 -1.67 0.01 114.38 121.28 3e1f h ARG 442 Ca 0.29 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.28 3e1f h ARG 442 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3e1f h ARG 442 CO -0.14 0.20 -0.22 1.98 -1.07 0.00 0.00 179.97 180.73 3e1f h MET 443 N 0.00 0.24 0.02 0.04 4.05 -1.59 -2.68 114.93 115.01 3e1f h MET 443 Ca -0.00 -0.19 -0.00 0.00 -0.28 0.00 0.00 59.70 59.23 3e1f h MET 443 Cb 0.55 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 3e1f h MET 443 CO 0.03 0.83 -0.01 0.28 0.23 0.00 0.00 176.91 178.27 3e1f h VAL 444 N -0.30 0.99 -0.00 -5.77 2.07 -0.99 -0.29 116.25 111.96 3e1f h VAL 444 Ca -0.01 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3e1f h VAL 444 Cb 0.87 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3e1f h VAL 444 CO 0.05 0.01 0.00 1.56 0.02 0.00 0.00 177.57 179.21 3e1f h GLN 445 N -0.04 0.00 0.00 1.57 4.20 -1.08 -0.10 115.11 119.66 3e1f h GLN 445 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 3e1f h GLN 445 Cb 0.03 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 3e1f h GLN 445 CO 0.00 0.00 -0.27 -0.09 -0.67 0.00 0.00 178.83 177.81 3e1f h ARG 446 N 0.00 0.00 -0.01 1.46 2.43 -1.01 -2.94 114.38 114.31 3e1f h ARG 446 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3e1f h ARG 446 Cb 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3e1f h ARG 446 CO -0.00 0.68 -0.36 -0.25 -1.51 0.00 0.00 179.97 178.53 3e1f n ASP 447 N -4.62 1.41 0.23 -3.80 8.00 -0.19 -4.02 116.55 113.57 3e1f n ASP 447 Ca -0.11 -1.13 0.09 0.00 0.71 0.00 0.00 54.79 54.34 3e1f n ASP 447 Cb 0.38 0.29 0.45 0.00 -0.02 0.00 0.00 41.12 42.23 3e1f n ASP 447 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 3e1f h ARG 448 N 1.65 0.00 0.00 -1.24 0.11 -1.20 -1.23 114.38 112.47 3e1f h ARG 448 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3e1f h ARG 448 Cb 0.60 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.68 3e1f h ARG 448 CO 0.00 0.00 -0.81 0.09 0.10 0.00 0.00 179.97 179.35 3e1f n ASN 449 N -2.32 0.63 -4.67 0.08 3.02 -1.26 -4.88 115.26 105.86 3e1f n ASN 449 Ca -0.01 -0.15 -0.42 0.00 -0.03 0.00 0.00 54.58 53.97 3e1f n ASN 449 Cb 0.41 0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 40.06 3e1f n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3e1f s HIS 450 N -3.14 2.65 0.34 3.10 3.76 -0.47 -4.88 115.29 116.65 3e1f s HIS 450 Ca 0.06 0.74 0.18 0.00 -0.15 0.00 0.00 55.06 55.89 3e1f s HIS 450 Cb 0.15 -3.67 0.92 0.00 1.11 0.00 0.00 32.58 31.09 3e1f s HIS 450 CO 0.76 -2.52 1.88 -1.00 -0.85 0.00 0.00 174.74 173.01 3e1f h PRO 451 N 8.35 0.00 0.00 8.40 0.13 -1.89 -2.68 132.00 144.32 3e1f h PRO 451 Ca -0.35 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 3e1f h PRO 451 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 3e1f h PRO 451 CO 0.93 0.29 -0.08 0.66 -0.23 0.00 0.00 178.00 179.58 3e1f h SER 452 N 0.00 0.00 -3.53 1.44 4.64 -1.87 -3.39 113.55 110.84 3e1f h SER 452 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 3e1f h SER 452 Cb 0.61 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.63 3e1f h SER 452 CO 0.04 0.08 0.90 -0.69 -0.87 0.00 0.00 176.83 176.29 3e1f s VAL 453 N -4.07 4.33 -0.14 0.95 1.01 -1.01 0.97 120.40 122.43 3e1f s VAL 453 Ca -0.02 1.44 0.10 0.00 0.00 0.00 0.00 61.98 63.49 3e1f s VAL 453 Cb 0.12 -4.52 -0.13 0.00 0.00 0.00 0.00 36.38 31.85 3e1f s VAL 453 CO 0.55 -0.78 0.27 2.30 0.00 0.00 0.00 175.10 177.44 3e1f n ILE 454 N 6.43 0.00 -3.88 2.22 -5.35 -0.41 -4.91 119.36 113.46 3e1f n ILE 454 Ca 0.12 -0.24 -0.11 0.00 -0.27 0.00 0.00 62.75 62.25 3e1f n ILE 454 Cb 0.48 0.50 -0.12 0.00 -1.74 0.00 0.00 39.64 38.76 3e1f n ILE 454 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3e1f s ILE 455 N -2.43 0.04 -0.14 7.28 1.01 -1.16 -3.92 121.20 121.88 3e1f s ILE 455 Ca -0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.28 3e1f s ILE 455 Cb 0.06 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.32 3e1f s ILE 455 CO 0.39 -0.17 0.03 0.26 0.00 0.00 0.00 174.94 175.46 3e1f s TRP 456 N -0.51 3.22 -0.04 3.97 0.52 -0.46 -1.68 118.94 123.96 3e1f s TRP 456 Ca -0.06 0.11 0.04 0.00 0.02 0.00 0.00 56.10 56.22 3e1f s TRP 456 Cb -0.04 -1.94 -0.03 0.00 -1.15 0.00 0.00 33.47 30.32 3e1f s TRP 456 CO 0.00 0.30 -0.16 0.45 0.02 0.00 0.00 176.95 177.56 3e1f s SER 457 N -0.23 3.89 0.00 2.95 0.15 0.16 -0.47 113.70 120.15 3e1f s SER 457 Ca 0.07 -0.25 0.12 0.00 0.70 0.00 0.00 55.95 56.59 3e1f s SER 457 Cb -0.12 -0.77 0.57 0.00 -1.71 0.00 0.00 66.02 63.99 3e1f s SER 457 CO 0.02 0.33 1.39 0.18 1.20 0.00 0.00 173.24 176.36 3e1f n LEU 458 N 2.25 0.65 0.00 3.45 4.77 -0.99 -1.92 117.00 125.21 3e1f n LEU 458 Ca -0.17 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 3e1f n LEU 458 Cb 0.52 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3e1f n LEU 458 CO 0.25 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3e1f n GLY 459 N 0.82 0.60 3.17 -0.72 0.00 -1.26 -4.70 105.19 103.10 3e1f n GLY 459 Ca 0.10 -2.07 -0.10 0.00 0.00 0.00 0.00 46.02 43.94 3e1f n GLY 459 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3e1f s ASN 460 N -4.00 0.04 -0.14 1.61 2.47 -0.20 -4.79 114.94 109.92 3e1f s ASN 460 Ca 0.00 -0.36 -0.08 0.00 0.42 0.00 0.00 52.86 52.84 3e1f s ASN 460 Cb 0.00 0.27 0.01 0.00 -1.45 0.00 0.00 41.25 40.09 3e1f s ASN 460 CO 0.00 -0.53 0.17 -0.62 -3.72 0.00 0.00 177.10 172.40 3e1f n GLU 461 N 0.79 -0.48 -2.50 0.43 1.02 -1.26 -3.96 120.64 114.68 3e1f n GLU 461 Ca -0.19 0.33 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 3e1f n GLU 461 Cb 0.58 -0.54 0.07 0.00 -0.02 0.00 0.00 31.44 31.53 3e1f n GLU 461 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3e1f n SER 462 N 0.44 0.25 0.00 1.62 7.64 -1.26 -0.53 113.62 121.77 3e1f n SER 462 Ca -0.04 -2.09 0.00 0.00 1.01 0.00 0.00 58.87 57.75 3e1f n SER 462 Cb 0.18 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 3e1f n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3e1f n GLY 463 N -0.78 0.81 2.62 0.23 0.00 -1.23 -4.21 105.19 102.63 3e1f n GLY 463 Ca -0.05 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 3e1f n GLY 463 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3e1f s HIS 464 N 0.00 0.96 0.44 1.61 2.46 -1.26 -3.26 115.29 116.25 3e1f s HIS 464 Ca 0.00 -1.33 0.08 0.00 0.47 0.00 0.00 55.06 54.28 3e1f s HIS 464 Cb 0.00 -1.26 -0.00 0.00 -0.13 0.00 0.00 32.58 31.19 3e1f s HIS 464 CO 0.00 -0.85 0.44 0.20 -2.47 0.00 0.00 174.74 172.06 3e1f s GLY 465 N 1.77 2.11 0.25 1.59 0.00 -1.26 -4.91 107.32 106.87 3e1f s GLY 465 Ca 0.10 -1.81 -0.04 0.00 0.00 0.00 0.00 44.72 42.97 3e1f s GLY 465 CO -0.28 -1.69 1.87 0.00 0.00 0.00 0.00 173.10 173.00 3e1f h ALA 466 N 0.88 1.27 -1.01 3.20 0.00 -1.79 -2.02 119.26 119.79 3e1f h ALA 466 Ca -0.40 -0.02 0.24 0.00 0.00 0.00 0.00 54.91 54.73 3e1f h ALA 466 Cb 1.27 -0.28 -0.12 0.00 0.00 0.00 0.00 17.79 18.66 3e1f h ALA 466 CO 0.54 0.38 0.60 -0.91 0.00 0.00 0.00 179.25 179.87 3e1f h ASN 467 N 1.09 0.68 -0.58 0.00 2.35 -1.69 0.23 115.58 117.67 3e1f h ASN 467 Ca 0.40 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 56.27 3e1f h ASN 467 Cb 0.13 0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 3e1f h ASN 467 CO -0.16 0.13 0.33 0.45 -1.65 0.00 0.00 177.43 176.53 3e1f h HIS 468 N 0.60 0.78 -0.61 1.19 3.86 -1.51 -0.54 115.15 118.91 3e1f h HIS 468 Ca 0.64 -0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.74 3e1f h HIS 468 Cb 1.19 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.39 3e1f h HIS 468 CO -0.01 0.55 -0.00 -0.44 0.86 0.00 0.00 177.93 178.89 3e1f h ASP 469 N 0.78 1.06 -0.08 2.45 3.32 -0.63 0.88 116.42 124.20 3e1f h ASP 469 Ca 0.21 -0.31 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 3e1f h ASP 469 Cb 0.01 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.28 3e1f h ASP 469 CO -0.04 1.11 0.03 0.00 -1.72 0.00 0.00 179.24 178.63 3e1f h ALA 470 N 0.99 0.11 -0.02 3.45 0.00 -0.78 -2.03 119.26 120.98 3e1f h ALA 470 Ca 0.17 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3e1f h ALA 470 Cb 0.57 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3e1f h ALA 470 CO 0.03 -0.31 -0.38 -0.07 0.00 0.00 0.00 179.25 178.53 3e1f h LEU 471 N -0.02 0.04 0.51 0.00 3.38 -1.01 -2.17 115.31 116.04 3e1f h LEU 471 Ca 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3e1f h LEU 471 Cb 0.16 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3e1f h LEU 471 CO -0.00 0.42 -0.26 0.22 0.09 0.00 0.00 178.44 178.90 3e1f h TYR 472 N 0.03 -0.69 -0.28 1.13 3.20 -0.54 -2.50 116.97 117.33 3e1f h TYR 472 Ca 0.00 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 3e1f h TYR 472 Cb 0.69 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 3e1f h TYR 472 CO 0.00 -0.42 0.19 -0.09 -1.64 0.00 0.00 178.16 176.20 3e1f h ARG 473 N -0.71 0.33 0.35 1.82 9.65 -1.17 -2.44 114.38 122.21 3e1f h ARG 473 Ca -0.07 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.78 3e1f h ARG 473 Cb 0.56 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.07 3e1f h ARG 473 CO 0.10 0.22 -0.17 2.35 2.80 0.00 0.00 179.97 185.27 3e1f h TRP 474 N 0.34 -0.43 -0.63 2.20 7.01 -1.09 -1.56 115.95 121.79 3e1f h TRP 474 Ca 0.11 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.17 3e1f h TRP 474 Cb 0.02 0.14 -0.06 0.00 -2.10 0.00 0.00 29.16 27.17 3e1f h TRP 474 CO -0.00 -0.21 0.32 0.82 -2.79 0.00 0.00 178.44 176.58 3e1f h ILE 475 N -0.56 0.91 -0.67 2.65 2.04 -1.16 0.16 117.51 120.88 3e1f h ILE 475 Ca -0.05 -0.20 0.05 0.00 1.00 0.00 0.00 64.86 65.66 3e1f h ILE 475 Cb 0.41 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 3e1f h ILE 475 CO 0.08 0.11 0.44 0.11 0.00 0.00 0.00 178.15 178.88 3e1f h LYS 476 N 0.58 0.71 -0.01 2.37 1.79 -1.24 0.54 116.57 121.32 3e1f h LYS 476 Ca 0.29 -0.04 -0.11 0.00 -2.18 0.00 0.00 60.65 58.61 3e1f h LYS 476 Cb 0.24 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 30.74 3e1f h LYS 476 CO -0.21 0.47 -0.43 0.77 -1.08 0.00 0.00 179.45 178.96 3e1f h SER 477 N 0.73 0.39 -0.36 0.86 0.02 -0.18 -3.29 113.55 111.72 3e1f h SER 477 Ca 0.28 -0.76 -0.16 0.00 -0.84 0.00 0.00 61.79 60.31 3e1f h SER 477 Cb 0.17 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 3e1f h SER 477 CO -0.08 1.10 -0.38 0.58 -1.14 0.00 0.00 176.83 176.90 3e1f h VAL 478 N -0.27 1.28 -2.55 2.27 2.07 -0.35 -3.41 116.25 115.28 3e1f h VAL 478 Ca -0.05 -1.56 -0.56 0.00 0.82 0.00 0.00 66.70 65.35 3e1f h VAL 478 Cb 1.16 1.43 -0.38 0.00 -1.52 0.00 0.00 31.29 31.97 3e1f h VAL 478 CO 0.09 0.52 -0.83 -0.62 0.02 0.00 0.00 177.57 176.74 3e1f s ASP 479 N -6.81 2.87 0.38 0.57 2.15 0.19 -4.97 116.67 111.05 3e1f s ASP 479 Ca -0.11 -2.04 0.28 0.00 0.43 0.00 0.00 52.55 51.11 3e1f s ASP 479 Cb 0.11 -0.31 1.19 0.00 -0.30 0.00 0.00 42.92 43.61 3e1f s ASP 479 CO 0.88 -0.32 1.83 -0.65 -0.17 0.00 0.00 175.17 176.74 3e1f h PRO 480 N 7.17 0.00 0.00 4.34 0.11 -1.75 -3.24 132.00 138.63 3e1f h PRO 480 Ca 0.03 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.12 3e1f h PRO 480 Cb 0.98 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 3e1f h PRO 480 CO 0.27 0.00 -0.09 0.66 -0.21 0.00 0.00 178.00 178.64 3e1f h SER 481 N 0.00 0.00 -4.31 -2.05 4.64 -1.91 -3.44 113.55 106.48 3e1f h SER 481 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 3e1f h SER 481 Cb 0.38 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.21 3e1f h SER 481 CO 0.00 0.09 -0.84 -0.13 -0.87 0.00 0.00 176.83 175.08 3e1f s ARG 482 N -4.02 1.38 0.50 4.77 0.52 -1.22 -4.30 118.95 116.59 3e1f s ARG 482 Ca -0.02 -0.85 -0.19 0.00 -0.52 0.00 0.00 55.73 54.15 3e1f s ARG 482 Cb 0.12 -1.44 -0.08 0.00 0.52 0.00 0.00 34.95 34.07 3e1f s ARG 482 CO 0.55 0.37 1.03 -2.14 0.02 0.00 0.00 175.30 175.14 3e1f s PRO 483 N -0.97 3.76 0.00 3.54 0.02 -1.25 -4.83 135.00 135.26 3e1f s PRO 483 Ca 0.07 1.28 0.03 0.00 0.02 0.00 0.00 61.00 62.40 3e1f s PRO 483 Cb -0.08 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 3e1f s PRO 483 CO 0.01 -0.46 -0.07 0.08 -0.33 0.00 0.00 177.00 176.23 3e1f s VAL 484 N -2.13 3.61 0.05 3.83 1.01 -1.26 -1.36 120.40 124.15 3e1f s VAL 484 Ca 0.66 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 3e1f s VAL 484 Cb -0.15 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3e1f s VAL 484 CO 0.23 0.41 -0.00 0.00 0.00 0.00 0.00 175.10 175.74 3e1f s GLN 485 N -1.38 0.60 -0.29 2.72 -2.07 0.38 -0.22 119.66 119.41 3e1f s GLN 485 Ca 0.17 -1.11 -0.16 0.00 -1.82 0.00 0.00 55.36 52.44 3e1f s GLN 485 Cb -0.11 0.21 0.12 0.00 -1.09 0.00 0.00 33.01 32.15 3e1f s GLN 485 CO 0.07 -0.12 0.87 -0.47 -1.32 0.00 0.00 175.29 174.31 3e1f s TYR 486 N -3.59 -0.77 -0.62 9.60 5.04 -1.26 -2.35 117.35 123.40 3e1f s TYR 486 Ca 0.04 1.53 0.24 0.00 -2.44 0.00 0.00 57.07 56.44 3e1f s TYR 486 Cb 0.05 0.46 0.33 0.00 0.35 0.00 0.00 41.96 43.15 3e1f s TYR 486 CO -0.09 -0.38 1.31 1.49 -1.34 0.00 0.00 175.55 176.53 3e1f h GLU 487 N 6.52 0.00 -6.94 4.97 4.22 -1.87 -3.42 114.58 118.06 3e1f h GLU 487 Ca -0.28 0.00 -0.56 0.00 0.08 0.00 0.00 59.36 58.60 3e1f h GLU 487 Cb 1.20 0.00 0.17 0.00 0.50 0.00 0.00 28.75 30.62 3e1f h GLU 487 CO 0.18 0.00 0.23 0.41 -2.18 0.00 0.00 179.01 177.64 3e1f n GLY 488 N 1.33 -0.11 2.34 1.92 0.00 -1.26 -0.47 105.19 108.94 3e1f n GLY 488 Ca 0.03 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 3e1f n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 489 N 1.15 0.77 0.00 -0.02 0.00 -1.20 -3.70 105.19 102.19 3e1f n GLY 489 Ca 0.14 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3e1f n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 490 N -1.60 1.27 4.39 -0.02 0.00 -1.16 -4.71 105.19 103.36 3e1f n GLY 490 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3e1f n GLY 490 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e1f n ALA 491 N -0.43 0.00 -1.69 4.61 0.00 0.38 -4.63 120.51 118.75 3e1f n ALA 491 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3e1f n ALA 491 Cb 0.00 -0.51 0.07 0.00 0.00 0.00 0.00 19.45 19.01 3e1f n ALA 491 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3e1f n ASP 492 N 0.00 1.08 -3.81 0.00 5.68 -1.26 -2.41 116.55 115.82 3e1f n ASP 492 Ca 0.00 -2.54 -0.30 0.00 -0.50 0.00 0.00 54.79 51.45 3e1f n ASP 492 Cb 0.00 -0.32 0.28 0.00 -1.14 0.00 0.00 41.12 39.94 3e1f n ASP 492 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3e1f s THR 493 N -1.29 1.48 -2.00 2.12 -4.23 -1.26 -4.87 115.64 105.60 3e1f s THR 493 Ca 0.18 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.84 3e1f s THR 493 Cb 0.17 -2.04 0.44 0.00 1.34 0.00 0.00 72.50 72.41 3e1f s THR 493 CO -0.01 0.00 1.46 0.35 -0.54 0.00 0.00 174.62 175.87 3e1f n THR 494 N -5.44 0.00 -0.77 3.99 -2.24 -1.26 -2.81 114.28 105.75 3e1f n THR 494 Ca 0.09 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.95 3e1f n THR 494 Cb 0.58 -0.40 0.31 0.00 -2.10 0.00 0.00 70.33 68.73 3e1f n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3e1f n ALA 495 N -0.80 3.16 -3.25 6.98 0.00 -1.26 -4.96 120.51 120.39 3e1f n ALA 495 Ca 0.12 -1.87 -0.13 0.00 0.00 0.00 0.00 53.44 51.56 3e1f n ALA 495 Cb 0.05 -0.87 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 3e1f n ALA 495 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3e1f s THR 496 N -2.32 -0.01 -0.88 0.00 -1.32 -1.12 -4.08 115.64 105.91 3e1f s THR 496 Ca 0.46 0.04 0.25 0.00 -1.21 0.00 0.00 61.69 61.23 3e1f s THR 496 Cb 0.33 -0.32 0.07 0.00 -1.51 0.00 0.00 72.50 71.07 3e1f s THR 496 CO 0.16 0.02 1.49 0.47 -2.21 0.00 0.00 174.62 174.55 3e1f n ASP 497 N 3.27 0.49 -4.10 8.08 8.00 0.69 -4.84 116.55 128.14 3e1f n ASP 497 Ca -0.16 0.03 -0.23 0.00 0.71 0.00 0.00 54.79 55.14 3e1f n ASP 497 Cb 0.57 0.05 -0.15 0.00 -0.02 0.00 0.00 41.12 41.56 3e1f n ASP 497 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3e1f s ILE 498 N -3.06 1.14 -0.53 0.53 1.01 -1.26 -4.49 121.20 114.54 3e1f s ILE 498 Ca 0.10 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 59.87 3e1f s ILE 498 Cb 0.16 -0.96 0.02 0.00 0.01 0.00 0.00 42.46 41.70 3e1f s ILE 498 CO 0.67 0.33 1.25 -0.63 0.00 0.00 0.00 174.94 176.56 3e1f s ILE 499 N -0.18 4.01 -0.61 2.92 1.01 -0.21 -4.70 121.20 123.44 3e1f s ILE 499 Ca 0.02 0.95 0.06 0.00 0.00 0.00 0.00 60.65 61.68 3e1f s ILE 499 Cb -0.07 -4.57 0.28 0.00 0.01 0.00 0.00 42.46 38.11 3e1f s ILE 499 CO 0.00 -1.14 0.80 0.00 0.00 0.00 0.00 174.94 174.60 3e1f s PRO 501 N -2.73 -0.85 -0.14 0.00 0.04 -1.26 -4.05 135.00 126.01 3e1f s PRO 501 Ca 0.42 0.17 -0.02 0.00 0.04 0.00 0.00 61.00 61.61 3e1f s PRO 501 Cb 0.19 -1.62 0.04 0.00 0.04 0.00 0.00 34.50 33.16 3e1f s PRO 501 CO -0.05 -3.51 0.01 0.00 0.04 0.00 0.00 177.00 173.49 3e1f s MET 502 N -5.19 0.76 -0.38 4.56 0.23 -1.26 -0.77 119.30 117.25 3e1f s MET 502 Ca 0.69 -0.23 0.00 0.00 -1.03 0.00 0.00 55.69 55.12 3e1f s MET 502 Cb -0.14 -1.67 0.00 0.00 -1.53 0.00 0.00 34.83 31.50 3e1f s MET 502 CO 0.57 -0.48 0.00 0.66 -2.03 0.00 0.00 175.02 173.74 3e1f n TYR 503 N 5.06 0.00 -2.36 3.16 4.01 0.10 -4.96 117.16 122.18 3e1f n TYR 503 Ca -0.09 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.23 3e1f n TYR 503 Cb 0.48 -0.99 -0.03 0.00 -0.31 0.00 0.00 39.34 38.49 3e1f n TYR 503 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3e1f s ALA 504 N -2.10 3.47 0.80 -0.72 0.00 -1.26 -4.88 121.76 117.07 3e1f s ALA 504 Ca 0.00 0.86 -0.12 0.00 0.00 0.00 0.00 51.96 52.70 3e1f s ALA 504 Cb 0.00 -3.50 0.07 0.00 0.00 0.00 0.00 23.12 19.69 3e1f s ALA 504 CO 0.00 -0.60 1.10 1.03 0.00 0.00 0.00 175.76 177.29 3e1f s ARG 505 N 1.49 2.10 0.01 0.00 0.52 -1.26 -4.68 118.95 117.12 3e1f s ARG 505 Ca 0.60 0.60 -0.25 0.00 -0.52 0.00 0.00 55.73 56.16 3e1f s ARG 505 Cb -0.30 -1.92 -0.19 0.00 0.52 0.00 0.00 34.95 33.06 3e1f s ARG 505 CO 0.28 -1.60 1.39 0.28 0.02 0.00 0.00 175.30 175.66 3e1f h VAL 506 N -1.07 1.27 0.00 3.52 2.07 -1.94 -1.16 116.25 118.93 3e1f h VAL 506 Ca -0.47 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 3e1f h VAL 506 Cb 1.27 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 32.87 3e1f h VAL 506 CO 0.60 0.21 -1.09 0.47 0.02 0.00 0.00 177.57 177.78 3e1f n ASP 507 N -4.93 4.58 -4.72 0.57 8.00 -1.26 -3.66 116.55 115.13 3e1f n ASP 507 Ca -0.08 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.04 3e1f n ASP 507 Cb 0.19 0.99 -0.06 0.00 -0.02 0.00 0.00 41.12 42.23 3e1f n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3e1f s GLU 508 N -2.11 4.32 0.36 -1.24 2.12 -1.26 -4.73 118.70 116.16 3e1f s GLU 508 Ca -0.01 0.40 -0.13 0.00 0.36 0.00 0.00 54.97 55.59 3e1f s GLU 508 Cb 0.01 -3.43 -0.08 0.00 0.26 0.00 0.00 34.13 30.89 3e1f s GLU 508 CO 0.08 0.18 0.76 -0.51 -0.54 0.00 0.00 175.26 175.23 3e1f s ASP 509 N 0.57 6.67 -0.51 -1.70 1.11 -1.26 -3.88 116.67 117.67 3e1f s ASP 509 Ca 0.25 1.24 0.06 0.00 0.18 0.00 0.00 52.55 54.27 3e1f s ASP 509 Cb -0.15 -2.36 0.21 0.00 1.07 0.00 0.00 42.92 41.70 3e1f s ASP 509 CO 0.09 -0.30 0.52 0.00 1.18 0.00 0.00 175.17 176.66 3e1f n GLN 510 N -0.78 1.16 -0.01 8.23 6.02 -0.23 -4.95 117.38 126.82 3e1f n GLN 510 Ca 0.03 -3.74 0.00 0.00 -0.01 0.00 0.00 57.00 53.28 3e1f n GLN 510 Cb 0.53 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 30.04 3e1f n GLN 510 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3e1f n PRO 511 N 1.77 0.00 -1.98 -1.09 -0.04 -1.26 -1.71 135.00 130.69 3e1f n PRO 511 Ca 0.25 -0.17 -0.38 0.00 -0.04 0.00 0.00 63.50 63.16 3e1f n PRO 511 Cb 0.46 -1.64 0.02 0.00 -0.04 0.00 0.00 33.50 32.30 3e1f n PRO 511 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3e1f s PHE 512 N 3.58 2.53 0.36 0.54 0.08 -1.26 -4.89 117.98 118.91 3e1f s PHE 512 Ca 0.00 1.44 -0.27 0.00 0.12 0.00 0.00 56.93 58.22 3e1f s PHE 512 Cb 0.00 -3.63 -0.09 0.00 -0.57 0.00 0.00 43.02 38.73 3e1f s PHE 512 CO 0.00 -2.33 1.22 -1.25 -0.10 0.00 0.00 175.22 172.76 3e1f s PRO 513 N -2.81 4.25 0.00 0.24 0.04 -1.26 -2.40 135.00 133.06 3e1f s PRO 513 Ca 0.68 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.73 3e1f s PRO 513 Cb -0.36 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.27 3e1f s PRO 513 CO 0.43 -0.20 0.00 0.00 0.04 0.00 0.00 177.00 177.26 3e1f n ALA 514 N 0.53 0.00 -3.26 8.56 0.00 -1.26 -4.54 120.51 120.54 3e1f n ALA 514 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.20 3e1f n ALA 514 Cb 0.44 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.82 3e1f n ALA 514 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3e1f n VAL 515 N 0.00 1.43 -1.34 0.00 0.24 -1.25 -4.84 118.33 112.57 3e1f n VAL 515 Ca 0.00 -4.90 -0.31 0.00 -2.04 0.00 0.00 64.34 57.10 3e1f n VAL 515 Cb 0.00 -1.80 0.09 0.00 -1.47 0.00 0.00 33.84 30.66 3e1f n VAL 515 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3e1f s PRO 516 N -2.28 2.17 -0.44 7.34 0.04 -1.01 -4.63 135.00 136.20 3e1f s PRO 516 Ca 0.40 1.00 0.03 0.00 0.04 0.00 0.00 61.00 62.47 3e1f s PRO 516 Cb 0.19 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.95 3e1f s PRO 516 CO -0.06 -1.65 0.18 0.15 0.04 0.00 0.00 177.00 175.65 3e1f s LYS 517 N -4.97 1.81 0.68 4.56 1.02 -0.70 -4.89 119.74 117.25 3e1f s LYS 517 Ca 0.61 -2.21 -0.12 0.00 0.02 0.00 0.00 55.97 54.27 3e1f s LYS 517 Cb -0.16 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.82 3e1f s LYS 517 CO 0.56 -1.04 1.06 -1.58 -0.92 0.00 0.00 175.35 173.44 3e1f s TRP 518 N 0.39 3.02 0.21 3.18 0.52 -1.26 -1.07 118.94 123.93 3e1f s TRP 518 Ca 0.13 1.46 -0.32 0.00 0.02 0.00 0.00 56.10 57.39 3e1f s TRP 518 Cb -0.22 -2.93 -0.13 0.00 -1.15 0.00 0.00 33.47 29.04 3e1f s TRP 518 CO -0.04 -1.27 1.64 0.45 0.02 0.00 0.00 176.95 177.76 3e1f n SER 519 N -2.87 3.66 -0.14 2.95 2.88 -1.25 -4.43 113.62 114.41 3e1f n SER 519 Ca 0.08 1.09 0.22 0.00 -1.33 0.00 0.00 58.87 58.93 3e1f n SER 519 Cb 0.53 -1.53 0.63 0.00 -0.75 0.00 0.00 64.21 63.09 3e1f n SER 519 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3e1f h ILE 520 N 3.63 0.67 -0.24 2.46 3.07 -1.27 0.10 117.51 125.92 3e1f h ILE 520 Ca -0.44 -0.05 -0.17 0.00 1.55 0.00 0.00 64.86 65.74 3e1f h ILE 520 Cb 1.22 0.50 -0.00 0.00 -0.27 0.00 0.00 36.82 38.27 3e1f h ILE 520 CO 0.90 0.03 -0.54 0.11 -1.05 0.00 0.00 178.15 177.59 3e1f h LYS 521 N 0.16 0.73 -0.07 0.16 1.57 -1.84 -3.12 116.57 114.16 3e1f h LYS 521 Ca 0.38 -0.46 -0.17 0.00 -1.87 0.00 0.00 60.65 58.53 3e1f h LYS 521 Cb 1.26 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.62 3e1f h LYS 521 CO -0.06 1.08 -0.68 -0.22 -0.57 0.00 0.00 179.45 179.00 3e1f h LYS 522 N 0.56 0.32 -0.49 3.15 3.64 -1.22 -3.30 116.57 119.24 3e1f h LYS 522 Ca 0.01 -0.25 0.04 0.00 -1.27 0.00 0.00 60.65 59.18 3e1f h LYS 522 Cb 1.12 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 3e1f h LYS 522 CO 0.11 0.88 0.26 2.35 -2.27 0.00 0.00 179.45 180.79 3e1f h TRP 523 N 0.22 0.49 -0.73 1.91 2.91 -0.85 -2.84 115.95 117.07 3e1f h TRP 523 Ca -0.02 0.02 0.09 0.00 1.13 0.00 0.00 58.89 60.11 3e1f h TRP 523 Cb 1.23 -0.15 -0.05 0.00 -0.51 0.00 0.00 29.16 29.69 3e1f h TRP 523 CO 0.03 0.25 0.48 -0.07 -1.03 0.00 0.00 178.44 178.11 3e1f h LEU 524 N 0.52 0.59 -2.22 0.65 3.38 -1.62 -2.67 115.31 113.94 3e1f h LEU 524 Ca 0.21 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3e1f h LEU 524 Cb 0.09 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3e1f h LEU 524 CO -0.13 0.36 0.00 -1.54 0.09 0.00 0.00 178.44 177.22 3e1f n SER 525 N -4.49 3.25 -4.71 -0.43 3.41 -1.08 -4.53 113.62 105.03 3e1f n SER 525 Ca 0.12 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.32 3e1f n SER 525 Cb 0.31 -0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 63.89 3e1f n SER 525 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3e1f n LEU 526 N 1.29 3.79 -4.62 1.04 4.77 -1.01 -4.78 117.00 117.48 3e1f n LEU 526 Ca 0.20 1.20 -0.62 0.00 -0.03 0.00 0.00 56.01 56.77 3e1f n LEU 526 Cb 0.53 -1.51 -0.08 0.00 -2.33 0.00 0.00 43.42 40.02 3e1f n LEU 526 CO 0.14 -0.32 0.89 -2.65 -1.33 0.00 0.00 177.39 174.12 3e1f n PRO 527 N 0.80 0.22 0.00 3.23 -0.02 -1.26 -1.02 135.00 136.95 3e1f n PRO 527 Ca 0.05 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3e1f n PRO 527 Cb 0.36 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 3e1f n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3e1f n GLY 528 N 2.79 2.45 3.77 -1.23 0.00 -1.26 -5.01 105.19 106.70 3e1f n GLY 528 Ca 0.25 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3e1f n GLY 528 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3e1f s GLU 529 N 0.00 3.86 0.00 1.61 2.56 -0.19 -4.91 118.70 121.63 3e1f s GLU 529 Ca 0.00 2.44 0.00 0.00 0.00 0.00 0.00 54.97 57.41 3e1f s GLU 529 Cb 0.00 -2.77 0.00 0.00 2.00 0.00 0.00 34.13 33.36 3e1f s GLU 529 CO 0.00 -0.69 0.00 0.25 -0.56 0.00 0.00 175.26 174.26 3e1f n THR 530 N 0.06 0.00 -1.08 -1.70 -2.24 -1.26 -4.78 114.28 103.28 3e1f n THR 530 Ca 0.04 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.52 3e1f n THR 530 Cb 0.41 0.74 0.17 0.00 -2.10 0.00 0.00 70.33 69.55 3e1f n THR 530 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3e1f s ARG 531 N 0.00 0.60 0.31 -0.78 0.52 -1.26 -4.01 118.95 114.34 3e1f s ARG 531 Ca 0.00 0.73 -0.15 0.00 -0.52 0.00 0.00 55.73 55.79 3e1f s ARG 531 Cb 0.00 -1.74 -0.09 0.00 0.52 0.00 0.00 34.95 33.64 3e1f s ARG 531 CO 0.00 -2.67 0.72 -1.25 0.02 0.00 0.00 175.30 172.13 3e1f s PRO 532 N -4.87 4.01 -0.22 3.54 0.04 -1.13 -4.84 135.00 131.53 3e1f s PRO 532 Ca 0.65 0.66 -0.02 0.00 0.04 0.00 0.00 61.00 62.33 3e1f s PRO 532 Cb -0.19 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.88 3e1f s PRO 532 CO 0.58 0.19 -0.09 -1.17 0.04 0.00 0.00 177.00 176.54 3e1f s LEU 533 N -2.89 2.76 -0.16 -3.56 0.20 -0.40 -1.04 118.68 113.59 3e1f s LEU 533 Ca 0.53 -0.61 -0.02 0.00 0.69 0.00 0.00 54.13 54.72 3e1f s LEU 533 Cb -0.11 -1.64 0.05 0.00 -0.43 0.00 0.00 46.19 44.06 3e1f s LEU 533 CO 0.18 -0.05 0.00 -0.63 -0.29 0.00 0.00 176.35 175.57 3e1f s ILE 534 N 1.38 0.67 0.18 6.68 1.01 -0.29 -2.05 121.20 128.77 3e1f s ILE 534 Ca 0.04 -0.44 -0.32 0.00 0.00 0.00 0.00 60.65 59.93 3e1f s ILE 534 Cb -0.15 -1.01 -0.11 0.00 0.01 0.00 0.00 42.46 41.21 3e1f s ILE 534 CO -0.06 -0.02 1.63 -0.76 0.00 0.00 0.00 174.94 175.73 3e1f s LEU 535 N 1.81 4.37 0.21 2.97 1.02 -0.83 -4.07 118.68 124.16 3e1f s LEU 535 Ca 0.01 2.71 0.26 0.00 0.02 0.00 0.00 54.13 57.12 3e1f s LEU 535 Cb -0.16 -3.59 0.83 0.00 0.02 0.00 0.00 46.19 43.29 3e1f s LEU 535 CO -0.07 -0.89 1.78 0.00 0.02 0.00 0.00 176.35 177.19 3e1f s GLU 537 N -3.10 0.67 0.04 0.00 2.02 -1.22 -4.41 118.70 112.69 3e1f s GLU 537 Ca 0.11 1.13 -0.27 0.00 0.02 0.00 0.00 54.97 55.96 3e1f s GLU 537 Cb 0.12 0.15 0.09 0.00 0.10 0.00 0.00 34.13 34.60 3e1f s GLU 537 CO 0.59 -0.14 0.79 1.52 0.02 0.00 0.00 175.26 178.04 3e1f s TYR 538 N 1.49 -0.42 -0.80 1.61 1.13 -0.96 0.02 117.35 119.42 3e1f s TYR 538 Ca -0.09 0.31 -0.04 0.00 -1.41 0.00 0.00 57.07 55.85 3e1f s TYR 538 Cb -0.05 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.30 3e1f s TYR 538 CO -0.18 -0.63 0.71 0.00 -2.51 0.00 0.00 175.55 172.94 3e1f n ALA 539 N -0.18 -2.20 -1.54 9.51 0.00 -1.26 -2.10 120.51 122.74 3e1f n ALA 539 Ca -0.12 0.08 -0.44 0.00 0.00 0.00 0.00 53.44 52.96 3e1f n ALA 539 Cb 0.62 -3.88 -0.05 0.00 0.00 0.00 0.00 19.45 16.15 3e1f n ALA 539 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3e1f n HIS 540 N -2.57 1.71 -0.99 0.00 -0.00 -0.72 -3.81 115.22 108.84 3e1f n HIS 540 Ca -0.04 0.05 -0.15 0.00 0.46 0.00 0.00 57.72 58.05 3e1f n HIS 540 Cb 0.57 -2.64 -0.05 0.00 -0.12 0.00 0.00 29.99 27.75 3e1f n HIS 540 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3e1f n ALA 541 N 11.83 5.56 -2.59 1.57 0.00 0.13 -4.22 120.51 132.79 3e1f n ALA 541 Ca 0.36 -1.72 -0.43 0.00 0.00 0.00 0.00 53.44 51.65 3e1f n ALA 541 Cb 0.38 -1.74 -0.04 0.00 0.00 0.00 0.00 19.45 18.05 3e1f n ALA 541 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3e1f s MET 542 N -0.67 3.52 6.45 0.00 0.00 -1.26 -3.71 119.30 123.63 3e1f s MET 542 Ca 0.41 0.15 0.00 0.00 0.00 0.00 0.00 55.69 56.25 3e1f s MET 542 Cb 0.25 -3.96 0.00 0.00 0.00 0.00 0.00 34.83 31.12 3e1f s MET 542 CO -0.06 -1.37 0.00 0.41 0.00 0.00 0.00 175.02 174.00 3e1f n GLY 543 N 4.98 1.69 3.52 2.11 0.00 -1.26 -4.02 105.19 112.21 3e1f n GLY 543 Ca 0.06 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 3e1f n GLY 543 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3e1f s ASN 544 N -4.00 6.80 0.00 1.61 2.47 -1.26 -4.88 114.94 115.68 3e1f s ASN 544 Ca 0.00 -2.35 0.00 0.00 0.42 0.00 0.00 52.86 50.93 3e1f s ASN 544 Cb 0.00 -2.49 0.00 0.00 -1.45 0.00 0.00 41.25 37.31 3e1f s ASN 544 CO 0.00 -1.08 0.00 -0.24 -3.72 0.00 0.00 177.10 172.06 3e1f n SER 545 N 7.29 0.29 -0.85 -4.21 2.88 -1.26 -4.78 113.62 112.98 3e1f n SER 545 Ca 0.37 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.82 3e1f n SER 545 Cb 0.47 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.90 3e1f n SER 545 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3e1f n LEU 546 N 0.00 -0.93 -4.73 2.46 7.94 -1.23 -4.83 117.00 115.68 3e1f n LEU 546 Ca 0.00 0.16 -0.41 0.00 -1.11 0.00 0.00 56.01 54.66 3e1f n LEU 546 Cb 0.00 -1.61 -0.05 0.00 0.53 0.00 0.00 43.42 42.30 3e1f n LEU 546 CO 0.00 -0.38 0.66 -0.83 -1.11 0.00 0.00 177.39 175.73 3e1f s GLY 547 N -2.80 3.03 0.00 -3.96 0.00 -0.85 -2.96 107.32 99.79 3e1f s GLY 547 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.31 3e1f s GLY 547 CO 0.00 1.40 0.00 0.61 0.00 0.00 0.00 173.10 175.11 3e1f n GLY 548 N 2.08 0.73 0.33 0.20 0.00 0.15 -3.95 105.19 104.73 3e1f n GLY 548 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 3e1f n GLY 548 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3e1f h PHE 549 N 0.00 1.16 0.00 1.61 3.57 -1.73 -2.40 116.94 119.15 3e1f h PHE 549 Ca 0.00 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 3e1f h PHE 549 Cb 0.00 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.39 3e1f h PHE 549 CO 0.00 0.87 -0.01 0.00 -2.23 0.00 0.00 178.31 176.94 3e1f h ALA 550 N 1.16 1.98 -0.49 2.41 0.00 -1.87 -2.01 119.26 120.45 3e1f h ALA 550 Ca 0.26 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 3e1f h ALA 550 Cb 0.19 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3e1f h ALA 550 CO -0.02 0.01 0.06 -0.22 0.00 0.00 0.00 179.25 179.08 3e1f h LYS 551 N 0.00 0.78 -0.23 0.00 3.64 -1.83 -1.29 116.57 117.64 3e1f h LYS 551 Ca -0.00 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 3e1f h LYS 551 Cb 0.02 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3e1f h LYS 551 CO 0.00 0.74 0.08 1.88 -2.27 0.00 0.00 179.45 179.89 3e1f h TYR 552 N 0.74 0.37 -0.29 1.91 0.05 -1.41 -2.52 116.97 115.82 3e1f h TYR 552 Ca 0.16 -0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.80 3e1f h TYR 552 Cb 0.36 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 3e1f h TYR 552 CO 0.02 0.41 -0.26 -1.49 -1.05 0.00 0.00 178.16 175.80 3e1f h TRP 553 N 0.22 0.65 -0.45 4.88 4.06 -1.44 0.51 115.95 124.38 3e1f h TRP 553 Ca 0.08 -0.15 0.07 0.00 2.06 0.00 0.00 58.89 60.95 3e1f h TRP 553 Cb 0.21 -0.16 -0.06 0.00 -1.00 0.00 0.00 29.16 28.16 3e1f h TRP 553 CO -0.00 0.78 0.12 0.37 -3.56 0.00 0.00 178.44 176.15 3e1f h GLN 554 N 0.51 0.26 -0.46 0.49 -0.00 -1.11 -1.04 115.11 113.75 3e1f h GLN 554 Ca 0.07 -0.02 -0.13 0.00 -0.00 0.00 0.00 58.65 58.57 3e1f h GLN 554 Cb 0.71 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.12 3e1f h GLN 554 CO 0.05 0.17 -0.22 0.00 0.00 0.00 0.00 178.83 178.83 3e1f h ALA 555 N 1.33 0.65 -0.76 3.38 0.00 -1.02 -2.60 119.26 120.24 3e1f h ALA 555 Ca 0.22 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.76 3e1f h ALA 555 Cb 0.25 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 3e1f h ALA 555 CO -0.26 0.64 0.48 0.74 0.00 0.00 0.00 179.25 180.86 3e1f h PHE 556 N 0.82 0.91 -0.05 0.00 0.04 -0.17 -1.47 116.94 117.01 3e1f h PHE 556 Ca 0.10 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.75 3e1f h PHE 556 Cb 0.80 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 3e1f h PHE 556 CO 0.05 0.52 -0.62 0.00 -0.60 0.00 0.00 178.31 177.67 3e1f h ARG 557 N 0.94 0.19 0.12 1.51 3.08 -1.17 -3.29 114.38 115.76 3e1f h ARG 557 Ca 0.30 -0.13 -0.27 0.00 0.07 0.00 0.00 59.98 59.95 3e1f h ARG 557 Cb 0.01 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3e1f h ARG 557 CO -0.11 0.75 -1.23 0.37 -1.07 0.00 0.00 179.97 178.68 3e1f h GLN 558 N 0.14 0.27 -4.61 0.04 4.15 -1.13 -3.44 115.11 110.52 3e1f h GLN 558 Ca -0.01 -0.45 -0.70 0.00 0.77 0.00 0.00 58.65 58.26 3e1f h GLN 558 Cb 1.12 0.17 -0.20 0.00 0.21 0.00 0.00 27.48 28.78 3e1f h GLN 558 CO 0.09 1.21 -0.41 0.71 -1.93 0.00 0.00 178.83 178.51 3e1f s TYR 559 N -2.68 3.23 0.25 3.99 1.51 -0.58 -4.98 117.35 118.09 3e1f s TYR 559 Ca -0.04 -0.45 -0.06 0.00 -1.01 0.00 0.00 57.07 55.51 3e1f s TYR 559 Cb 0.07 -2.61 0.48 0.00 -0.11 0.00 0.00 41.96 39.79 3e1f s TYR 559 CO 0.88 -0.54 1.63 -1.35 -1.11 0.00 0.00 175.55 175.06 3e1f h PRO 560 N 8.60 0.10 -0.00 -1.71 0.11 -1.85 0.46 132.00 137.70 3e1f h PRO 560 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3e1f h PRO 560 Cb 1.13 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3e1f h PRO 560 CO 0.71 0.06 -0.00 0.54 -0.21 0.00 0.00 178.00 179.11 3e1f n ARG 561 N -5.36 1.18 -3.13 1.05 1.74 -1.26 -4.37 116.66 106.51 3e1f n ARG 561 Ca 0.15 -0.28 -0.45 0.00 -0.77 0.00 0.00 57.85 56.50 3e1f n ARG 561 Cb 0.51 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 3e1f n ARG 561 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3e1f s LEU 562 N -2.01 5.86 -0.24 0.55 1.43 0.15 -1.27 118.68 123.15 3e1f s LEU 562 Ca 0.45 -2.24 0.07 0.00 -1.03 0.00 0.00 54.13 51.38 3e1f s LEU 562 Cb 0.22 -2.30 0.54 0.00 0.03 0.00 0.00 46.19 44.68 3e1f s LEU 562 CO 0.36 -0.86 1.51 0.00 0.23 0.00 0.00 176.35 177.60 3e1f n GLN 563 N 5.38 2.97 0.00 1.70 6.02 -0.87 -4.59 117.38 127.99 3e1f n GLN 563 Ca 0.14 -2.22 0.00 0.00 -0.01 0.00 0.00 57.00 54.92 3e1f n GLN 563 Cb 0.47 -1.96 0.00 0.00 1.02 0.00 0.00 30.24 29.77 3e1f n GLN 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3e1f n GLY 564 N -0.05 -0.65 0.92 1.08 0.00 -1.26 -0.06 105.19 105.17 3e1f n GLY 564 Ca 0.30 -2.05 0.01 0.00 0.00 0.00 0.00 46.02 44.28 3e1f n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 565 N 0.00 0.39 2.94 -0.02 0.00 -0.77 -1.97 105.19 105.75 3e1f n GLY 565 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 3e1f n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3e1f s PHE 566 N -2.26 2.18 0.60 1.61 0.40 -0.02 -1.69 117.98 118.80 3e1f s PHE 566 Ca 0.07 -1.51 -0.20 0.00 -0.60 0.00 0.00 56.93 54.69 3e1f s PHE 566 Cb -0.00 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.99 3e1f s PHE 566 CO -0.01 -0.72 1.30 0.28 0.70 0.00 0.00 175.22 176.77 3e1f n VAL 567 N 4.74 4.41 -4.04 -0.44 0.31 -0.04 -2.27 118.33 121.00 3e1f n VAL 567 Ca -0.13 -0.50 -0.32 0.00 -0.01 0.00 0.00 64.34 63.39 3e1f n VAL 567 Cb 0.46 -1.54 -0.15 0.00 -0.91 0.00 0.00 33.84 31.69 3e1f n VAL 567 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 3e1f s TRP 568 N -1.35 3.18 0.00 3.52 -0.11 -0.89 -0.31 118.94 122.98 3e1f s TRP 568 Ca 0.78 -2.32 0.00 0.00 1.22 0.00 0.00 56.10 55.78 3e1f s TRP 568 Cb -0.40 -2.00 0.00 0.00 -1.50 0.00 0.00 33.47 29.57 3e1f s TRP 568 CO 0.44 -0.87 0.00 -0.40 -4.62 0.00 0.00 176.95 171.50 3e1f n ASP 569 N 4.45 0.00 0.03 5.86 5.75 0.23 0.21 116.55 133.08 3e1f n ASP 569 Ca -0.11 -0.55 -0.01 0.00 -0.01 0.00 0.00 54.79 54.10 3e1f n ASP 569 Cb 0.42 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.51 3e1f n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3e1f h TRP 570 N 0.55 -0.09 -4.17 2.11 -0.00 -0.94 -2.14 115.95 111.27 3e1f h TRP 570 Ca 0.00 -0.00 -0.66 0.00 -0.00 0.00 0.00 58.89 58.23 3e1f h TRP 570 Cb 0.00 0.03 -0.25 0.00 -0.00 0.00 0.00 29.16 28.94 3e1f h TRP 570 CO 0.00 -0.05 -0.87 0.54 -0.00 0.00 0.00 178.44 178.06 3e1f s VAL 571 N -2.48 2.04 0.26 2.65 0.11 -1.26 -0.24 120.40 121.47 3e1f s VAL 571 Ca -0.01 -1.43 -0.30 0.00 -2.93 0.00 0.00 61.98 57.30 3e1f s VAL 571 Cb 0.00 -1.77 -0.11 0.00 -1.53 0.00 0.00 36.38 32.98 3e1f s VAL 571 CO 0.04 0.25 1.56 -1.81 -3.33 0.00 0.00 175.10 171.81 3e1f s ASP 572 N -1.43 6.48 -1.26 3.54 1.01 -0.60 -4.28 116.67 120.13 3e1f s ASP 572 Ca 0.11 2.82 -0.06 0.00 0.71 0.00 0.00 52.55 56.13 3e1f s ASP 572 Cb -0.10 -2.62 0.18 0.00 1.01 0.00 0.00 42.92 41.39 3e1f s ASP 572 CO 0.03 -0.85 2.03 0.00 0.21 0.00 0.00 175.17 176.59 3e1f n GLN 573 N 2.65 4.26 -4.11 8.23 6.02 0.34 -3.87 117.38 130.89 3e1f n GLN 573 Ca 0.09 -3.71 -0.32 0.00 -0.01 0.00 0.00 57.00 53.06 3e1f n GLN 573 Cb 0.38 -2.72 -0.07 0.00 1.02 0.00 0.00 30.24 28.85 3e1f n GLN 573 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3e1f s SER 574 N 0.18 5.54 0.13 1.08 1.04 -1.26 -4.66 113.70 115.75 3e1f s SER 574 Ca 0.44 0.07 0.07 0.00 0.48 0.00 0.00 55.95 57.02 3e1f s SER 574 Cb 0.13 -1.54 -0.04 0.00 0.10 0.00 0.00 66.02 64.68 3e1f s SER 574 CO -0.03 0.24 -0.07 -0.76 0.98 0.00 0.00 173.24 173.60 3e1f s LEU 575 N -1.92 3.12 -0.15 2.42 1.43 -0.42 -4.36 118.68 118.80 3e1f s LEU 575 Ca 0.24 -0.40 -0.20 0.00 -1.03 0.00 0.00 54.13 52.74 3e1f s LEU 575 Cb -0.12 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 3e1f s LEU 575 CO 0.16 0.15 0.60 -0.63 0.23 0.00 0.00 176.35 176.86 3e1f s ILE 576 N -1.39 5.07 0.46 -0.59 -1.09 -0.66 0.25 121.20 123.25 3e1f s ILE 576 Ca 0.23 1.16 0.04 0.00 -2.23 0.00 0.00 60.65 59.86 3e1f s ILE 576 Cb -0.10 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.81 3e1f s ILE 576 CO 0.15 0.20 0.01 -0.54 -1.23 0.00 0.00 174.94 173.52 3e1f s LYS 577 N 1.35 2.08 -0.02 2.79 1.02 -0.68 -4.93 119.74 121.36 3e1f s LYS 577 Ca 0.29 -2.26 0.02 0.00 0.02 0.00 0.00 55.97 54.04 3e1f s LYS 577 Cb -0.16 -1.58 0.00 0.00 -0.52 0.00 0.00 37.83 35.57 3e1f s LYS 577 CO 0.12 -0.21 -0.06 0.71 -0.92 0.00 0.00 175.35 174.99 3e1f s TYR 578 N -2.80 0.62 0.94 3.18 1.51 -1.26 -1.76 117.35 117.78 3e1f s TYR 578 Ca 0.20 -0.13 -0.13 0.00 -1.01 0.00 0.00 57.07 55.99 3e1f s TYR 578 Cb 0.06 -0.45 0.21 0.00 -0.11 0.00 0.00 41.96 41.66 3e1f s TYR 578 CO 0.10 -0.06 1.28 0.16 -1.11 0.00 0.00 175.55 175.92 3e1f s ASP 579 N 0.18 3.13 0.31 2.29 -4.77 -0.86 -4.85 116.67 112.10 3e1f s ASP 579 Ca -0.02 0.02 0.07 0.00 -3.30 0.00 0.00 52.55 49.33 3e1f s ASP 579 Cb -0.06 -0.04 0.81 0.00 -1.09 0.00 0.00 42.92 42.53 3e1f s ASP 579 CO -0.00 -2.70 1.75 1.05 0.70 0.00 0.00 175.17 175.96 3e1f h GLU 580 N -1.51 0.63 0.00 2.11 9.09 -2.02 0.21 114.58 123.10 3e1f h GLU 580 Ca -0.42 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 58.95 3e1f h GLU 580 Cb 1.22 -0.14 0.00 0.00 -1.65 0.00 0.00 28.75 28.18 3e1f h GLU 580 CO 0.33 0.42 0.00 0.09 0.05 0.00 0.00 179.01 179.90 3e1f n ASN 581 N -4.84 0.19 0.00 3.06 3.02 -1.26 -4.88 115.26 110.55 3e1f n ASN 581 Ca 0.25 0.54 0.00 0.00 -0.03 0.00 0.00 54.58 55.34 3e1f n ASN 581 Cb 0.66 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 3e1f n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3e1f n GLY 582 N 0.46 0.89 3.88 7.41 0.00 0.75 -5.07 105.19 113.51 3e1f n GLY 582 Ca 0.04 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 3e1f n GLY 582 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3e1f s ASN 583 N -2.64 6.39 0.32 1.61 -0.87 -1.26 -4.85 114.94 113.64 3e1f s ASN 583 Ca 0.00 0.45 -0.23 0.00 -1.57 0.00 0.00 52.86 51.52 3e1f s ASN 583 Cb 0.00 -2.06 -0.10 0.00 -0.02 0.00 0.00 41.25 39.07 3e1f s ASN 583 CO 0.00 0.39 0.88 -2.16 -2.57 0.00 0.00 177.10 173.64 3e1f s PRO 584 N -1.14 4.40 -0.05 -0.60 0.04 -1.26 -2.02 135.00 134.37 3e1f s PRO 584 Ca 0.17 1.14 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 3e1f s PRO 584 Cb -0.12 -2.66 0.04 0.00 0.04 0.00 0.00 34.50 31.79 3e1f s PRO 584 CO 0.06 0.23 0.41 1.67 0.04 0.00 0.00 177.00 179.41 3e1f s TRP 585 N -1.74 -0.34 -0.11 0.56 1.48 -0.72 -4.97 118.94 113.09 3e1f s TRP 585 Ca 0.51 0.63 -0.30 0.00 -1.06 0.00 0.00 56.10 55.89 3e1f s TRP 585 Cb -0.16 0.18 -0.02 0.00 -1.16 0.00 0.00 33.47 32.31 3e1f s TRP 585 CO 0.20 -0.41 1.22 -1.12 -4.06 0.00 0.00 176.95 172.79 3e1f s SER 586 N -0.99 7.01 0.21 -2.66 0.01 -1.26 -1.68 113.70 114.34 3e1f s SER 586 Ca -0.10 1.74 0.10 0.00 1.31 0.00 0.00 55.95 58.99 3e1f s SER 586 Cb -0.04 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 3e1f s SER 586 CO 0.05 -0.67 -0.11 0.00 0.41 0.00 0.00 173.24 172.93 3e1f s ALA 587 N 2.83 2.92 0.00 1.44 0.00 0.14 -4.93 121.76 124.16 3e1f s ALA 587 Ca 0.55 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.92 3e1f s ALA 587 Cb -0.23 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.26 3e1f s ALA 587 CO 0.18 0.39 0.00 2.48 0.00 0.00 0.00 175.76 178.81 3e1f n TYR 588 N -0.23 0.00 -1.54 0.00 0.18 -1.26 -1.30 117.16 113.00 3e1f n TYR 588 Ca -0.09 0.00 -0.57 0.00 1.88 0.00 0.00 57.90 59.12 3e1f n TYR 588 Cb 0.57 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.46 3e1f n TYR 588 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3e1f n GLY 589 N 0.31 0.02 3.18 -7.48 0.00 -0.26 -1.30 105.19 99.66 3e1f n GLY 589 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.77 3e1f n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 590 N 1.97 2.61 0.00 -0.02 0.00 -1.26 -4.59 105.19 103.91 3e1f n GLY 590 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3e1f n GLY 590 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3e1f n ASP 591 N 0.78 0.00 -0.17 1.61 8.00 -0.42 -0.61 116.55 125.74 3e1f n ASP 591 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 3e1f n ASP 591 Cb 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.19 3e1f n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3e1f n PHE 592 N -0.86 0.00 -0.76 1.24 3.01 -1.26 -4.93 117.46 113.90 3e1f n PHE 592 Ca 0.00 -0.66 0.00 0.00 1.01 0.00 0.00 57.45 57.80 3e1f n PHE 592 Cb 0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.36 3e1f n PHE 592 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3e1f n GLY 593 N -0.94 1.47 3.73 1.37 0.00 0.22 -4.78 105.19 106.27 3e1f n GLY 593 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3e1f n GLY 593 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3e1f s ASP 594 N -3.23 6.62 -0.28 1.61 -4.77 -1.24 -4.99 116.67 110.38 3e1f s ASP 594 Ca 0.00 2.63 -0.23 0.00 -3.30 0.00 0.00 52.55 51.65 3e1f s ASP 594 Cb 0.00 -2.61 0.12 0.00 -1.09 0.00 0.00 42.92 39.34 3e1f s ASP 594 CO 0.00 -0.77 0.98 0.28 0.70 0.00 0.00 175.17 176.37 3e1f s THR 595 N 0.60 0.00 0.59 2.11 -1.32 -1.26 -3.99 115.64 112.38 3e1f s THR 595 Ca 0.65 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.94 3e1f s THR 595 Cb -0.43 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.53 3e1f s THR 595 CO 0.37 0.00 1.21 -2.84 -2.21 0.00 0.00 174.62 171.14 3e1f s PRO 596 N 0.45 3.00 0.18 7.08 0.02 -1.26 -5.13 135.00 139.34 3e1f s PRO 596 Ca 0.01 1.82 0.03 0.00 0.02 0.00 0.00 61.00 62.88 3e1f s PRO 596 Cb -0.05 -1.94 -0.05 0.00 0.02 0.00 0.00 34.50 32.49 3e1f s PRO 596 CO -0.07 -1.19 -0.03 0.54 -0.33 0.00 0.00 177.00 175.92 3e1f s ASN 597 N -1.59 1.53 -0.73 2.53 2.20 -1.26 -4.64 114.94 112.97 3e1f s ASN 597 Ca 0.77 -1.14 0.02 0.00 -0.94 0.00 0.00 52.86 51.58 3e1f s ASN 597 Cb -0.30 0.05 0.35 0.00 -2.00 0.00 0.00 41.25 39.35 3e1f s ASN 597 CO 0.33 -0.49 1.36 0.47 -2.94 0.00 0.00 177.10 175.84 3e1f n ASP 598 N -0.27 5.76 0.00 3.54 8.00 -0.74 -4.95 116.55 127.89 3e1f n ASP 598 Ca -0.07 -3.71 0.00 0.00 0.71 0.00 0.00 54.79 51.72 3e1f n ASP 598 Cb 0.63 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 3e1f n ASP 598 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3e1f n ARG 599 N -0.25 0.00 -0.89 -1.24 5.12 -1.26 -1.78 116.66 116.35 3e1f n ARG 599 Ca 0.40 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 56.39 3e1f n ARG 599 Cb 0.37 0.00 0.40 0.00 -1.16 0.00 0.00 32.46 32.07 3e1f n ARG 599 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3e1f n GLN 600 N 14.00 4.87 0.00 5.56 0.00 -1.26 -1.11 117.38 139.44 3e1f n GLN 600 Ca 0.00 -3.17 0.06 0.00 0.00 0.00 0.00 57.00 53.89 3e1f n GLN 600 Cb 0.00 -2.26 0.33 0.00 0.00 0.00 0.00 30.24 28.31 3e1f n GLN 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3e1f n PHE 601 N 0.58 0.00 1.12 2.61 3.01 -0.74 -2.07 117.46 121.98 3e1f n PHE 601 Ca 0.28 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.86 3e1f n PHE 601 Cb 1.20 0.00 0.30 0.00 -0.01 0.00 0.00 39.48 40.97 3e1f n PHE 601 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3e1f s MET 603 N -1.90 2.21 -0.07 0.00 -1.94 -0.88 -0.51 119.30 116.21 3e1f s MET 603 Ca 0.34 -2.41 0.11 0.00 -1.71 0.00 0.00 55.69 52.02 3e1f s MET 603 Cb 0.20 -3.54 0.17 0.00 2.01 0.00 0.00 34.83 33.67 3e1f s MET 603 CO 0.31 -1.12 1.09 0.09 -0.01 0.00 0.00 175.02 175.38 3e1f n ASN 604 N 3.58 1.35 -4.91 3.03 5.03 -1.26 -4.24 115.26 117.84 3e1f n ASN 604 Ca 0.05 -2.62 -0.28 0.00 0.87 0.00 0.00 54.58 52.60 3e1f n ASN 604 Cb 0.37 -0.33 0.06 0.00 -1.02 0.00 0.00 39.78 38.85 3e1f n ASN 604 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3e1f s GLY 605 N -2.08 1.63 0.00 7.41 0.00 -1.24 -0.60 107.32 112.44 3e1f s GLY 605 Ca 0.18 -0.67 0.25 0.00 0.00 0.00 0.00 44.72 44.49 3e1f s GLY 605 CO 0.02 -0.29 1.44 1.04 0.00 0.00 0.00 173.10 175.30 3e1f n LEU 606 N -2.91 0.54 -4.00 0.66 4.77 0.67 -4.72 117.00 112.01 3e1f n LEU 606 Ca 0.07 -0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 55.94 3e1f n LEU 606 Cb 0.59 -0.24 -0.10 0.00 -2.33 0.00 0.00 43.42 41.33 3e1f n LEU 606 CO 0.54 0.13 -0.33 0.68 -1.33 0.00 0.00 177.39 177.08 3e1f s VAL 607 N -2.95 0.14 0.75 4.08 -7.23 -0.89 -0.35 120.40 113.96 3e1f s VAL 607 Ca 0.12 -1.20 -0.11 0.00 -1.81 0.00 0.00 61.98 58.99 3e1f s VAL 607 Cb 0.18 -0.73 0.04 0.00 0.56 0.00 0.00 36.38 36.43 3e1f s VAL 607 CO 0.68 -0.66 1.08 -0.36 -0.31 0.00 0.00 175.10 175.53 3e1f s PHE 608 N -2.35 2.93 0.49 2.82 0.08 0.00 -1.56 117.98 120.40 3e1f s PHE 608 Ca -0.08 1.29 0.33 0.00 0.12 0.00 0.00 56.93 58.60 3e1f s PHE 608 Cb -0.03 -3.01 1.45 0.00 -0.57 0.00 0.00 43.02 40.86 3e1f s PHE 608 CO -0.04 -1.55 1.71 0.00 -0.10 0.00 0.00 175.22 175.24 3e1f h ALA 609 N -0.94 2.96 -0.35 5.36 0.00 -1.90 0.58 119.26 124.97 3e1f h ALA 609 Ca -0.45 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 3e1f h ALA 609 Cb 1.24 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 3e1f h ALA 609 CO 0.58 -1.42 0.11 -0.40 0.00 0.00 0.00 179.25 178.11 3e1f n ASP 610 N -4.37 3.34 -1.69 0.00 5.75 -1.26 -4.42 116.55 113.90 3e1f n ASP 610 Ca 0.32 -2.57 -0.20 0.00 -0.01 0.00 0.00 54.79 52.34 3e1f n ASP 610 Cb 1.35 -0.62 -0.07 0.00 -1.03 0.00 0.00 41.12 40.75 3e1f n ASP 610 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3e1f n ARG 611 N 0.10 -1.42 -3.00 0.11 3.00 0.20 -4.98 116.66 110.67 3e1f n ARG 611 Ca 0.19 1.14 -0.40 0.00 -0.01 0.00 0.00 57.85 58.76 3e1f n ARG 611 Cb 0.84 -5.54 -0.05 0.00 0.00 0.00 0.00 32.46 27.71 3e1f n ARG 611 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3e1f s THR 612 N -2.79 4.97 0.57 0.55 2.01 -1.24 -4.80 115.64 114.91 3e1f s THR 612 Ca 0.00 1.45 -0.20 0.00 0.31 0.00 0.00 61.69 63.26 3e1f s THR 612 Cb 0.00 -4.05 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 3e1f s THR 612 CO 0.00 0.12 1.05 -2.65 -0.69 0.00 0.00 174.62 172.45 3e1f n PRO 613 N 4.70 1.09 -2.99 4.92 -0.02 -1.26 -0.82 135.00 140.62 3e1f n PRO 613 Ca 0.01 0.41 -0.20 0.00 -2.02 0.00 0.00 63.50 61.70 3e1f n PRO 613 Cb 0.50 -2.23 0.02 0.00 -0.02 0.00 0.00 33.50 31.76 3e1f n PRO 613 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 3e1f s HIS 614 N -1.44 2.98 0.16 6.00 3.76 0.52 -4.77 115.29 122.50 3e1f s HIS 614 Ca 0.74 -0.10 -0.15 0.00 -0.15 0.00 0.00 55.06 55.39 3e1f s HIS 614 Cb -0.43 -2.40 0.04 0.00 1.11 0.00 0.00 32.58 30.90 3e1f s HIS 614 CO 0.48 -0.46 1.82 -1.35 -0.85 0.00 0.00 174.74 174.39 3e1f h PRO 615 N 0.46 0.58 -1.01 8.40 0.11 -1.93 -2.80 132.00 135.82 3e1f h PRO 615 Ca -0.43 -0.04 0.29 0.00 0.11 0.00 0.00 66.00 65.93 3e1f h PRO 615 Cb 1.27 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 3e1f h PRO 615 CO 0.52 0.39 0.72 0.00 -0.21 0.00 0.00 178.00 179.41 3e1f h ALA 616 N 1.17 2.88 -0.87 -0.75 0.00 -1.88 -1.34 119.26 118.47 3e1f h ALA 616 Ca 0.17 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.15 3e1f h ALA 616 Cb -0.06 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3e1f h ALA 616 CO -0.04 -1.17 0.56 1.25 0.00 0.00 0.00 179.25 179.85 3e1f h LEU 617 N 0.04 0.74 -0.76 0.00 5.85 -1.68 -0.38 115.31 119.13 3e1f h LEU 617 Ca 0.49 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 59.17 3e1f h LEU 617 Cb 1.87 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.74 3e1f h LEU 617 CO -0.03 0.43 0.18 0.00 -0.34 0.00 0.00 178.44 178.67 3e1f h THR 618 N 0.82 1.26 -0.49 1.05 1.03 -1.41 -1.13 112.91 114.04 3e1f h THR 618 Ca 0.41 -0.96 -0.01 0.00 -0.01 0.00 0.00 66.41 65.84 3e1f h THR 618 Cb 0.47 0.53 -0.02 0.00 -1.07 0.00 0.00 68.15 68.06 3e1f h THR 618 CO -0.17 0.37 0.25 -0.08 -0.01 0.00 0.00 175.52 175.87 3e1f h GLU 619 N 1.06 0.69 0.10 0.00 4.57 -1.21 -2.25 114.58 117.54 3e1f h GLU 619 Ca 0.22 -0.09 0.01 0.00 -1.18 0.00 0.00 59.36 58.32 3e1f h GLU 619 Cb 0.36 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.80 3e1f h GLU 619 CO 0.00 0.57 -0.15 0.00 -1.18 0.00 0.00 179.01 178.25 3e1f h ALA 620 N 1.09 -0.26 -0.56 2.92 0.00 -0.93 -1.17 119.26 120.36 3e1f h ALA 620 Ca 0.17 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.17 3e1f h ALA 620 Cb 0.09 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.01 3e1f h ALA 620 CO -0.02 -0.67 -0.03 -0.22 0.00 0.00 0.00 179.25 178.30 3e1f h LYS 621 N -0.30 0.08 0.26 0.00 3.64 -0.97 -0.79 116.57 118.49 3e1f h LYS 621 Ca 0.02 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3e1f h LYS 621 Cb 0.31 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3e1f h LYS 621 CO -0.07 0.05 -0.12 1.25 -2.27 0.00 0.00 179.45 178.29 3e1f h HIS 622 N 0.08 -0.32 0.00 1.91 2.76 -1.02 -2.91 115.15 115.65 3e1f h HIS 622 Ca 0.28 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.42 3e1f h HIS 622 Cb 0.44 0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.51 3e1f h HIS 622 CO -0.37 -0.16 -0.12 1.96 -1.30 0.00 0.00 177.93 177.94 3e1f h GLN 623 N -0.39 0.00 -0.70 5.26 1.08 -0.81 -2.63 115.11 116.91 3e1f h GLN 623 Ca -0.04 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.11 3e1f h GLN 623 Cb 0.30 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.70 3e1f h GLN 623 CO 0.06 0.12 0.07 1.04 -0.95 0.00 0.00 178.83 179.16 3e1f n GLN 624 N -3.74 3.94 -0.77 1.46 6.02 -0.34 -4.98 117.38 118.98 3e1f n GLN 624 Ca -0.02 -2.57 -0.32 0.00 -0.01 0.00 0.00 57.00 54.08 3e1f n GLN 624 Cb 0.23 -2.11 0.16 0.00 1.02 0.00 0.00 30.24 29.53 3e1f n GLN 624 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3e1f n GLN 625 N 0.34 -0.32 -0.19 -1.09 6.02 -1.00 -4.83 117.38 116.32 3e1f n GLN 625 Ca 0.26 -0.02 0.08 0.00 -0.01 0.00 0.00 57.00 57.30 3e1f n GLN 625 Cb 1.09 -2.34 0.18 0.00 1.02 0.00 0.00 30.24 30.18 3e1f n GLN 625 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3e1f n PHE 626 N -4.00 0.51 -4.07 1.08 3.01 -1.26 -4.90 117.46 107.82 3e1f n PHE 626 Ca 0.12 -0.40 -0.24 0.00 1.01 0.00 0.00 57.45 57.95 3e1f n PHE 626 Cb 0.52 -0.01 -0.17 0.00 -0.01 0.00 0.00 39.48 39.80 3e1f n PHE 626 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3e1f s PHE 627 N -1.06 1.10 -0.08 1.38 0.08 -1.26 -0.35 117.98 117.79 3e1f s PHE 627 Ca 0.29 -0.43 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 3e1f s PHE 627 Cb 0.16 -0.96 -0.03 0.00 -0.57 0.00 0.00 43.02 41.62 3e1f s PHE 627 CO 0.21 -0.34 -0.01 -0.65 -0.10 0.00 0.00 175.22 174.33 3e1f s GLN 628 N 1.37 2.95 0.07 0.44 -1.52 -0.19 -4.92 119.66 117.85 3e1f s GLN 628 Ca -0.03 -0.43 0.07 0.00 -1.95 0.00 0.00 55.36 53.03 3e1f s GLN 628 Cb -0.14 -2.76 -0.03 0.00 -0.22 0.00 0.00 33.01 29.86 3e1f s GLN 628 CO -0.03 0.69 -0.20 -0.06 -0.25 0.00 0.00 175.29 175.44 3e1f s PHE 629 N -0.87 1.75 0.01 0.91 0.40 -1.26 -0.39 117.98 118.54 3e1f s PHE 629 Ca 0.13 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.08 3e1f s PHE 629 Cb -0.11 -1.00 -0.01 0.00 0.51 0.00 0.00 43.02 42.40 3e1f s PHE 629 CO 0.02 0.13 -0.05 1.03 0.70 0.00 0.00 175.22 177.06 3e1f s ARG 630 N -1.49 0.37 -0.06 0.44 0.52 -0.68 -4.97 118.95 113.07 3e1f s ARG 630 Ca 0.06 -0.39 0.05 0.00 -0.52 0.00 0.00 55.73 54.94 3e1f s ARG 630 Cb -0.09 -0.23 -0.01 0.00 0.52 0.00 0.00 34.95 35.13 3e1f s ARG 630 CO 0.03 0.05 -0.23 -1.17 0.02 0.00 0.00 175.30 174.00 3e1f s LEU 631 N -0.74 2.21 -0.36 2.53 2.96 -1.26 -0.23 118.68 123.80 3e1f s LEU 631 Ca -0.05 -0.45 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 3e1f s LEU 631 Cb -0.05 -1.41 0.13 0.00 0.50 0.00 0.00 46.19 45.36 3e1f s LEU 631 CO -0.00 0.26 0.21 -0.55 -1.32 0.00 0.00 176.35 174.95 3e1f s SER 632 N -0.25 3.16 0.59 3.68 0.15 -0.03 -5.02 113.70 115.97 3e1f s SER 632 Ca -0.00 -2.17 0.00 0.00 0.70 0.00 0.00 55.95 54.47 3e1f s SER 632 Cb -0.13 -0.52 0.00 0.00 -1.71 0.00 0.00 66.02 63.66 3e1f s SER 632 CO 0.03 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.76 3e1f n GLY 633 N 4.08 0.95 0.00 9.45 0.00 -1.26 -1.80 105.19 116.61 3e1f n GLY 633 Ca 0.10 0.38 0.09 0.00 0.00 0.00 0.00 46.02 46.58 3e1f n GLY 633 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3e1f n GLN 634 N 0.00 0.95 -3.93 1.61 1.13 -1.26 -4.97 117.38 110.91 3e1f n GLN 634 Ca 0.00 -0.03 -0.35 0.00 -1.94 0.00 0.00 57.00 54.68 3e1f n GLN 634 Cb 0.00 -1.37 -0.09 0.00 0.11 0.00 0.00 30.24 28.89 3e1f n GLN 634 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3e1f s THR 635 N -2.82 5.04 -0.20 5.09 2.01 -0.75 -1.57 115.64 122.45 3e1f s THR 635 Ca 0.04 0.05 -0.08 0.00 0.31 0.00 0.00 61.69 62.01 3e1f s THR 635 Cb 0.13 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 3e1f s THR 635 CO 0.75 0.49 0.08 -0.63 -0.69 0.00 0.00 174.62 174.62 3e1f s ILE 636 N 0.06 4.89 -0.21 1.82 1.01 0.58 -0.85 121.20 128.50 3e1f s ILE 636 Ca 0.07 0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.68 3e1f s ILE 636 Cb -0.12 -3.22 -0.02 0.00 0.01 0.00 0.00 42.46 39.11 3e1f s ILE 636 CO 0.00 0.43 -0.01 -0.70 0.00 0.00 0.00 174.94 174.66 3e1f s GLU 637 N 0.56 3.50 -0.20 2.79 2.12 0.69 -0.03 118.70 128.13 3e1f s GLU 637 Ca 0.04 -0.57 -0.06 0.00 0.36 0.00 0.00 54.97 54.75 3e1f s GLU 637 Cb -0.13 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.16 3e1f s GLU 637 CO 0.01 -0.11 0.03 0.08 -0.54 0.00 0.00 175.26 174.73 3e1f s VAL 638 N 1.29 4.29 -0.07 3.70 1.01 0.50 -1.69 120.40 129.43 3e1f s VAL 638 Ca 0.04 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.85 3e1f s VAL 638 Cb -0.15 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 3e1f s VAL 638 CO -0.00 0.43 -0.17 -0.89 0.00 0.00 0.00 175.10 174.47 3e1f s THR 639 N 0.81 2.81 0.01 3.92 2.01 0.47 -0.14 115.64 125.53 3e1f s THR 639 Ca 0.02 -0.79 -0.15 0.00 0.31 0.00 0.00 61.69 61.07 3e1f s THR 639 Cb -0.14 -2.11 -0.06 0.00 0.01 0.00 0.00 72.50 70.21 3e1f s THR 639 CO 0.02 0.57 0.43 -0.55 -0.69 0.00 0.00 174.62 174.40 3e1f s SER 640 N -0.32 6.84 0.00 3.53 0.15 0.33 -1.02 113.70 123.21 3e1f s SER 640 Ca 0.02 0.99 0.14 0.00 0.70 0.00 0.00 55.95 57.80 3e1f s SER 640 Cb -0.13 -2.26 0.37 0.00 -1.71 0.00 0.00 66.02 62.30 3e1f s SER 640 CO 0.02 0.31 1.30 -0.62 1.20 0.00 0.00 173.24 175.46 3e1f n GLU 641 N 1.77 2.74 -2.38 5.44 1.02 0.52 -2.89 120.64 126.88 3e1f n GLU 641 Ca -0.13 -2.16 -0.32 0.00 -0.02 0.00 0.00 57.16 54.53 3e1f n GLU 641 Cb 0.52 -1.34 -0.03 0.00 -0.02 0.00 0.00 31.44 30.57 3e1f n GLU 641 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3e1f s TYR 642 N -1.01 3.33 -0.05 -0.32 2.02 -1.26 -4.86 117.35 115.21 3e1f s TYR 642 Ca 0.29 1.49 0.15 0.00 -0.37 0.00 0.00 57.07 58.64 3e1f s TYR 642 Cb 0.15 -2.85 -0.24 0.00 -0.40 0.00 0.00 41.96 38.63 3e1f s TYR 642 CO 0.20 -0.51 0.29 1.28 -1.57 0.00 0.00 175.55 175.25 3e1f n LEU 643 N -1.55 0.00 0.07 -1.29 4.77 -1.26 -2.03 117.00 115.70 3e1f n LEU 643 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3e1f n LEU 643 Cb 0.54 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 3e1f n LEU 643 CO 0.45 0.07 -0.05 0.49 -1.33 0.00 0.00 177.39 177.02 3e1f n PHE 644 N -2.15 -0.63 -0.88 -1.77 3.72 -1.26 -4.86 117.46 109.63 3e1f n PHE 644 Ca -0.07 0.11 -0.30 0.00 -0.05 0.00 0.00 57.45 57.14 3e1f n PHE 644 Cb 0.53 0.16 0.18 0.00 -0.94 0.00 0.00 39.48 39.40 3e1f n PHE 644 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3e1f s ARG 645 N -2.00 0.59 0.19 -1.08 1.70 -1.26 -4.63 118.95 112.46 3e1f s ARG 645 Ca 0.00 1.04 0.07 0.00 -0.47 0.00 0.00 55.73 56.37 3e1f s ARG 645 Cb 0.00 -1.72 -0.04 0.00 -0.57 0.00 0.00 34.95 32.63 3e1f s ARG 645 CO 0.00 -2.76 0.07 -1.58 -1.08 0.00 0.00 175.30 169.95 3e1f s HIS 646 N -2.72 2.97 -1.35 5.89 5.65 -1.26 -3.13 115.29 121.33 3e1f s HIS 646 Ca 0.66 -0.10 -0.10 0.00 0.25 0.00 0.00 55.06 55.76 3e1f s HIS 646 Cb -0.21 -1.41 -0.06 0.00 -1.18 0.00 0.00 32.58 29.72 3e1f s HIS 646 CO 0.59 0.53 2.55 -1.13 -0.65 0.00 0.00 174.74 176.63 3e1f n SER 647 N -0.43 6.53 -0.30 9.88 3.41 -0.52 -4.58 113.62 127.61 3e1f n SER 647 Ca -0.09 -2.56 0.05 0.00 -0.26 0.00 0.00 58.87 56.02 3e1f n SER 647 Cb 0.56 -1.42 0.20 0.00 -0.26 0.00 0.00 64.21 63.29 3e1f n SER 647 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3e1f n ASP 648 N 4.44 0.89 -2.75 4.04 5.68 -1.26 -3.78 116.55 123.81 3e1f n ASP 648 Ca 0.64 -1.86 -0.04 0.00 -0.50 0.00 0.00 54.79 53.03 3e1f n ASP 648 Cb 0.24 -0.10 0.06 0.00 -1.14 0.00 0.00 41.12 40.19 3e1f n ASP 648 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3e1f n ASN 649 N -0.07 0.83 -3.78 -1.12 5.15 -1.26 -5.07 115.26 109.93 3e1f n ASN 649 Ca 0.09 -2.30 -0.13 0.00 -0.60 0.00 0.00 54.58 51.64 3e1f n ASN 649 Cb 0.16 -0.21 -0.09 0.00 -0.53 0.00 0.00 39.78 39.11 3e1f n ASN 649 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3e1f s GLU 650 N -2.73 0.67 -0.09 1.20 8.01 -1.25 -4.01 118.70 120.50 3e1f s GLU 650 Ca 0.24 -0.29 -0.07 0.00 0.01 0.00 0.00 54.97 54.87 3e1f s GLU 650 Cb 0.39 0.29 0.03 0.00 -4.31 0.00 0.00 34.13 30.53 3e1f s GLU 650 CO -0.03 -0.19 0.23 -0.48 0.01 0.00 0.00 175.26 174.80 3e1f s LEU 651 N -1.49 0.84 0.16 1.80 2.34 -0.59 -2.08 118.68 119.65 3e1f s LEU 651 Ca -0.12 0.48 -0.30 0.00 0.06 0.00 0.00 54.13 54.25 3e1f s LEU 651 Cb -0.05 0.76 -0.07 0.00 -0.56 0.00 0.00 46.19 46.27 3e1f s LEU 651 CO 0.02 -0.11 1.01 -0.22 -1.06 0.00 0.00 176.35 175.99 3e1f s LEU 652 N 0.58 4.52 -0.23 1.48 2.96 0.13 -1.47 118.68 126.66 3e1f s LEU 652 Ca -0.04 1.93 0.01 0.00 -0.22 0.00 0.00 54.13 55.81 3e1f s LEU 652 Cb -0.05 -3.60 0.05 0.00 0.50 0.00 0.00 46.19 43.09 3e1f s LEU 652 CO -0.03 -0.08 -0.08 -2.28 -1.32 0.00 0.00 176.35 172.56 3e1f s HIS 653 N -0.30 2.54 0.36 5.38 5.65 0.37 -1.11 115.29 128.18 3e1f s HIS 653 Ca 0.47 -1.79 0.08 0.00 0.25 0.00 0.00 55.06 54.06 3e1f s HIS 653 Cb -0.26 -1.65 -0.04 0.00 -1.18 0.00 0.00 32.58 29.45 3e1f s HIS 653 CO 0.32 -0.78 0.17 1.67 -0.65 0.00 0.00 174.74 175.47 3e1f s TRP 654 N 1.35 2.69 -0.29 3.88 1.48 -1.07 -0.45 118.94 126.53 3e1f s TRP 654 Ca -0.05 -0.43 -0.18 0.00 -1.06 0.00 0.00 56.10 54.38 3e1f s TRP 654 Cb -0.18 -1.75 0.15 0.00 -1.16 0.00 0.00 33.47 30.53 3e1f s TRP 654 CO -0.07 0.27 1.04 1.41 -4.06 0.00 0.00 176.95 175.54 3e1f s MET 655 N -3.88 0.35 -0.11 3.25 1.75 -0.70 -2.31 119.30 117.64 3e1f s MET 655 Ca 0.39 0.56 -0.04 0.00 -1.25 0.00 0.00 55.69 55.34 3e1f s MET 655 Cb -0.01 0.10 -0.04 0.00 2.84 0.00 0.00 34.83 37.72 3e1f s MET 655 CO 0.23 -0.07 0.05 0.08 -0.65 0.00 0.00 175.02 174.67 3e1f s VAL 656 N 1.04 4.75 -0.09 10.11 1.01 -0.66 -1.34 120.40 135.23 3e1f s VAL 656 Ca -0.06 -0.07 -0.07 0.00 0.00 0.00 0.00 61.98 61.78 3e1f s VAL 656 Cb -0.04 -3.05 0.03 0.00 0.00 0.00 0.00 36.38 33.32 3e1f s VAL 656 CO -0.13 0.58 0.22 0.00 0.00 0.00 0.00 175.10 175.77 3e1f s ALA 657 N -0.68 -0.53 -0.42 5.51 0.00 -1.04 -1.13 121.76 123.47 3e1f s ALA 657 Ca 0.12 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.60 3e1f s ALA 657 Cb -0.12 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.58 3e1f s ALA 657 CO 0.02 -0.13 0.65 -1.17 0.00 0.00 0.00 175.76 175.13 3e1f s LEU 658 N 0.53 4.42 -1.20 0.00 2.96 0.16 -1.09 118.68 124.46 3e1f s LEU 658 Ca -0.03 -0.20 -0.14 0.00 -0.22 0.00 0.00 54.13 53.53 3e1f s LEU 658 Cb -0.05 -2.76 0.02 0.00 0.50 0.00 0.00 46.19 43.90 3e1f s LEU 658 CO -0.03 -0.75 0.27 0.47 -1.32 0.00 0.00 176.35 175.00 3e1f n ASP 659 N 6.25 -1.21 0.00 3.68 8.00 -0.91 -0.09 116.55 132.27 3e1f n ASP 659 Ca -0.01 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.37 3e1f n ASP 659 Cb 0.48 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.22 3e1f n ASP 659 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3e1f n GLY 660 N -2.17 2.79 3.60 0.44 0.00 -1.26 -4.80 105.19 103.78 3e1f n GLY 660 Ca -0.19 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 3e1f n GLY 660 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3e1f s LYS 661 N 0.00 3.55 0.70 1.61 1.02 0.87 -4.78 119.74 122.71 3e1f s LYS 661 Ca 0.00 1.16 -0.15 0.00 0.02 0.00 0.00 55.97 57.00 3e1f s LYS 661 Cb 0.00 -4.06 0.02 0.00 -0.52 0.00 0.00 37.83 33.27 3e1f s LYS 661 CO 0.00 -1.59 1.15 -1.25 -0.92 0.00 0.00 175.35 172.73 3e1f s PRO 662 N 5.06 2.44 0.11 -1.68 0.04 -1.26 0.38 135.00 140.09 3e1f s PRO 662 Ca 0.67 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.24 3e1f s PRO 662 Cb -0.17 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3e1f s PRO 662 CO 0.32 -1.56 0.00 1.28 0.04 0.00 0.00 177.00 177.09 3e1f n LEU 663 N -2.67 0.20 -4.38 -3.56 4.77 -0.28 -4.80 117.00 106.28 3e1f n LEU 663 Ca 0.11 0.17 -0.19 0.00 -0.03 0.00 0.00 56.01 56.08 3e1f n LEU 663 Cb 0.51 0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.54 3e1f n LEU 663 CO 0.48 -0.53 -0.28 0.00 -1.33 0.00 0.00 177.39 175.73 3e1f s ALA 664 N -2.00 2.02 0.01 -1.18 0.00 -1.20 -5.02 121.76 114.39 3e1f s ALA 664 Ca 0.00 -1.93 -0.29 0.00 0.00 0.00 0.00 51.96 49.74 3e1f s ALA 664 Cb 0.00 0.77 0.11 0.00 0.00 0.00 0.00 23.12 24.00 3e1f s ALA 664 CO 0.00 -0.35 1.25 -1.54 0.00 0.00 0.00 175.76 175.12 3e1f s SER 665 N -3.39 -0.04 0.00 0.00 1.04 -1.26 -1.65 113.70 108.39 3e1f s SER 665 Ca 0.35 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.58 3e1f s SER 665 Cb 0.08 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.40 3e1f s SER 665 CO 0.14 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.58 3e1f n GLY 666 N -0.61 -0.61 3.56 7.32 0.00 -0.98 -4.97 105.19 108.91 3e1f n GLY 666 Ca -0.05 -0.71 -0.01 0.00 0.00 0.00 0.00 46.02 45.25 3e1f n GLY 666 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3e1f s GLU 667 N -0.38 0.32 -0.08 1.61 -1.05 -1.26 -2.58 118.70 115.27 3e1f s GLU 667 Ca 0.00 0.63 0.02 0.00 -0.15 0.00 0.00 54.97 55.47 3e1f s GLU 667 Cb 0.00 0.19 -0.02 0.00 -0.44 0.00 0.00 34.13 33.86 3e1f s GLU 667 CO 0.00 -0.08 -0.13 0.08 0.95 0.00 0.00 175.26 176.08 3e1f s VAL 668 N 1.69 3.10 0.50 1.83 1.01 -0.27 -4.96 120.40 123.30 3e1f s VAL 668 Ca -0.07 -0.68 -0.22 0.00 0.00 0.00 0.00 61.98 61.02 3e1f s VAL 668 Cb -0.04 -2.25 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 3e1f s VAL 668 CO -0.15 0.56 1.17 -2.16 0.00 0.00 0.00 175.10 174.52 3e1f s PRO 669 N -0.28 3.55 -0.23 2.72 0.04 -1.26 0.19 135.00 139.72 3e1f s PRO 669 Ca 0.02 1.76 -0.14 0.00 0.04 0.00 0.00 61.00 62.69 3e1f s PRO 669 Cb -0.13 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 3e1f s PRO 669 CO 0.03 -0.72 0.30 -0.51 0.04 0.00 0.00 177.00 176.14 3e1f s LEU 670 N -3.35 4.11 -0.54 -3.56 1.43 -0.88 -4.72 118.68 111.17 3e1f s LEU 670 Ca 0.68 0.30 0.06 0.00 -1.03 0.00 0.00 54.13 54.14 3e1f s LEU 670 Cb -0.28 -2.33 0.22 0.00 0.03 0.00 0.00 46.19 43.82 3e1f s LEU 670 CO 0.33 -0.05 0.56 -0.67 0.23 0.00 0.00 176.35 176.75 3e1f n ASP 671 N 4.62 1.78 -4.33 2.29 2.03 -1.26 -4.62 116.55 117.05 3e1f n ASP 671 Ca -0.11 -2.98 -0.33 0.00 0.52 0.00 0.00 54.79 51.89 3e1f n ASP 671 Cb 0.51 -0.66 -0.15 0.00 -0.72 0.00 0.00 41.12 40.11 3e1f n ASP 671 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3e1f s VAL 672 N -1.43 2.82 0.39 5.18 1.01 -1.26 -4.88 120.40 122.23 3e1f s VAL 672 Ca 0.34 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 61.40 3e1f s VAL 672 Cb 0.10 -2.17 -0.10 0.00 0.00 0.00 0.00 36.38 34.21 3e1f s VAL 672 CO -0.11 0.53 0.86 0.00 0.00 0.00 0.00 175.10 176.38 3e1f s ALA 673 N 0.37 3.17 0.22 5.51 0.00 -1.26 -1.44 121.76 128.33 3e1f s ALA 673 Ca -0.12 0.20 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 3e1f s ALA 673 Cb -0.16 -2.97 -0.15 0.00 0.00 0.00 0.00 23.12 19.84 3e1f s ALA 673 CO 0.06 0.16 1.22 -0.35 0.00 0.00 0.00 175.76 176.86 3e1f n PRO 674 N -0.67 1.51 0.00 0.00 -0.04 -1.18 0.12 135.00 134.73 3e1f n PRO 674 Ca 0.05 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 3e1f n PRO 674 Cb 0.54 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 3e1f n PRO 674 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3e1f n GLN 675 N 1.66 0.00 -1.77 0.54 1.13 -0.86 -4.94 117.38 113.14 3e1f n GLN 675 Ca 0.13 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.89 3e1f n GLN 675 Cb 0.28 -1.87 0.20 0.00 0.11 0.00 0.00 30.24 28.96 3e1f n GLN 675 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3e1f s GLY 676 N -1.53 1.75 0.13 1.08 0.00 0.32 -4.60 107.32 104.46 3e1f s GLY 676 Ca 0.00 -1.17 0.05 0.00 0.00 0.00 0.00 44.72 43.61 3e1f s GLY 676 CO 0.00 -0.37 -0.13 0.54 0.00 0.00 0.00 173.10 173.15 3e1f s LYS 677 N -5.81 1.01 -0.05 2.90 1.02 -1.26 -0.51 119.74 117.05 3e1f s LYS 677 Ca 0.74 -1.28 -0.02 0.00 0.02 0.00 0.00 55.97 55.42 3e1f s LYS 677 Cb -0.05 -0.79 0.03 0.00 -0.52 0.00 0.00 37.83 36.50 3e1f s LYS 677 CO 0.54 0.14 0.11 -1.14 -0.92 0.00 0.00 175.35 174.07 3e1f s GLN 678 N -2.94 0.07 -0.16 1.68 0.74 0.80 -4.85 119.66 115.01 3e1f s GLN 678 Ca 0.10 0.26 -0.08 0.00 0.05 0.00 0.00 55.36 55.70 3e1f s GLN 678 Cb -0.03 -0.12 -0.04 0.00 1.10 0.00 0.00 33.01 33.92 3e1f s GLN 678 CO 0.02 -0.12 0.11 -0.51 -0.55 0.00 0.00 175.29 174.24 3e1f s LEU 679 N 0.80 4.13 -0.17 3.68 1.43 -1.26 -0.37 118.68 126.92 3e1f s LEU 679 Ca -0.06 0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 3e1f s LEU 679 Cb -0.08 -2.03 0.02 0.00 0.03 0.00 0.00 46.19 44.13 3e1f s LEU 679 CO -0.04 0.27 -0.17 -0.63 0.23 0.00 0.00 176.35 176.02 3e1f s ILE 680 N -0.20 1.83 -0.49 -0.59 1.01 0.96 -4.97 121.20 118.75 3e1f s ILE 680 Ca 0.10 -0.82 -0.19 0.00 0.00 0.00 0.00 60.65 59.73 3e1f s ILE 680 Cb -0.12 -1.69 0.05 0.00 0.01 0.00 0.00 42.46 40.71 3e1f s ILE 680 CO 0.01 0.48 0.60 -0.70 0.00 0.00 0.00 174.94 175.33 3e1f s GLU 681 N 1.38 3.14 0.38 2.79 2.56 -1.26 -0.30 118.70 127.38 3e1f s GLU 681 Ca 0.04 -0.80 -0.26 0.00 0.00 0.00 0.00 54.97 53.95 3e1f s GLU 681 Cb -0.13 -4.06 -0.09 0.00 2.00 0.00 0.00 34.13 31.85 3e1f s GLU 681 CO -0.12 -1.14 1.16 -0.51 -0.56 0.00 0.00 175.26 174.09 3e1f s LEU 682 N 2.59 4.26 0.80 2.70 1.43 -0.61 -4.99 118.68 124.86 3e1f s LEU 682 Ca 0.16 2.34 -0.12 0.00 -1.03 0.00 0.00 54.13 55.48 3e1f s LEU 682 Cb -0.18 -3.94 0.08 0.00 0.03 0.00 0.00 46.19 42.17 3e1f s LEU 682 CO 0.13 -0.57 1.13 -2.16 0.23 0.00 0.00 176.35 175.11 3e1f s PRO 683 N -2.14 1.89 -0.91 1.29 0.04 -1.26 -4.68 135.00 129.23 3e1f s PRO 683 Ca 0.54 1.44 -0.21 0.00 0.04 0.00 0.00 61.00 62.82 3e1f s PRO 683 Cb -0.31 -1.84 -0.24 0.00 0.04 0.00 0.00 34.50 32.16 3e1f s PRO 683 CO 0.39 -1.96 2.40 -1.91 0.04 0.00 0.00 177.00 175.96 3e1f n GLU 684 N -3.46 0.21 -1.33 4.56 2.13 -1.26 -4.79 120.64 116.70 3e1f n GLU 684 Ca 0.11 -0.14 -0.37 0.00 0.66 0.00 0.00 57.16 57.42 3e1f n GLU 684 Cb 0.52 -1.88 0.04 0.00 0.27 0.00 0.00 31.44 30.39 3e1f n GLU 684 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3e1f n LEU 685 N 10.44 -0.41 -4.72 4.31 4.77 -1.26 -4.84 117.00 125.29 3e1f n LEU 685 Ca 0.60 0.64 -0.43 0.00 -0.03 0.00 0.00 56.01 56.80 3e1f n LEU 685 Cb 0.20 -1.11 -0.02 0.00 -2.33 0.00 0.00 43.42 40.16 3e1f n LEU 685 CO 0.91 -3.56 1.27 -0.81 -1.33 0.00 0.00 177.39 173.87 3e1f n PRO 686 N 0.14 2.63 -2.67 3.23 -0.04 -1.26 -4.92 135.00 132.11 3e1f n PRO 686 Ca 0.10 0.94 -0.43 0.00 -0.04 0.00 0.00 63.50 64.07 3e1f n PRO 686 Cb 0.49 -2.74 -0.03 0.00 -0.04 0.00 0.00 33.50 31.18 3e1f n PRO 686 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 3e1f s GLN 687 N 0.32 3.64 1.02 0.54 2.00 -1.26 -5.01 119.66 120.91 3e1f s GLN 687 Ca 0.70 0.41 -0.11 0.00 -2.00 0.00 0.00 55.36 54.35 3e1f s GLN 687 Cb -0.53 -3.93 0.20 0.00 0.80 0.00 0.00 33.01 29.56 3e1f s GLN 687 CO 0.41 -1.37 1.09 -1.25 -0.50 0.00 0.00 175.29 173.67 3e1f s PRO 688 N 4.29 0.24 0.13 1.67 0.04 -1.26 -4.99 135.00 135.12 3e1f s PRO 688 Ca 0.44 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.62 3e1f s PRO 688 Cb -0.08 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.79 3e1f s PRO 688 CO 0.30 -3.03 0.00 -0.85 0.04 0.00 0.00 177.00 173.46 3e1f n GLU 689 N -4.47 0.00 -0.82 4.56 0.28 -1.26 -5.10 120.64 113.84 3e1f n GLU 689 Ca 0.07 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.74 3e1f n GLU 689 Cb 0.53 -0.09 0.11 0.00 1.43 0.00 0.00 31.44 33.42 3e1f n GLU 689 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3e1f n SER 690 N -3.06 -2.74 -4.78 -1.84 2.88 -1.26 -4.91 113.62 97.91 3e1f n SER 690 Ca 0.00 0.28 -0.36 0.00 -1.33 0.00 0.00 58.87 57.46 3e1f n SER 690 Cb 0.00 -1.11 -0.02 0.00 -0.75 0.00 0.00 64.21 62.32 3e1f n SER 690 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3e1f s ALA 691 N -2.32 2.90 0.00 -1.46 0.00 -1.26 -4.85 121.76 114.76 3e1f s ALA 691 Ca 0.54 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.25 3e1f s ALA 691 Cb -0.20 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3e1f s ALA 691 CO 0.70 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.39 3e1f n GLY 692 N 0.14 -0.67 3.14 0.00 0.00 -0.93 -4.96 105.19 101.92 3e1f n GLY 692 Ca 0.08 -1.57 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 3e1f n GLY 692 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3e1f s GLN 693 N -1.81 2.88 -0.04 1.61 2.00 -1.26 -0.81 119.66 122.22 3e1f s GLN 693 Ca 0.00 -0.92 -0.30 0.00 -2.00 0.00 0.00 55.36 52.14 3e1f s GLN 693 Cb 0.00 -2.73 -0.02 0.00 0.80 0.00 0.00 33.01 31.05 3e1f s GLN 693 CO 0.00 -0.30 1.00 -0.51 -0.50 0.00 0.00 175.29 174.98 3e1f s LEU 694 N 1.28 4.32 -0.22 3.68 1.43 -0.64 -2.14 118.68 126.40 3e1f s LEU 694 Ca 0.02 1.62 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 3e1f s LEU 694 Cb -0.15 -3.56 0.04 0.00 0.03 0.00 0.00 46.19 42.55 3e1f s LEU 694 CO -0.09 -0.35 -0.13 0.26 0.23 0.00 0.00 176.35 176.26 3e1f s TRP 695 N 1.45 2.86 0.06 0.29 0.52 -0.25 0.52 118.94 124.39 3e1f s TRP 695 Ca 0.51 -1.91 -0.27 0.00 0.02 0.00 0.00 56.10 54.45 3e1f s TRP 695 Cb -0.20 -1.84 -0.05 0.00 -1.15 0.00 0.00 33.47 30.23 3e1f s TRP 695 CO 0.24 -0.82 0.86 -1.17 0.02 0.00 0.00 176.95 176.08 3e1f s LEU 696 N 1.25 4.45 -0.06 2.99 2.96 -0.31 -2.51 118.68 127.45 3e1f s LEU 696 Ca -0.03 1.59 -0.01 0.00 -0.22 0.00 0.00 54.13 55.47 3e1f s LEU 696 Cb -0.17 -3.40 0.03 0.00 0.50 0.00 0.00 46.19 43.15 3e1f s LEU 696 CO -0.08 -0.06 0.01 -0.89 -1.32 0.00 0.00 176.35 174.00 3e1f s THR 697 N 0.16 0.28 0.04 3.68 2.01 -0.45 -0.97 115.64 120.39 3e1f s THR 697 Ca 0.43 0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.64 3e1f s THR 697 Cb -0.21 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 71.83 3e1f s THR 697 CO 0.26 0.22 -0.15 0.68 -0.69 0.00 0.00 174.62 174.95 3e1f s VAL 698 N 1.74 3.04 -0.03 3.82 -7.23 -0.37 -1.72 120.40 119.66 3e1f s VAL 698 Ca 0.01 -1.11 0.01 0.00 -1.81 0.00 0.00 61.98 59.08 3e1f s VAL 698 Cb -0.13 -2.31 0.02 0.00 0.56 0.00 0.00 36.38 34.52 3e1f s VAL 698 CO -0.04 0.32 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.91 3e1f s ARG 699 N -1.54 0.54 -0.11 4.82 0.52 0.40 -1.26 118.95 122.32 3e1f s ARG 699 Ca 0.16 -0.08 -0.18 0.00 -0.52 0.00 0.00 55.73 55.11 3e1f s ARG 699 Cb -0.11 -0.59 -0.04 0.00 0.52 0.00 0.00 34.95 34.73 3e1f s ARG 699 CO 0.07 -0.03 0.49 0.08 0.02 0.00 0.00 175.30 175.92 3e1f s VAL 700 N 0.61 5.17 -0.02 3.52 1.01 0.44 -0.48 120.40 130.65 3e1f s VAL 700 Ca -0.07 0.98 0.06 0.00 0.00 0.00 0.00 61.98 62.95 3e1f s VAL 700 Cb -0.10 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 3e1f s VAL 700 CO -0.00 0.33 -0.21 -0.69 0.00 0.00 0.00 175.10 174.53 3e1f s VAL 701 N 0.57 1.65 -0.55 2.92 1.01 -0.54 -1.98 120.40 123.49 3e1f s VAL 701 Ca 0.27 -0.88 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 3e1f s VAL 701 Cb -0.15 -1.38 0.10 0.00 0.00 0.00 0.00 36.38 34.94 3e1f s VAL 701 CO 0.11 0.47 0.60 -1.10 0.00 0.00 0.00 175.10 175.17 3e1f s GLN 702 N -0.40 3.03 0.10 2.72 -0.21 0.36 -1.55 119.66 123.71 3e1f s GLN 702 Ca 0.06 -1.35 -0.22 0.00 0.02 0.00 0.00 55.36 53.86 3e1f s GLN 702 Cb -0.09 -4.23 -0.13 0.00 1.00 0.00 0.00 33.01 29.56 3e1f s GLN 702 CO -0.00 -1.36 1.75 -1.00 -2.12 0.00 0.00 175.29 172.55 3e1f h PRO 703 N 9.02 0.05 -6.65 2.91 0.13 -1.87 0.34 132.00 135.94 3e1f h PRO 703 Ca -0.29 -0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.33 3e1f h PRO 703 Cb 1.09 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 3e1f h PRO 703 CO 1.03 0.04 0.21 -0.80 -0.23 0.00 0.00 178.00 178.24 3e1f s ASN 704 N -5.23 7.26 0.42 1.44 0.01 -1.26 -2.77 114.94 114.81 3e1f s ASN 704 Ca -0.13 1.63 -0.23 0.00 -0.71 0.00 0.00 52.86 53.42 3e1f s ASN 704 Cb 0.07 -2.50 -0.09 0.00 0.41 0.00 0.00 41.25 39.14 3e1f s ASN 704 CO 0.67 0.07 1.03 0.00 -1.51 0.00 0.00 177.10 177.35 3e1f s ALA 705 N -1.42 3.04 0.00 0.60 0.00 -1.26 -4.64 121.76 118.08 3e1f s ALA 705 Ca 0.43 0.63 0.00 0.00 0.00 0.00 0.00 51.96 53.02 3e1f s ALA 705 Cb -0.20 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.68 3e1f s ALA 705 CO 0.24 -0.17 0.00 0.25 0.00 0.00 0.00 175.76 176.08 3e1f n THR 706 N -0.30 0.00 0.19 0.00 -2.24 -0.36 -4.97 114.28 106.59 3e1f n THR 706 Ca 0.06 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.92 3e1f n THR 706 Cb 0.51 -0.33 0.15 0.00 -2.10 0.00 0.00 70.33 68.56 3e1f n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3e1f h ALA 707 N 0.58 0.87 -0.00 6.98 0.00 -1.99 -3.32 119.26 122.38 3e1f h ALA 707 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3e1f h ALA 707 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3e1f h ALA 707 CO 0.00 0.27 -0.15 -2.67 0.00 0.00 0.00 179.25 176.69 3e1f n TRP 708 N -3.17 0.00 -4.35 0.00 4.27 -1.26 -5.04 117.44 107.89 3e1f n TRP 708 Ca 0.03 0.00 -0.22 0.00 -3.89 0.00 0.00 57.50 53.42 3e1f n TRP 708 Cb 0.60 0.00 -0.13 0.00 -1.36 0.00 0.00 31.31 30.42 3e1f n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 3e1f s SER 709 N -1.22 2.10 1.13 -0.67 1.04 -1.25 -4.73 113.70 110.10 3e1f s SER 709 Ca 0.02 -0.57 -0.18 0.00 0.48 0.00 0.00 55.95 55.69 3e1f s SER 709 Cb 0.03 -0.12 0.26 0.00 0.10 0.00 0.00 66.02 66.28 3e1f s SER 709 CO 0.14 0.04 1.16 -1.83 0.98 0.00 0.00 173.24 173.74 3e1f s GLU 710 N -1.51 -0.67 0.30 4.02 1.03 -1.26 -1.23 118.70 119.39 3e1f s GLU 710 Ca 0.03 -0.12 -0.24 0.00 0.03 0.00 0.00 54.97 54.67 3e1f s GLU 710 Cb -0.09 -1.67 -0.09 0.00 -0.80 0.00 0.00 34.13 31.48 3e1f s GLU 710 CO 0.02 -3.33 0.89 0.00 -1.33 0.00 0.00 175.26 171.51 3e1f s ALA 711 N -3.22 3.26 -0.68 -0.84 0.00 -1.26 -3.54 121.76 115.48 3e1f s ALA 711 Ca 0.71 0.42 0.00 0.00 0.00 0.00 0.00 51.96 53.09 3e1f s ALA 711 Cb -0.09 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 19.95 3e1f s ALA 711 CO 0.55 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.94 3e1f n GLY 712 N 0.56 0.86 3.77 0.00 0.00 0.12 -4.96 105.19 105.54 3e1f n GLY 712 Ca 0.01 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 3e1f n GLY 712 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3e1f s HIS 713 N -2.17 2.54 -0.28 1.61 2.46 -1.07 -4.61 115.29 113.75 3e1f s HIS 713 Ca 0.00 1.24 -0.12 0.00 0.47 0.00 0.00 55.06 56.64 3e1f s HIS 713 Cb 0.00 -3.94 -0.04 0.00 -0.13 0.00 0.00 32.58 28.46 3e1f s HIS 713 CO 0.00 -2.90 0.24 0.42 -2.47 0.00 0.00 174.74 170.04 3e1f s ILE 714 N -1.17 5.27 -0.49 0.89 1.01 -1.26 -0.49 121.20 124.96 3e1f s ILE 714 Ca 0.57 0.23 0.22 0.00 0.00 0.00 0.00 60.65 61.67 3e1f s ILE 714 Cb -0.44 -3.59 -0.23 0.00 0.01 0.00 0.00 42.46 38.20 3e1f s ILE 714 CO 0.59 0.19 0.79 -1.54 0.00 0.00 0.00 174.94 174.96 3e1f n SER 715 N 5.14 0.50 -3.59 3.58 3.41 -0.84 -5.01 113.62 116.81 3e1f n SER 715 Ca -0.12 -0.33 -0.06 0.00 -0.26 0.00 0.00 58.87 58.09 3e1f n SER 715 Cb 0.51 1.29 -0.02 0.00 -0.26 0.00 0.00 64.21 65.74 3e1f n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3e1f s ALA 716 N -3.27 -1.79 0.15 7.33 0.00 -1.24 -4.66 121.76 118.29 3e1f s ALA 716 Ca 0.00 0.73 -0.24 0.00 0.00 0.00 0.00 51.96 52.45 3e1f s ALA 716 Cb 0.15 0.48 0.06 0.00 0.00 0.00 0.00 23.12 23.80 3e1f s ALA 716 CO 0.86 -0.81 0.79 1.67 0.00 0.00 0.00 175.76 178.27 3e1f s TRP 717 N -3.14 -0.30 -0.18 0.00 -2.14 -1.26 -0.42 118.94 111.50 3e1f s TRP 717 Ca 0.08 0.01 -0.28 0.00 2.66 0.00 0.00 56.10 58.56 3e1f s TRP 717 Cb -0.01 0.62 0.10 0.00 -3.10 0.00 0.00 33.47 31.08 3e1f s TRP 717 CO -0.05 -0.88 0.87 -1.14 -2.66 0.00 0.00 176.95 173.09 3e1f s GLN 718 N -3.53 0.74 0.23 3.25 2.00 -0.39 -4.99 119.66 116.97 3e1f s GLN 718 Ca 0.08 0.45 0.11 0.00 -2.00 0.00 0.00 55.36 54.00 3e1f s GLN 718 Cb -0.02 0.35 -0.05 0.00 0.80 0.00 0.00 33.01 34.09 3e1f s GLN 718 CO -0.03 -0.18 -0.21 -0.65 -0.50 0.00 0.00 175.29 173.72 3e1f s GLN 719 N -0.52 1.62 -0.07 1.67 -0.21 -1.26 -1.23 119.66 119.66 3e1f s GLN 719 Ca -0.03 -1.61 -0.05 0.00 0.02 0.00 0.00 55.36 53.69 3e1f s GLN 719 Cb -0.02 -1.84 0.03 0.00 1.00 0.00 0.00 33.01 32.17 3e1f s GLN 719 CO 0.02 0.37 0.18 -1.58 -2.12 0.00 0.00 175.29 172.16 3e1f s TRP 720 N -2.01 -0.20 -0.61 0.91 0.51 -0.15 -5.00 118.94 112.39 3e1f s TRP 720 Ca 0.25 0.51 -0.26 0.00 -2.12 0.00 0.00 56.10 54.47 3e1f s TRP 720 Cb -0.07 0.03 0.04 0.00 -0.81 0.00 0.00 33.47 32.66 3e1f s TRP 720 CO 0.12 -0.13 1.12 1.03 -0.51 0.00 0.00 176.95 178.59 3e1f s ARG 721 N 0.48 3.36 0.00 4.98 0.52 -1.26 -1.16 118.95 125.86 3e1f s ARG 721 Ca -0.03 -0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 3e1f s ARG 721 Cb -0.05 -4.08 0.00 0.00 0.52 0.00 0.00 34.95 31.35 3e1f s ARG 721 CO -0.02 -1.74 0.00 1.28 0.02 0.00 0.00 175.30 174.84 3e1f n LEU 722 N 8.30 0.00 -4.92 2.53 4.77 0.18 -4.97 117.00 122.90 3e1f n LEU 722 Ca 0.04 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.75 3e1f n LEU 722 Cb 0.48 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.63 3e1f n LEU 722 CO 0.69 0.00 0.63 0.00 -1.33 0.00 0.00 177.39 177.38 3e1f s ALA 723 N -3.20 3.10 0.02 -1.18 0.00 -1.26 -4.84 121.76 114.40 3e1f s ALA 723 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.22 3e1f s ALA 723 Cb 0.00 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 3e1f s ALA 723 CO 0.00 -1.18 -0.03 -2.00 0.00 0.00 0.00 175.76 172.54 3e1f s GLU 724 N -5.23 0.30 -0.31 0.00 2.12 -1.26 -1.62 118.70 112.70 3e1f s GLU 724 Ca 0.58 -0.49 0.00 0.00 0.36 0.00 0.00 54.97 55.43 3e1f s GLU 724 Cb -0.11 -0.02 0.10 0.00 0.26 0.00 0.00 34.13 34.36 3e1f s GLU 724 CO 0.46 -0.01 0.08 -0.80 -0.54 0.00 0.00 175.26 174.45 3e1f s ASN 725 N -1.10 4.17 0.13 -1.70 0.01 0.01 -4.97 114.94 111.49 3e1f s ASN 725 Ca -0.11 -1.72 -0.31 0.00 -0.71 0.00 0.00 52.86 50.01 3e1f s ASN 725 Cb -0.07 -1.05 -0.09 0.00 0.41 0.00 0.00 41.25 40.44 3e1f s ASN 725 CO -0.00 -0.40 1.55 -0.76 -1.51 0.00 0.00 177.10 175.98 3e1f s LEU 726 N 1.44 4.37 0.09 0.60 1.43 -1.26 -2.18 118.68 123.17 3e1f s LEU 726 Ca 0.09 2.53 -0.31 0.00 -1.03 0.00 0.00 54.13 55.41 3e1f s LEU 726 Cb -0.18 -3.59 -0.07 0.00 0.03 0.00 0.00 46.19 42.39 3e1f s LEU 726 CO -0.20 -0.81 1.29 -0.55 0.23 0.00 0.00 176.35 176.32 3e1f s SER 727 N 1.40 6.96 -0.09 2.29 0.15 -1.26 -4.89 113.70 118.26 3e1f s SER 727 Ca 0.70 2.18 0.06 0.00 0.70 0.00 0.00 55.95 59.59 3e1f s SER 727 Cb -0.42 -2.58 -0.10 0.00 -1.71 0.00 0.00 66.02 61.21 3e1f s SER 727 CO 0.31 -0.55 0.00 1.33 1.20 0.00 0.00 173.24 175.53 3e1f n VAL 728 N 3.87 0.62 -2.07 4.45 0.24 -1.26 -4.87 118.33 119.31 3e1f n VAL 728 Ca 0.10 -0.35 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 3e1f n VAL 728 Cb 0.44 -0.79 -0.05 0.00 -1.47 0.00 0.00 33.84 31.97 3e1f n VAL 728 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3e1f s THR 729 N -2.22 3.47 0.49 3.34 -4.23 -1.26 -4.95 115.64 110.28 3e1f s THR 729 Ca -0.07 -0.39 -0.22 0.00 -1.18 0.00 0.00 61.69 59.83 3e1f s THR 729 Cb 0.03 -4.05 -0.07 0.00 1.34 0.00 0.00 72.50 69.75 3e1f s THR 729 CO 0.34 -0.99 1.17 -0.76 -0.54 0.00 0.00 174.62 173.84 3e1f s LEU 730 N 9.88 3.92 0.40 4.79 1.43 -1.26 -4.95 118.68 132.89 3e1f s LEU 730 Ca 0.69 2.30 -0.19 0.00 -1.03 0.00 0.00 54.13 55.91 3e1f s LEU 730 Cb -0.06 -4.34 -0.14 0.00 0.03 0.00 0.00 46.19 41.67 3e1f s LEU 730 CO -0.01 -1.06 0.02 -0.81 0.23 0.00 0.00 176.35 174.73 3e1f n PRO 731 N -0.77 0.00 -2.64 1.29 -0.04 -1.26 -4.90 135.00 126.68 3e1f n PRO 731 Ca 0.09 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.13 3e1f n PRO 731 Cb 0.49 -0.92 -0.03 0.00 -0.04 0.00 0.00 33.50 32.99 3e1f n PRO 731 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3e1f s ALA 732 N -1.64 2.89 -0.37 0.55 0.00 -1.26 -4.97 121.76 116.96 3e1f s ALA 732 Ca 0.54 -1.38 -0.43 0.00 0.00 0.00 0.00 51.96 50.70 3e1f s ALA 732 Cb -0.55 -4.11 -0.17 0.00 0.00 0.00 0.00 23.12 18.29 3e1f s ALA 732 CO 0.59 -3.03 1.74 0.00 0.00 0.00 0.00 175.76 175.06 3e1f n ALA 733 N 8.77 -0.50 -1.75 0.00 0.00 -1.26 -4.94 120.51 120.83 3e1f n ALA 733 Ca 0.02 0.39 -0.32 0.00 0.00 0.00 0.00 53.44 53.54 3e1f n ALA 733 Cb 0.48 -2.13 0.01 0.00 0.00 0.00 0.00 19.45 17.81 3e1f n ALA 733 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3e1f s SER 734 N 3.71 6.02 0.38 0.00 1.04 -1.26 -4.98 113.70 118.60 3e1f s SER 734 Ca 1.03 1.57 0.23 0.00 0.48 0.00 0.00 55.95 59.26 3e1f s SER 734 Cb -1.23 -2.50 0.35 0.00 0.10 0.00 0.00 66.02 62.74 3e1f s SER 734 CO 0.71 -1.01 1.55 0.45 0.98 0.00 0.00 173.24 175.92 3e1f h HIS 735 N -0.04 0.00 -4.21 5.02 3.86 -1.92 -3.47 115.15 114.40 3e1f h HIS 735 Ca -0.45 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.24 3e1f h HIS 735 Cb 1.20 0.00 0.14 0.00 1.06 0.00 0.00 27.41 29.81 3e1f h HIS 735 CO 0.63 0.00 0.36 0.00 0.86 0.00 0.00 177.93 179.78 3e1f s ALA 736 N -3.22 2.14 -0.05 2.45 0.00 -1.26 -5.05 121.76 116.77 3e1f s ALA 736 Ca 0.06 0.69 -0.02 0.00 0.00 0.00 0.00 51.96 52.70 3e1f s ALA 736 Cb 0.07 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.81 3e1f s ALA 736 CO 0.68 -1.82 0.10 0.42 0.00 0.00 0.00 175.76 175.14 3e1f s ILE 737 N -2.26 -0.07 0.42 0.00 1.01 -1.26 -4.21 121.20 114.83 3e1f s ILE 737 Ca 0.70 0.22 -0.26 0.00 0.00 0.00 0.00 60.65 61.31 3e1f s ILE 737 Cb -0.25 -0.19 -0.09 0.00 0.01 0.00 0.00 42.46 41.95 3e1f s ILE 737 CO 0.47 0.09 1.42 -2.84 0.00 0.00 0.00 174.94 174.08 3e1f s PRO 738 N 1.28 3.86 -0.18 2.79 0.02 -1.26 -4.93 135.00 136.58 3e1f s PRO 738 Ca -0.07 2.42 -0.05 0.00 0.02 0.00 0.00 61.00 63.31 3e1f s PRO 738 Cb -0.12 -2.77 -0.03 0.00 0.02 0.00 0.00 34.50 31.60 3e1f s PRO 738 CO -0.05 -0.68 -0.01 -1.58 -0.33 0.00 0.00 177.00 174.36 3e1f s HIS 739 N -1.19 3.06 -0.28 6.54 2.46 0.21 -4.77 115.29 121.34 3e1f s HIS 739 Ca 0.58 -0.32 -0.12 0.00 0.47 0.00 0.00 55.06 55.67 3e1f s HIS 739 Cb -0.44 -2.03 -0.05 0.00 -0.13 0.00 0.00 32.58 29.94 3e1f s HIS 739 CO 0.57 -0.10 0.25 -1.17 -2.47 0.00 0.00 174.74 171.82 3e1f s LEU 740 N 0.66 4.03 -0.07 8.88 2.96 -1.26 -1.32 118.68 132.55 3e1f s LEU 740 Ca -0.01 0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 53.98 3e1f s LEU 740 Cb -0.14 -2.23 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 3e1f s LEU 740 CO 0.02 -0.10 0.04 -0.89 -1.32 0.00 0.00 176.35 174.11 3e1f s THR 741 N 1.87 4.58 -0.11 3.68 2.01 0.42 -4.97 115.64 123.12 3e1f s THR 741 Ca 0.10 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.87 3e1f s THR 741 Cb -0.16 -2.98 0.02 0.00 0.01 0.00 0.00 72.50 69.39 3e1f s THR 741 CO 0.11 0.54 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.59 3e1f s THR 742 N -0.98 1.16 0.00 -0.82 2.01 -1.26 -1.12 115.64 114.62 3e1f s THR 742 Ca 0.16 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.76 3e1f s THR 742 Cb -0.12 -1.13 0.00 0.00 0.01 0.00 0.00 72.50 71.26 3e1f s THR 742 CO 0.05 0.38 0.00 -1.20 -0.69 0.00 0.00 174.62 173.17 3e1f n SER 743 N 4.68 0.33 0.02 3.53 7.64 0.01 -4.99 113.62 124.83 3e1f n SER 743 Ca -0.15 -1.00 0.11 0.00 1.01 0.00 0.00 58.87 58.84 3e1f n SER 743 Cb 0.50 -0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.64 3e1f n SER 743 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3e1f n GLU 744 N -0.84 0.38 0.00 1.43 2.13 -1.26 -4.19 120.64 118.29 3e1f n GLU 744 Ca 0.00 -0.05 0.04 0.00 0.66 0.00 0.00 57.16 57.80 3e1f n GLU 744 Cb 0.00 -1.57 -0.04 0.00 0.27 0.00 0.00 31.44 30.10 3e1f n GLU 744 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 3e1f n MET 745 N -2.03 4.32 -3.83 5.31 1.56 -1.26 -4.86 117.12 116.33 3e1f n MET 745 Ca 0.00 -0.06 -0.09 0.00 -0.27 0.00 0.00 57.70 57.29 3e1f n MET 745 Cb 0.47 -0.87 -0.07 0.00 2.15 0.00 0.00 33.22 34.91 3e1f n MET 745 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 3e1f s ASP 746 N -1.64 0.03 -0.18 6.12 1.11 -1.26 -0.78 116.67 120.06 3e1f s ASP 746 Ca 0.03 -0.62 -0.00 0.00 0.18 0.00 0.00 52.55 52.14 3e1f s ASP 746 Cb 0.06 0.39 0.04 0.00 1.07 0.00 0.00 42.92 44.48 3e1f s ASP 746 CO 0.29 -0.79 -0.07 -0.36 1.18 0.00 0.00 175.17 175.43 3e1f s PHE 747 N -3.87 1.97 -0.19 4.23 0.08 -0.66 -0.81 117.98 118.72 3e1f s PHE 747 Ca 0.07 -1.30 -0.01 0.00 0.12 0.00 0.00 56.93 55.81 3e1f s PHE 747 Cb 0.04 -1.43 0.01 0.00 -0.57 0.00 0.00 43.02 41.06 3e1f s PHE 747 CO -0.09 -0.67 -0.13 0.00 -0.10 0.00 0.00 175.22 174.22 3e1f s ILE 749 N 1.30 4.49 0.02 0.00 1.09 0.41 -0.43 121.20 128.09 3e1f s ILE 749 Ca 0.04 -0.13 0.08 0.00 -1.10 0.00 0.00 60.65 59.54 3e1f s ILE 749 Cb -0.14 -3.03 -0.02 0.00 -1.06 0.00 0.00 42.46 38.20 3e1f s ILE 749 CO -0.08 0.44 -0.24 -1.61 -0.10 0.00 0.00 174.94 173.35 3e1f s GLU 750 N 0.67 1.78 -0.24 2.79 2.02 -0.44 0.72 118.70 125.99 3e1f s GLU 750 Ca 0.02 -0.99 -0.03 0.00 0.02 0.00 0.00 54.97 54.00 3e1f s GLU 750 Cb -0.13 -1.85 0.13 0.00 0.10 0.00 0.00 34.13 32.38 3e1f s GLU 750 CO 0.02 0.49 0.40 -1.17 0.02 0.00 0.00 175.26 175.01 3e1f s LEU 751 N -0.98 -0.69 0.00 1.80 2.96 -0.65 -0.61 118.68 120.51 3e1f s LEU 751 Ca 0.10 0.32 0.00 0.00 -0.22 0.00 0.00 54.13 54.33 3e1f s LEU 751 Cb -0.09 1.21 0.00 0.00 0.50 0.00 0.00 46.19 47.81 3e1f s LEU 751 CO 0.01 -0.29 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 3e1f n GLY 752 N 5.37 2.91 0.13 7.98 0.00 -1.26 -1.67 105.19 118.64 3e1f n GLY 752 Ca -0.04 0.30 -0.20 0.00 0.00 0.00 0.00 46.02 46.08 3e1f n GLY 752 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3e1f h ASN 753 N 0.00 0.59 -4.00 1.61 -0.73 -1.98 -3.47 115.58 107.60 3e1f h ASN 753 Ca 0.00 -0.70 -0.51 0.00 1.87 0.00 0.00 56.30 56.96 3e1f h ASN 753 Cb 0.00 -0.19 0.06 0.00 0.27 0.00 0.00 38.32 38.46 3e1f h ASN 753 CO 0.00 1.57 0.48 -0.54 -0.37 0.00 0.00 177.43 178.57 3e1f s LYS 754 N -2.62 3.78 -0.03 6.67 1.02 -0.67 -3.61 119.74 124.28 3e1f s LYS 754 Ca -0.09 1.77 -0.01 0.00 0.02 0.00 0.00 55.97 57.66 3e1f s LYS 754 Cb 0.06 -2.42 0.03 0.00 -0.52 0.00 0.00 37.83 34.98 3e1f s LYS 754 CO 0.89 -0.53 0.04 0.50 -0.92 0.00 0.00 175.35 175.33 3e1f s ARG 755 N -2.68 0.04 -0.08 1.68 3.52 -0.58 -1.63 118.95 119.23 3e1f s ARG 755 Ca 0.63 0.25 0.02 0.00 -0.13 0.00 0.00 55.73 56.50 3e1f s ARG 755 Cb -0.28 -0.46 -0.02 0.00 -1.56 0.00 0.00 34.95 32.63 3e1f s ARG 755 CO 0.35 -0.25 -0.13 -1.58 -0.81 0.00 0.00 175.30 172.88 3e1f s TRP 756 N 1.63 2.78 -0.13 5.12 0.51 0.22 -0.46 118.94 128.61 3e1f s TRP 756 Ca -0.02 -0.29 -0.01 0.00 -2.12 0.00 0.00 56.10 53.66 3e1f s TRP 756 Cb -0.13 -1.72 0.04 0.00 -0.81 0.00 0.00 33.47 30.85 3e1f s TRP 756 CO -0.03 0.07 -0.04 -1.14 -0.51 0.00 0.00 176.95 175.30 3e1f s GLN 757 N -0.36 1.22 -0.30 4.98 0.74 0.45 -0.44 119.66 125.95 3e1f s GLN 757 Ca 0.04 -0.31 -0.08 0.00 0.05 0.00 0.00 55.36 55.06 3e1f s GLN 757 Cb -0.12 -1.69 -0.00 0.00 1.10 0.00 0.00 33.01 32.30 3e1f s GLN 757 CO 0.02 -0.38 0.11 -0.06 -0.55 0.00 0.00 175.29 174.43 3e1f s PHE 758 N 1.75 3.15 -0.39 1.67 0.40 -0.08 -1.16 117.98 123.32 3e1f s PHE 758 Ca 0.03 -0.76 -0.29 0.00 -0.60 0.00 0.00 56.93 55.31 3e1f s PHE 758 Cb -0.14 -2.29 0.00 0.00 0.51 0.00 0.00 43.02 41.10 3e1f s PHE 758 CO -0.07 -0.51 1.55 1.21 0.70 0.00 0.00 175.22 178.10 3e1f s ASN 759 N 1.56 6.17 0.00 1.36 3.84 -1.04 -1.66 114.94 125.17 3e1f s ASN 759 Ca 0.04 0.97 0.07 0.00 0.21 0.00 0.00 52.86 54.15 3e1f s ASN 759 Cb -0.17 -2.54 0.35 0.00 -0.55 0.00 0.00 41.25 38.35 3e1f s ASN 759 CO 0.04 -1.54 1.10 0.54 -2.79 0.00 0.00 177.10 174.44 3e1f n ARG 760 N 8.22 0.09 0.05 0.43 1.74 0.04 -1.00 116.66 126.24 3e1f n ARG 760 Ca 0.19 0.24 0.07 0.00 -0.77 0.00 0.00 57.85 57.57 3e1f n ARG 760 Cb 0.48 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.35 3e1f n ARG 760 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3e1f n GLN 761 N -1.31 0.62 -0.05 5.56 0.00 -1.26 -4.58 117.38 116.37 3e1f n GLN 761 Ca 0.03 0.10 -0.06 0.00 -0.00 0.00 0.00 57.00 57.07 3e1f n GLN 761 Cb 0.06 -1.76 -0.02 0.00 0.00 0.00 0.00 30.24 28.52 3e1f n GLN 761 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3e1f n SER 762 N -2.68 1.48 0.00 1.69 7.64 -0.57 -4.93 113.62 116.24 3e1f n SER 762 Ca -0.05 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.07 3e1f n SER 762 Cb 0.68 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 3e1f n SER 762 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3e1f n GLY 763 N 1.80 1.41 3.41 0.23 0.00 -0.17 -4.66 105.19 107.21 3e1f n GLY 763 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 3e1f n GLY 763 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3e1f s PHE 764 N -2.00 2.17 -0.32 1.61 0.08 -1.25 -4.86 117.98 113.40 3e1f s PHE 764 Ca 0.00 -0.39 -0.29 0.00 0.12 0.00 0.00 56.93 56.38 3e1f s PHE 764 Cb 0.00 -1.05 -0.02 0.00 -0.57 0.00 0.00 43.02 41.38 3e1f s PHE 764 CO 0.00 0.49 1.70 -1.17 -0.10 0.00 0.00 175.22 176.14 3e1f s LEU 765 N -2.80 3.59 0.14 -0.37 2.96 -1.26 -2.50 118.68 118.45 3e1f s LEU 765 Ca 0.21 1.29 0.23 0.00 -0.22 0.00 0.00 54.13 55.64 3e1f s LEU 765 Cb -0.07 -3.53 0.12 0.00 0.50 0.00 0.00 46.19 43.21 3e1f s LEU 765 CO 0.10 -1.58 1.12 -1.54 -1.32 0.00 0.00 176.35 173.13 3e1f n SER 766 N 9.68 0.74 -3.61 3.68 3.41 -0.31 -1.62 113.62 125.59 3e1f n SER 766 Ca 0.21 0.16 -0.06 0.00 -0.26 0.00 0.00 58.87 58.92 3e1f n SER 766 Cb 0.47 0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 64.81 3e1f n SER 766 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3e1f s GLN 767 N -3.27 0.31 0.08 4.33 2.00 -1.09 -4.60 119.66 117.42 3e1f s GLN 767 Ca 0.02 0.08 0.02 0.00 -2.00 0.00 0.00 55.36 53.49 3e1f s GLN 767 Cb 0.12 0.15 -0.04 0.00 0.80 0.00 0.00 33.01 34.04 3e1f s GLN 767 CO 0.77 -0.09 -0.08 -1.64 -0.50 0.00 0.00 175.29 173.75 3e1f s MET 768 N -1.03 0.74 -0.00 1.67 -1.94 -1.26 -0.41 119.30 117.07 3e1f s MET 768 Ca 0.04 -1.13 0.00 0.00 -1.71 0.00 0.00 55.69 52.89 3e1f s MET 768 Cb -0.01 -0.29 0.01 0.00 2.01 0.00 0.00 34.83 36.55 3e1f s MET 768 CO -0.04 0.02 0.00 -1.58 -0.01 0.00 0.00 175.02 173.42 3e1f s TRP 769 N -2.73 0.03 -0.65 -0.03 0.51 0.39 -1.52 118.94 114.94 3e1f s TRP 769 Ca 0.04 0.02 0.05 0.00 -2.12 0.00 0.00 56.10 54.09 3e1f s TRP 769 Cb -0.01 -0.07 0.16 0.00 -0.81 0.00 0.00 33.47 32.75 3e1f s TRP 769 CO -0.02 -0.02 0.45 0.42 -0.51 0.00 0.00 176.95 177.26 3e1f s ILE 770 N 0.24 2.56 0.00 2.03 1.01 -0.96 -1.52 121.20 124.56 3e1f s ILE 770 Ca -0.02 -3.97 0.00 0.00 0.00 0.00 0.00 60.65 56.66 3e1f s ILE 770 Cb -0.03 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.74 3e1f s ILE 770 CO -0.01 -1.00 0.00 0.61 0.00 0.00 0.00 174.94 174.54 3e1f n GLY 771 N 2.22 0.86 1.80 6.18 0.00 -1.24 -3.62 105.19 111.40 3e1f n GLY 771 Ca 0.19 -1.40 -0.03 0.00 0.00 0.00 0.00 46.02 44.78 3e1f n GLY 771 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3e1f n ASP 772 N 1.30 4.51 -4.47 1.61 3.85 -1.26 -4.88 116.55 117.21 3e1f n ASP 772 Ca 0.00 -2.98 -0.37 0.00 -0.71 0.00 0.00 54.79 50.74 3e1f n ASP 772 Cb 0.00 -0.70 -0.12 0.00 -1.35 0.00 0.00 41.12 38.95 3e1f n ASP 772 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3e1f s LYS 773 N -2.57 3.70 0.63 0.11 -0.14 -1.24 -5.09 119.74 115.14 3e1f s LYS 773 Ca 0.46 -0.45 -0.16 0.00 -1.36 0.00 0.00 55.97 54.46 3e1f s LYS 773 Cb 0.37 -3.36 -0.01 0.00 -1.68 0.00 0.00 37.83 33.14 3e1f s LYS 773 CO 0.12 -0.17 1.13 0.15 -0.76 0.00 0.00 175.35 175.81 3e1f s LYS 774 N 1.59 2.90 -0.02 1.68 1.02 -1.26 -2.27 119.74 123.37 3e1f s LYS 774 Ca 0.06 1.50 0.04 0.00 0.02 0.00 0.00 55.97 57.60 3e1f s LYS 774 Cb -0.15 -1.95 -0.07 0.00 -0.52 0.00 0.00 37.83 35.14 3e1f s LYS 774 CO 0.05 -1.19 0.07 1.04 -0.92 0.00 0.00 175.35 174.39 3e1f n GLN 775 N -2.10 1.44 -4.67 1.68 1.13 -0.58 -4.83 117.38 109.45 3e1f n GLN 775 Ca 0.11 -0.03 -0.27 0.00 -1.94 0.00 0.00 57.00 54.88 3e1f n GLN 775 Cb 0.51 -1.11 -0.14 0.00 0.11 0.00 0.00 30.24 29.61 3e1f n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3e1f s LEU 776 N -3.75 2.18 -0.00 1.08 1.43 -1.26 -1.46 118.68 116.90 3e1f s LEU 776 Ca -0.02 -0.56 0.13 0.00 -1.03 0.00 0.00 54.13 52.65 3e1f s LEU 776 Cb 0.02 -1.05 -0.15 0.00 0.03 0.00 0.00 46.19 45.04 3e1f s LEU 776 CO 0.19 0.18 0.47 0.18 0.23 0.00 0.00 176.35 177.60 3e1f n LEU 777 N 1.75 0.44 -3.75 1.79 4.77 0.13 -4.80 117.00 117.33 3e1f n LEU 777 Ca -0.17 -0.37 -0.12 0.00 -0.03 0.00 0.00 56.01 55.32 3e1f n LEU 777 Cb 0.53 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.51 3e1f n LEU 777 CO 0.23 0.11 -0.03 -0.89 -1.33 0.00 0.00 177.39 175.48 3e1f s THR 778 N -2.38 -0.01 0.69 -5.08 2.01 -1.18 -4.91 115.64 104.77 3e1f s THR 778 Ca 0.02 0.05 -0.17 0.00 0.31 0.00 0.00 61.69 61.90 3e1f s THR 778 Cb 0.09 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 3e1f s THR 778 CO 0.53 0.02 0.61 -2.65 -0.69 0.00 0.00 174.62 172.43 3e1f n PRO 779 N 3.41 0.39 -2.65 4.92 -0.02 -1.26 -3.52 135.00 136.28 3e1f n PRO 779 Ca -0.17 0.17 -0.42 0.00 -2.02 0.00 0.00 63.50 61.06 3e1f n PRO 779 Cb 0.56 -1.87 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 3e1f n PRO 779 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3e1f s LEU 780 N -0.51 3.57 0.38 2.45 2.96 -0.64 -4.41 118.68 122.48 3e1f s LEU 780 Ca 0.68 -0.51 0.08 0.00 -0.22 0.00 0.00 54.13 54.15 3e1f s LEU 780 Cb -0.37 -2.61 -0.07 0.00 0.50 0.00 0.00 46.19 43.64 3e1f s LEU 780 CO 0.56 -1.65 -0.04 -0.13 -1.32 0.00 0.00 176.35 173.76 3e1f s ARG 781 N 5.10 1.89 0.63 1.98 0.52 -0.24 -4.03 118.95 124.79 3e1f s ARG 781 Ca 0.32 -2.02 -0.13 0.00 -0.52 0.00 0.00 55.73 53.38 3e1f s ARG 781 Cb -0.10 -1.65 -0.03 0.00 0.52 0.00 0.00 34.95 33.69 3e1f s ARG 781 CO 0.15 0.04 1.04 -0.51 0.02 0.00 0.00 175.30 176.04 3e1f s ASP 782 N -3.66 5.83 -0.07 0.23 1.11 -1.26 -0.35 116.67 118.50 3e1f s ASP 782 Ca 0.34 1.63 -0.04 0.00 0.18 0.00 0.00 52.55 54.66 3e1f s ASP 782 Cb 0.06 -2.50 0.03 0.00 1.07 0.00 0.00 42.92 41.58 3e1f s ASP 782 CO 0.17 -1.13 0.17 -1.58 1.18 0.00 0.00 175.17 173.98 3e1f s GLN 783 N -4.65 0.15 0.00 8.23 0.74 -0.53 -4.78 119.66 118.82 3e1f s GLN 783 Ca 0.59 0.35 0.00 0.00 0.05 0.00 0.00 55.36 56.35 3e1f s GLN 783 Cb -0.13 -0.07 0.00 0.00 1.10 0.00 0.00 33.01 33.90 3e1f s GLN 783 CO 0.46 -0.11 0.72 1.19 -0.55 0.00 0.00 175.29 176.99 3e1f n PHE 784 N 3.78 0.00 -4.60 1.67 3.72 -1.26 -2.51 117.46 118.26 3e1f n PHE 784 Ca -0.21 -0.26 -0.28 0.00 -0.05 0.00 0.00 57.45 56.65 3e1f n PHE 784 Cb 0.54 -0.03 -0.09 0.00 -0.94 0.00 0.00 39.48 38.97 3e1f n PHE 784 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3e1f s THR 785 N -0.51 1.17 0.02 4.37 -4.23 -1.26 -2.80 115.64 112.39 3e1f s THR 785 Ca 0.00 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.30 3e1f s THR 785 Cb 0.00 -2.51 0.04 0.00 1.34 0.00 0.00 72.50 71.38 3e1f s THR 785 CO 0.00 0.00 0.47 0.00 -0.54 0.00 0.00 174.62 174.55 3e1f s ARG 786 N -3.80 0.93 -0.42 3.99 1.70 -1.26 -4.70 118.95 115.39 3e1f s ARG 786 Ca 0.23 -0.21 -0.28 0.00 -0.47 0.00 0.00 55.73 55.00 3e1f s ARG 786 Cb 0.05 0.42 -0.08 0.00 -0.57 0.00 0.00 34.95 34.78 3e1f s ARG 786 CO 0.12 -0.31 2.35 0.00 -1.08 0.00 0.00 175.30 176.37 3e1f n ALA 787 N 0.66 1.11 -1.55 7.88 0.00 -1.26 -4.80 120.51 122.55 3e1f n ALA 787 Ca -0.19 -0.59 -0.60 0.00 0.00 0.00 0.00 53.44 52.06 3e1f n ALA 787 Cb 0.59 -2.99 -0.09 0.00 0.00 0.00 0.00 19.45 16.96 3e1f n ALA 787 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3e1f n PRO 788 N 8.81 0.00 -1.91 0.00 -0.04 -1.26 -0.73 135.00 139.88 3e1f n PRO 788 Ca 0.37 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.53 3e1f n PRO 788 Cb 0.45 -1.42 0.05 0.00 -0.04 0.00 0.00 33.50 32.54 3e1f n PRO 788 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3e1f s LEU 789 N 1.51 2.83 0.23 1.53 1.43 -1.26 -4.58 118.68 120.37 3e1f s LEU 789 Ca 0.93 1.04 -0.07 0.00 -1.03 0.00 0.00 54.13 55.00 3e1f s LEU 789 Cb -1.32 -3.77 0.28 0.00 0.03 0.00 0.00 46.19 41.41 3e1f s LEU 789 CO 0.67 -1.45 1.86 0.44 0.23 0.00 0.00 176.35 178.10 3e1f h ASP 790 N -0.72 0.85 0.40 2.29 3.32 -1.88 0.55 116.42 121.23 3e1f h ASP 790 Ca -0.45 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 3e1f h ASP 790 Cb 1.27 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 3e1f h ASP 790 CO 0.64 0.57 -0.03 0.78 -1.72 0.00 0.00 179.24 179.47 3e1f h ASN 791 N 0.99 0.00 1.51 6.45 2.35 -1.86 0.31 115.58 125.33 3e1f h ASN 791 Ca 0.34 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.04 3e1f h ASN 791 Cb 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3e1f h ASN 791 CO -0.14 0.03 -0.50 0.44 -1.65 0.00 0.00 177.43 175.62 3e1f h ASP 792 N 0.00 0.00 0.17 5.81 3.32 -1.22 -3.35 116.42 121.14 3e1f h ASP 792 Ca -0.00 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.70 3e1f h ASP 792 Cb 0.24 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.75 3e1f h ASP 792 CO 0.00 0.24 -2.08 -0.38 -1.72 0.00 0.00 179.24 175.30 3e1f n ILE 793 N -3.05 1.63 -1.13 0.35 5.41 -0.50 -0.27 119.36 121.80 3e1f n ILE 793 Ca 0.01 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.06 3e1f n ILE 793 Cb 0.64 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 3e1f n ILE 793 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3e1f n GLY 794 N 1.92 3.14 1.33 7.39 0.00 -0.02 -2.15 105.19 116.79 3e1f n GLY 794 Ca -0.31 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.56 3e1f n GLY 794 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3e1f n VAL 795 N 0.00 2.38 -2.47 1.61 0.24 -1.26 -4.85 118.33 113.98 3e1f n VAL 795 Ca 0.00 -1.60 -0.42 0.00 -2.04 0.00 0.00 64.34 60.27 3e1f n VAL 795 Cb 0.00 -0.20 -0.03 0.00 -1.47 0.00 0.00 33.84 32.15 3e1f n VAL 795 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3e1f s SER 796 N -1.36 7.04 0.44 -1.34 0.15 -0.91 -4.81 113.70 112.91 3e1f s SER 796 Ca 0.47 1.76 0.06 0.00 0.70 0.00 0.00 55.95 58.94 3e1f s SER 796 Cb 0.36 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.07 3e1f s SER 796 CO 0.13 -0.62 0.12 -1.61 1.20 0.00 0.00 173.24 172.47 3e1f s GLU 797 N 2.51 2.15 0.16 5.44 2.02 0.29 -4.89 118.70 126.38 3e1f s GLU 797 Ca 0.55 -2.03 -0.23 0.00 0.02 0.00 0.00 54.97 53.27 3e1f s GLU 797 Cb -0.23 -1.82 0.05 0.00 0.10 0.00 0.00 34.13 32.22 3e1f s GLU 797 CO 0.20 -0.19 1.60 0.00 0.02 0.00 0.00 175.26 176.89 3e1f h ALA 798 N 1.44 -0.21 0.19 5.21 0.00 -2.02 -3.08 119.26 120.79 3e1f h ALA 798 Ca -0.43 0.09 -0.35 0.00 0.00 0.00 0.00 54.91 54.22 3e1f h ALA 798 Cb 1.26 0.69 0.01 0.00 0.00 0.00 0.00 17.79 19.75 3e1f h ALA 798 CO 0.73 -0.73 -1.75 1.79 0.00 0.00 0.00 179.25 179.28 3e1f h THR 799 N -0.27 0.93 -3.30 0.00 1.35 -2.02 -3.43 112.91 106.17 3e1f h THR 799 Ca 0.16 -2.50 -0.74 0.00 -0.55 0.00 0.00 66.41 62.78 3e1f h THR 799 Cb 0.54 2.76 -0.25 0.00 -1.73 0.00 0.00 68.15 69.47 3e1f h THR 799 CO -0.51 0.86 -0.35 -0.60 -0.25 0.00 0.00 175.52 174.66 3e1f s ARG 800 N -2.57 2.82 -0.11 4.72 6.06 -1.17 -5.07 118.95 123.64 3e1f s ARG 800 Ca -0.16 -1.49 -0.16 0.00 -2.50 0.00 0.00 55.73 51.41 3e1f s ARG 800 Cb 0.05 -4.04 -0.05 0.00 0.06 0.00 0.00 34.95 30.97 3e1f s ARG 800 CO 0.85 -1.08 0.42 0.42 -2.50 0.00 0.00 175.30 173.41 3e1f s ILE 801 N 1.54 5.19 -0.55 4.11 1.09 -1.23 0.10 121.20 131.45 3e1f s ILE 801 Ca 0.04 0.83 -0.16 0.00 -1.10 0.00 0.00 60.65 60.25 3e1f s ILE 801 Cb -0.25 -3.75 0.13 0.00 -1.06 0.00 0.00 42.46 37.53 3e1f s ILE 801 CO 0.04 0.39 0.52 -0.62 -0.10 0.00 0.00 174.94 175.17 3e1f s ASP 802 N 0.27 6.21 0.33 3.58 -1.08 -1.26 -4.92 116.67 119.79 3e1f s ASP 802 Ca 0.23 -1.79 0.21 0.00 -0.52 0.00 0.00 52.55 50.68 3e1f s ASP 802 Cb -0.15 -2.22 1.15 0.00 -1.46 0.00 0.00 42.92 40.24 3e1f s ASP 802 CO 0.09 -0.87 1.64 -0.81 0.52 0.00 0.00 175.17 175.74 3e1f n PRO 803 N 5.29 0.14 0.00 4.34 -0.04 -1.26 -2.30 135.00 141.17 3e1f n PRO 803 Ca -0.13 0.63 -0.09 0.00 -0.04 0.00 0.00 63.50 63.88 3e1f n PRO 803 Cb 0.40 -1.99 -0.14 0.00 -0.04 0.00 0.00 33.50 31.74 3e1f n PRO 803 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3e1f h ASN 804 N 0.00 0.02 -3.03 3.54 -1.24 -1.96 -3.36 115.58 109.55 3e1f h ASN 804 Ca 0.00 -0.04 -0.58 0.00 0.71 0.00 0.00 56.30 56.39 3e1f h ASN 804 Cb 0.07 -0.01 0.12 0.00 0.73 0.00 0.00 38.32 39.24 3e1f h ASN 804 CO 0.00 1.04 0.24 0.00 -1.29 0.00 0.00 177.43 177.41 3e1f n ALA 805 N -2.52 0.37 -0.23 1.57 0.00 -0.97 -4.70 120.51 114.03 3e1f n ALA 805 Ca -0.13 0.28 0.03 0.00 0.00 0.00 0.00 53.44 53.62 3e1f n ALA 805 Cb 1.02 -2.11 0.15 0.00 0.00 0.00 0.00 19.45 18.51 3e1f n ALA 805 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 3e1f h TRP 806 N 1.81 0.35 -0.92 0.00 4.06 -1.83 -0.94 115.95 118.48 3e1f h TRP 806 Ca -0.44 0.04 0.05 0.00 2.06 0.00 0.00 58.89 60.59 3e1f h TRP 806 Cb 1.33 -0.05 -0.06 0.00 -1.00 0.00 0.00 29.16 29.37 3e1f h TRP 806 CO 0.46 0.02 0.59 -0.24 -3.56 0.00 0.00 178.44 175.71 3e1f h VAL 807 N 0.35 1.11 -0.22 1.49 3.04 -0.97 -0.81 116.25 120.25 3e1f h VAL 807 Ca 0.36 -0.38 -0.11 0.00 -1.01 0.00 0.00 66.70 65.55 3e1f h VAL 807 Cb 0.54 -0.10 -0.00 0.00 -2.01 0.00 0.00 31.29 29.71 3e1f h VAL 807 CO -0.40 0.20 -0.30 -0.33 -1.01 0.00 0.00 177.57 175.73 3e1f h GLU 808 N 1.12 0.59 -0.85 4.17 4.39 -1.55 -0.48 114.58 121.98 3e1f h GLU 808 Ca 0.38 -0.34 0.09 0.00 0.34 0.00 0.00 59.36 59.83 3e1f h GLU 808 Cb 0.08 0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.68 3e1f h GLU 808 CO -0.14 0.95 0.50 0.00 -1.16 0.00 0.00 179.01 179.15 3e1f h ARG 809 N 0.28 0.82 0.13 2.33 3.08 -0.76 0.17 114.38 120.42 3e1f h ARG 809 Ca 0.02 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3e1f h ARG 809 Cb 0.88 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.74 3e1f h ARG 809 CO 0.07 0.54 -0.06 -1.49 -1.07 0.00 0.00 179.97 177.96 3e1f h TRP 810 N 0.85 -0.16 0.03 3.04 6.55 -1.05 -1.37 115.95 123.84 3e1f h TRP 810 Ca 0.40 -0.00 0.03 0.00 0.95 0.00 0.00 58.89 60.26 3e1f h TRP 810 Cb 0.33 0.05 -0.05 0.00 -0.86 0.00 0.00 29.16 28.63 3e1f h TRP 810 CO -0.05 0.19 -0.42 0.87 -1.05 0.00 0.00 178.44 177.97 3e1f h LYS 811 N -0.52 -0.57 -0.58 0.49 1.57 -0.53 -0.72 116.57 115.70 3e1f h LYS 811 Ca -0.02 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.90 3e1f h LYS 811 Cb 0.42 0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.78 3e1f h LYS 811 CO 0.03 -0.38 0.14 0.00 -0.57 0.00 0.00 179.45 178.67 3e1f h ALA 812 N -0.08 0.70 0.00 3.86 0.00 -0.71 0.56 119.26 123.58 3e1f h ALA 812 Ca 0.04 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3e1f h ALA 812 Cb 0.66 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3e1f h ALA 812 CO -0.30 -0.28 -0.03 0.00 0.00 0.00 0.00 179.25 178.64 3e1f h ALA 813 N 1.45 1.35 0.00 0.00 0.00 -0.43 -3.46 119.26 118.16 3e1f h ALA 813 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3e1f h ALA 813 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3e1f h ALA 813 CO -0.37 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.33 3e1f n GLY 814 N -1.10 0.80 0.37 0.00 0.00 0.19 -4.90 105.19 100.54 3e1f n GLY 814 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.09 3e1f n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3e1f h HIS 815 N 0.00 0.77 0.00 1.61 3.86 -1.68 -1.67 115.15 118.04 3e1f h HIS 815 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3e1f h HIS 815 Cb 0.00 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.22 3e1f h HIS 815 CO 0.00 0.34 0.00 0.66 0.86 0.00 0.00 177.93 179.79 3e1f n TYR 816 N -4.52 0.40 -3.16 2.45 4.01 -1.26 -3.86 117.16 111.23 3e1f n TYR 816 Ca 0.14 0.14 -0.18 0.00 -0.16 0.00 0.00 57.90 57.84 3e1f n TYR 816 Cb 0.38 -0.73 -0.03 0.00 -0.31 0.00 0.00 39.34 38.65 3e1f n TYR 816 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3e1f n GLN 817 N -1.85 0.94 -3.75 -0.72 10.64 -0.64 -5.09 117.38 116.91 3e1f n GLN 817 Ca 0.04 -3.25 -0.35 0.00 -1.83 0.00 0.00 57.00 51.61 3e1f n GLN 817 Cb 0.27 -1.60 -0.08 0.00 -0.86 0.00 0.00 30.24 27.97 3e1f n GLN 817 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3e1f s ALA 818 N -2.07 3.65 -0.22 2.61 0.00 -1.15 -4.88 121.76 119.70 3e1f s ALA 818 Ca 0.38 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 51.38 3e1f s ALA 818 Cb 0.32 -2.16 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 3e1f s ALA 818 CO -0.08 0.12 0.78 -2.00 0.00 0.00 0.00 175.76 174.57 3e1f s GLU 819 N 0.45 4.20 -0.69 0.00 2.56 -1.10 -4.84 118.70 119.28 3e1f s GLU 819 Ca 0.07 0.87 -0.27 0.00 0.00 0.00 0.00 54.97 55.64 3e1f s GLU 819 Cb -0.11 -3.62 0.03 0.00 2.00 0.00 0.00 34.13 32.43 3e1f s GLU 819 CO -0.01 -0.43 1.24 0.00 -0.56 0.00 0.00 175.26 175.50 3e1f s ALA 820 N 2.53 2.84 -0.03 6.30 0.00 -1.26 -2.63 121.76 129.51 3e1f s ALA 820 Ca 0.34 -1.22 -0.21 0.00 0.00 0.00 0.00 51.96 50.87 3e1f s ALA 820 Cb -0.16 -4.17 -0.05 0.00 0.00 0.00 0.00 23.12 18.74 3e1f s ALA 820 CO 0.09 -3.07 0.60 0.00 0.00 0.00 0.00 175.76 173.38 3e1f s ALA 821 N 5.42 3.46 -0.15 0.00 0.00 -0.94 -4.87 121.76 124.68 3e1f s ALA 821 Ca 0.37 0.02 -0.26 0.00 0.00 0.00 0.00 51.96 52.09 3e1f s ALA 821 Cb -0.08 -2.77 -0.01 0.00 0.00 0.00 0.00 23.12 20.26 3e1f s ALA 821 CO 0.18 0.10 0.88 -1.17 0.00 0.00 0.00 175.76 175.75 3e1f s LEU 822 N 0.07 4.20 -0.20 0.00 2.96 -1.26 -0.09 118.68 124.36 3e1f s LEU 822 Ca 0.32 1.28 0.06 0.00 -0.22 0.00 0.00 54.13 55.57 3e1f s LEU 822 Cb -0.18 -3.32 -0.21 0.00 0.50 0.00 0.00 46.19 42.98 3e1f s LEU 822 CO 0.17 -0.40 0.05 0.18 -1.32 0.00 0.00 176.35 175.02 3e1f n LEU 823 N 5.10 1.85 -3.51 -0.68 4.77 0.12 -4.95 117.00 119.69 3e1f n LEU 823 Ca 0.05 0.01 -0.17 0.00 -0.03 0.00 0.00 56.01 55.88 3e1f n LEU 823 Cb 0.49 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 3e1f n LEU 823 CO 0.49 0.74 0.43 -1.58 -1.33 0.00 0.00 177.39 176.14 3e1f s GLN 824 N -2.53 1.08 -0.40 3.23 0.74 -0.98 -4.98 119.66 115.83 3e1f s GLN 824 Ca -0.23 0.16 0.05 0.00 0.05 0.00 0.00 55.36 55.40 3e1f s GLN 824 Cb 0.08 0.51 0.18 0.00 1.10 0.00 0.00 33.01 34.87 3e1f s GLN 824 CO 0.72 -0.35 0.71 0.00 -0.55 0.00 0.00 175.29 175.81 3e1f s THR 826 N 1.81 2.69 -0.02 0.00 -4.23 -0.14 -4.94 115.64 110.81 3e1f s THR 826 Ca 0.17 -2.07 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 3e1f s THR 826 Cb -0.02 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.13 3e1f s THR 826 CO -0.08 -0.27 -0.06 0.00 -0.54 0.00 0.00 174.62 173.67 3e1f s ALA 827 N -2.49 0.57 0.11 3.99 0.00 -1.26 -0.23 121.76 122.44 3e1f s ALA 827 Ca 0.33 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.12 3e1f s ALA 827 Cb -0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 3e1f s ALA 827 CO 0.18 0.09 -0.09 -0.51 0.00 0.00 0.00 175.76 175.44 3e1f s ASP 828 N 0.16 1.39 -0.12 0.00 -0.00 -0.40 -4.96 116.67 112.74 3e1f s ASP 828 Ca -0.02 -0.92 -0.03 0.00 -0.00 0.00 0.00 52.55 51.59 3e1f s ASP 828 Cb -0.06 0.04 -0.03 0.00 -0.00 0.00 0.00 42.92 42.86 3e1f s ASP 828 CO -0.00 -0.35 -0.02 -0.89 -0.00 0.00 0.00 175.17 173.91 3e1f s THR 829 N -3.02 4.08 0.50 -1.27 2.01 -1.26 -0.39 115.64 116.28 3e1f s THR 829 Ca 0.10 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 61.83 3e1f s THR 829 Cb 0.01 -2.75 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 3e1f s THR 829 CO -0.02 0.54 0.18 -0.76 -0.69 0.00 0.00 174.62 173.88 3e1f s LEU 830 N -0.21 2.63 0.00 4.42 1.43 0.01 -4.99 118.68 121.98 3e1f s LEU 830 Ca 0.04 -1.38 0.00 0.00 -1.03 0.00 0.00 54.13 51.76 3e1f s LEU 830 Cb -0.13 -1.05 0.00 0.00 0.03 0.00 0.00 46.19 45.05 3e1f s LEU 830 CO 0.02 -0.86 0.96 0.00 0.23 0.00 0.00 176.35 176.71 3e1f n ALA 831 N -1.42 0.94 -1.73 4.21 0.00 -1.26 -3.60 120.51 117.65 3e1f n ALA 831 Ca -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.32 3e1f n ALA 831 Cb 0.66 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 19.14 3e1f n ALA 831 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3e1f n ASP 832 N -1.46 -0.45 -3.64 0.00 5.75 -1.26 -5.10 116.55 110.39 3e1f n ASP 832 Ca 0.00 -0.99 -0.03 0.00 -0.01 0.00 0.00 54.79 53.76 3e1f n ASP 832 Cb 0.03 0.13 -0.04 0.00 -1.03 0.00 0.00 41.12 40.22 3e1f n ASP 832 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3e1f s ALA 833 N 0.00 -2.12 0.25 2.12 0.00 -1.24 -2.92 121.76 117.86 3e1f s ALA 833 Ca 0.00 1.86 -0.10 0.00 0.00 0.00 0.00 51.96 53.72 3e1f s ALA 833 Cb 0.00 -1.23 -0.07 0.00 0.00 0.00 0.00 23.12 21.82 3e1f s ALA 833 CO 0.00 -0.31 0.58 0.08 0.00 0.00 0.00 175.76 176.11 3e1f s VAL 834 N -1.25 4.91 -0.26 0.00 1.01 -0.64 -0.81 120.40 123.35 3e1f s VAL 834 Ca 0.09 0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 3e1f s VAL 834 Cb -0.01 -3.63 0.08 0.00 0.00 0.00 0.00 36.38 32.82 3e1f s VAL 834 CO -0.06 -0.12 0.06 -0.22 0.00 0.00 0.00 175.10 174.75 3e1f s LEU 835 N -2.94 1.83 -0.20 3.92 2.96 0.47 -2.63 118.68 122.09 3e1f s LEU 835 Ca 0.48 -1.29 -0.14 0.00 -0.22 0.00 0.00 54.13 52.96 3e1f s LEU 835 Cb -0.11 -0.78 -0.04 0.00 0.50 0.00 0.00 46.19 45.76 3e1f s LEU 835 CO 0.22 -0.36 0.32 -0.63 -1.32 0.00 0.00 176.35 174.58 3e1f s ILE 836 N 1.70 5.26 -0.20 6.68 -1.09 -0.46 -1.28 121.20 131.81 3e1f s ILE 836 Ca 0.04 0.55 -0.03 0.00 -2.23 0.00 0.00 60.65 58.98 3e1f s ILE 836 Cb -0.17 -3.65 -0.00 0.00 -1.58 0.00 0.00 42.46 37.05 3e1f s ILE 836 CO -0.18 0.30 -0.08 -0.89 -1.23 0.00 0.00 174.94 172.87 3e1f s THR 837 N 1.06 3.11 0.45 2.92 2.01 0.67 0.16 115.64 126.03 3e1f s THR 837 Ca 0.16 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.62 3e1f s THR 837 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.93 3e1f s THR 837 CO 0.06 0.45 0.05 0.42 -0.69 0.00 0.00 174.62 174.92 3e1f s THR 838 N 1.32 1.71 -0.30 -0.82 -4.23 -0.57 -0.97 115.64 111.79 3e1f s THR 838 Ca 0.04 -1.93 -0.13 0.00 -1.18 0.00 0.00 61.69 58.48 3e1f s THR 838 Cb -0.14 -2.64 0.18 0.00 1.34 0.00 0.00 72.50 71.23 3e1f s THR 838 CO -0.04 0.00 1.04 0.00 -0.54 0.00 0.00 174.62 175.08 3e1f s ALA 839 N -2.76 -3.27 0.27 3.99 0.00 -0.81 -2.22 121.76 116.96 3e1f s ALA 839 Ca 0.25 1.58 0.11 0.00 0.00 0.00 0.00 51.96 53.90 3e1f s ALA 839 Cb 0.05 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.73 3e1f s ALA 839 CO 0.13 -1.33 -0.14 -1.01 0.00 0.00 0.00 175.76 173.41 3e1f s HIS 840 N 2.80 2.43 -0.31 0.00 3.76 -0.47 0.15 115.29 123.65 3e1f s HIS 840 Ca -0.01 -0.29 -0.01 0.00 -0.15 0.00 0.00 55.06 54.60 3e1f s HIS 840 Cb -0.09 -1.07 0.10 0.00 1.11 0.00 0.00 32.58 32.64 3e1f s HIS 840 CO -0.13 0.68 0.10 0.00 -0.85 0.00 0.00 174.74 174.54 3e1f s ALA 841 N -2.41 1.53 -0.06 -1.40 0.00 0.87 -1.16 121.76 119.13 3e1f s ALA 841 Ca 0.30 -1.67 -0.30 0.00 0.00 0.00 0.00 51.96 50.29 3e1f s ALA 841 Cb -0.06 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.41 3e1f s ALA 841 CO 0.16 -1.67 1.15 -1.58 0.00 0.00 0.00 175.76 173.83 3e1f s TRP 842 N 1.61 3.28 0.36 0.00 0.51 -0.02 -2.21 118.94 122.48 3e1f s TRP 842 Ca 0.10 1.31 0.04 0.00 -2.12 0.00 0.00 56.10 55.43 3e1f s TRP 842 Cb -0.17 -3.36 -0.03 0.00 -0.81 0.00 0.00 33.47 29.09 3e1f s TRP 842 CO -0.25 -1.05 0.17 -0.65 -0.51 0.00 0.00 176.95 174.66 3e1f s GLN 843 N 2.09 1.79 -0.30 4.98 -0.21 -1.08 -0.69 119.66 126.24 3e1f s GLN 843 Ca 0.54 -2.06 -0.08 0.00 0.02 0.00 0.00 55.36 53.79 3e1f s GLN 843 Cb -0.23 -0.24 0.16 0.00 1.00 0.00 0.00 33.01 33.70 3e1f s GLN 843 CO 0.21 -0.51 0.72 -1.58 -2.12 0.00 0.00 175.29 172.02 3e1f s HIS 844 N -3.38 -1.26 -1.33 0.91 2.46 -0.49 -2.70 115.29 109.50 3e1f s HIS 844 Ca 0.31 1.75 -0.02 0.00 0.47 0.00 0.00 55.06 57.57 3e1f s HIS 844 Cb 0.03 0.60 0.01 0.00 -0.13 0.00 0.00 32.58 33.09 3e1f s HIS 844 CO 0.18 -0.66 0.77 1.04 -2.47 0.00 0.00 174.74 173.60 3e1f n GLN 845 N 5.37 -5.19 0.00 2.88 6.02 -1.26 -2.14 117.38 123.06 3e1f n GLN 845 Ca -0.07 0.64 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 3e1f n GLN 845 Cb 0.51 -5.29 0.00 0.00 1.02 0.00 0.00 30.24 26.48 3e1f n GLN 845 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3e1f n GLY 846 N -1.57 1.83 3.68 1.08 0.00 -1.26 -4.98 105.19 103.97 3e1f n GLY 846 Ca -0.25 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.07 3e1f n GLY 846 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3e1f n LYS 847 N 0.00 2.55 -2.84 1.61 3.00 -0.91 -4.93 118.16 116.64 3e1f n LYS 847 Ca 0.00 0.93 -0.43 0.00 -0.00 0.00 0.00 58.31 58.81 3e1f n LYS 847 Cb 0.00 -2.80 -0.04 0.00 0.00 0.00 0.00 35.03 32.18 3e1f n LYS 847 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 3e1f s THR 848 N 3.13 4.50 -0.16 3.15 2.01 -1.26 -1.40 115.64 125.60 3e1f s THR 848 Ca 0.86 0.72 -0.24 0.00 0.31 0.00 0.00 61.69 63.34 3e1f s THR 848 Cb -0.56 -4.42 -0.21 0.00 0.01 0.00 0.00 72.50 67.32 3e1f s THR 848 CO 0.42 -0.81 0.49 -0.07 -0.69 0.00 0.00 174.62 173.96 3e1f h LEU 849 N 10.49 0.00 -8.32 4.42 3.38 -1.25 -3.42 115.31 120.61 3e1f h LEU 849 Ca -0.24 -0.73 -0.25 0.00 0.09 0.00 0.00 57.88 56.75 3e1f h LEU 849 Cb 1.08 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.65 3e1f h LEU 849 CO 1.02 1.16 -0.71 -0.36 0.09 0.00 0.00 178.44 179.63 3e1f s PHE 850 N -2.24 0.80 -0.05 1.13 0.08 -1.02 -1.89 117.98 114.78 3e1f s PHE 850 Ca -0.22 -0.73 0.01 0.00 0.12 0.00 0.00 56.93 56.11 3e1f s PHE 850 Cb 0.01 -0.47 0.02 0.00 -0.57 0.00 0.00 43.02 42.01 3e1f s PHE 850 CO 0.60 -0.12 -0.05 0.42 -0.10 0.00 0.00 175.22 175.98 3e1f s ILE 851 N -2.61 0.60 -0.28 0.64 1.01 -0.81 -0.84 121.20 118.92 3e1f s ILE 851 Ca 0.02 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.55 3e1f s ILE 851 Cb -0.02 -0.63 0.08 0.00 0.01 0.00 0.00 42.46 41.90 3e1f s ILE 851 CO -0.02 0.25 -0.02 -0.55 0.00 0.00 0.00 174.94 174.60 3e1f s SER 852 N 1.08 4.21 -0.17 3.58 0.15 -0.31 -0.76 113.70 121.49 3e1f s SER 852 Ca -0.08 -1.53 -0.11 0.00 0.70 0.00 0.00 55.95 54.93 3e1f s SER 852 Cb -0.14 -1.31 -0.05 0.00 -1.71 0.00 0.00 66.02 62.81 3e1f s SER 852 CO -0.01 -0.29 0.19 -0.13 1.20 0.00 0.00 173.24 174.21 3e1f s ARG 853 N 1.25 4.09 0.15 5.44 0.52 -0.86 -1.37 118.95 128.17 3e1f s ARG 853 Ca 0.00 -0.08 0.00 0.00 -0.52 0.00 0.00 55.73 55.13 3e1f s ARG 853 Cb -0.19 -3.38 -0.04 0.00 0.52 0.00 0.00 34.95 31.86 3e1f s ARG 853 CO -0.09 0.37 0.03 0.15 0.02 0.00 0.00 175.30 175.78 3e1f s LYS 854 N 0.13 1.01 -0.16 3.54 1.02 -0.94 -0.96 119.74 123.36 3e1f s LYS 854 Ca 0.12 -1.48 -0.05 0.00 0.02 0.00 0.00 55.97 54.58 3e1f s LYS 854 Cb -0.12 0.01 0.08 0.00 -0.52 0.00 0.00 37.83 37.28 3e1f s LYS 854 CO 0.01 -0.20 0.30 0.95 -0.92 0.00 0.00 175.35 175.49 3e1f s THR 855 N -3.86 -0.47 -0.20 2.17 -4.23 -0.94 -1.52 115.64 106.58 3e1f s THR 855 Ca 0.24 0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 60.81 3e1f s THR 855 Cb 0.07 -0.56 -0.05 0.00 1.34 0.00 0.00 72.50 73.30 3e1f s THR 855 CO 0.03 0.04 0.17 -0.31 -0.54 0.00 0.00 174.62 174.00 3e1f s TYR 856 N 2.46 3.39 -0.35 3.99 1.51 0.12 -2.11 117.35 126.36 3e1f s TYR 856 Ca 0.03 0.35 0.03 0.00 -1.01 0.00 0.00 57.07 56.46 3e1f s TYR 856 Cb -0.13 -2.22 0.10 0.00 -0.11 0.00 0.00 41.96 39.60 3e1f s TYR 856 CO -0.11 0.22 0.09 0.50 -1.11 0.00 0.00 175.55 175.14 3e1f s ARG 857 N 0.57 1.32 -0.31 -0.62 3.52 -0.65 -1.35 118.95 121.44 3e1f s ARG 857 Ca 0.09 -1.75 -0.16 0.00 -0.13 0.00 0.00 55.73 53.79 3e1f s ARG 857 Cb -0.12 -2.89 -0.02 0.00 -1.56 0.00 0.00 34.95 30.36 3e1f s ARG 857 CO 0.01 -0.97 0.42 0.42 -0.81 0.00 0.00 175.30 174.37 3e1f s ILE 858 N 0.96 5.12 0.42 4.11 1.01 -1.08 -1.83 121.20 129.91 3e1f s ILE 858 Ca 0.11 0.43 0.04 0.00 0.00 0.00 0.00 60.65 61.23 3e1f s ILE 858 Cb -0.19 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.50 3e1f s ILE 858 CO -0.11 -0.01 0.30 -0.90 0.00 0.00 0.00 174.94 174.22 3e1f n ASP 859 N 5.48 2.39 -0.28 3.58 5.68 -1.15 -1.62 116.55 130.63 3e1f n ASP 859 Ca -0.07 -2.47 0.16 0.00 -0.50 0.00 0.00 54.79 51.91 3e1f n ASP 859 Cb 0.50 -0.02 0.43 0.00 -1.14 0.00 0.00 41.12 40.90 3e1f n ASP 859 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3e1f h GLY 860 N 0.53 1.18 1.27 6.12 0.00 -1.70 0.19 103.07 110.66 3e1f h GLY 860 Ca -0.27 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.80 3e1f h GLY 860 CO 0.43 -0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.83 3e1f n SER 861 N -4.58 0.00 -0.67 0.19 3.41 -1.26 -4.70 113.62 106.00 3e1f n SER 861 Ca 0.20 -0.31 -0.06 0.00 -0.26 0.00 0.00 58.87 58.45 3e1f n SER 861 Cb 0.62 -0.14 -0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3e1f n SER 861 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3e1f n GLY 862 N 0.26 0.17 3.47 5.00 0.00 0.68 -5.04 105.19 109.73 3e1f n GLY 862 Ca 0.12 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 3e1f n GLY 862 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3e1f s GLN 863 N -4.35 3.31 -0.27 1.61 -0.21 -1.25 -4.67 119.66 113.82 3e1f s GLN 863 Ca 0.01 -0.59 -0.14 0.00 0.02 0.00 0.00 55.36 54.66 3e1f s GLN 863 Cb -0.00 -2.71 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 3e1f s GLN 863 CO 0.01 0.35 0.33 1.41 -2.12 0.00 0.00 175.29 175.27 3e1f s MET 864 N 0.04 4.00 -0.46 2.91 -2.45 0.25 -2.92 119.30 120.67 3e1f s MET 864 Ca -0.02 -0.04 -0.11 0.00 -1.25 0.00 0.00 55.69 54.27 3e1f s MET 864 Cb -0.14 -3.66 0.10 0.00 1.25 0.00 0.00 34.83 32.38 3e1f s MET 864 CO 0.03 -0.25 0.35 0.00 1.05 0.00 0.00 175.02 176.20 3e1f s ALA 865 N 1.99 3.43 -0.22 4.11 0.00 -0.76 -0.02 121.76 130.28 3e1f s ALA 865 Ca 0.13 -2.33 -0.18 0.00 0.00 0.00 0.00 51.96 49.59 3e1f s ALA 865 Cb -0.16 -2.87 -0.03 0.00 0.00 0.00 0.00 23.12 20.06 3e1f s ALA 865 CO 0.10 -1.80 0.50 0.42 0.00 0.00 0.00 175.76 174.98 3e1f s ILE 866 N 1.47 5.10 -0.26 0.00 1.01 0.15 -1.63 121.20 127.05 3e1f s ILE 866 Ca 0.04 0.90 -0.01 0.00 0.00 0.00 0.00 60.65 61.58 3e1f s ILE 866 Cb -0.25 -3.82 0.04 0.00 0.01 0.00 0.00 42.46 38.43 3e1f s ILE 866 CO 0.02 0.15 -0.07 -0.89 0.00 0.00 0.00 174.94 174.15 3e1f s THR 867 N 1.86 2.70 -0.03 2.92 2.01 -0.90 -0.17 115.64 124.03 3e1f s THR 867 Ca 0.22 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 61.02 3e1f s THR 867 Cb -0.15 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3e1f s THR 867 CO 0.09 0.12 0.01 -0.69 -0.69 0.00 0.00 174.62 173.47 3e1f s VAL 868 N 1.27 4.29 -0.29 3.82 1.01 -0.37 -2.22 120.40 127.91 3e1f s VAL 868 Ca -0.02 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 3e1f s VAL 868 Cb -0.18 -2.88 0.11 0.00 0.00 0.00 0.00 36.38 33.43 3e1f s VAL 868 CO -0.05 0.46 0.16 -1.81 0.00 0.00 0.00 175.10 173.87 3e1f s ASP 869 N -1.33 3.18 0.11 3.32 1.01 -0.13 -2.24 116.67 120.57 3e1f s ASP 869 Ca 0.18 -1.25 -0.01 0.00 0.71 0.00 0.00 52.55 52.17 3e1f s ASP 869 Cb -0.11 -0.20 -0.04 0.00 1.01 0.00 0.00 42.92 43.57 3e1f s ASP 869 CO 0.08 -0.42 0.28 -0.69 0.21 0.00 0.00 175.17 174.63 3e1f s VAL 870 N 2.08 5.30 -0.03 -1.27 1.01 -0.43 -2.03 120.40 125.04 3e1f s VAL 870 Ca 0.10 -0.30 0.06 0.00 0.00 0.00 0.00 61.98 61.83 3e1f s VAL 870 Cb -0.16 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 3e1f s VAL 870 CO -0.34 0.05 -0.22 -1.61 0.00 0.00 0.00 175.10 172.98 3e1f s GLU 871 N -2.72 1.95 -0.09 2.72 2.02 0.06 -1.00 118.70 121.63 3e1f s GLU 871 Ca 0.37 -0.77 0.02 0.00 0.02 0.00 0.00 54.97 54.61 3e1f s GLU 871 Cb -0.12 -1.78 0.01 0.00 0.10 0.00 0.00 34.13 32.34 3e1f s GLU 871 CO 0.27 0.40 -0.14 0.08 0.02 0.00 0.00 175.26 175.89 3e1f s VAL 872 N -0.31 1.35 0.03 2.63 1.01 0.25 -1.92 120.40 123.44 3e1f s VAL 872 Ca 0.03 -0.58 -0.35 0.00 0.00 0.00 0.00 61.98 61.07 3e1f s VAL 872 Cb -0.10 -1.23 -0.14 0.00 0.00 0.00 0.00 36.38 34.90 3e1f s VAL 872 CO 0.01 0.41 1.63 0.00 0.00 0.00 0.00 175.10 177.14 3e1f n ALA 873 N 3.98 0.55 0.74 5.51 0.00 -0.79 -4.66 120.51 125.84 3e1f n ALA 873 Ca -0.21 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3e1f n ALA 873 Cb 0.52 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3e1f n ALA 873 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3e1f n SER 874 N 4.32 1.23 -1.10 0.00 3.41 -1.26 -2.50 113.62 117.73 3e1f n SER 874 Ca 0.20 -1.47 -0.01 0.00 -0.26 0.00 0.00 58.87 57.33 3e1f n SER 874 Cb 0.25 -0.37 -0.02 0.00 -0.26 0.00 0.00 64.21 63.82 3e1f n SER 874 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3e1f n ASP 875 N 0.30 0.07 -3.99 4.04 5.75 -1.26 -5.07 116.55 116.40 3e1f n ASP 875 Ca 0.00 -1.90 -0.24 0.00 -0.01 0.00 0.00 54.79 52.65 3e1f n ASP 875 Cb 0.25 -0.05 -0.17 0.00 -1.03 0.00 0.00 41.12 40.12 3e1f n ASP 875 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 3e1f s THR 876 N 0.00 0.99 0.08 2.12 -1.32 -1.04 -5.10 115.64 111.37 3e1f s THR 876 Ca 0.14 -0.39 -0.30 0.00 -1.21 0.00 0.00 61.69 59.94 3e1f s THR 876 Cb 0.16 -0.92 -0.16 0.00 -1.51 0.00 0.00 72.50 70.07 3e1f s THR 876 CO -0.07 0.32 0.70 -0.81 -2.21 0.00 0.00 174.62 172.55 3e1f n PRO 877 N 3.91 0.00 -1.66 7.08 -0.04 -1.26 -4.72 135.00 138.32 3e1f n PRO 877 Ca -0.23 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 62.76 3e1f n PRO 877 Cb 0.51 -1.09 -0.04 0.00 -0.04 0.00 0.00 33.50 32.84 3e1f n PRO 877 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3e1f n HIS 878 N 0.69 2.19 -1.70 0.54 8.25 -1.26 -4.91 115.22 119.02 3e1f n HIS 878 Ca 0.16 0.31 -0.38 0.00 -0.26 0.00 0.00 57.72 57.55 3e1f n HIS 878 Cb 0.14 -2.52 0.05 0.00 1.12 0.00 0.00 29.99 28.78 3e1f n HIS 878 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3e1f n PRO 879 N 3.34 1.26 0.25 -0.41 -0.04 -1.26 -4.87 135.00 133.27 3e1f n PRO 879 Ca 0.17 0.48 0.13 0.00 -0.04 0.00 0.00 63.50 64.24 3e1f n PRO 879 Cb 0.28 -2.44 0.61 0.00 -0.04 0.00 0.00 33.50 31.90 3e1f n PRO 879 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3e1f h ALA 880 N 0.85 1.09 -2.15 0.55 0.00 -1.87 -3.40 119.26 114.33 3e1f h ALA 880 Ca -0.50 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.47 3e1f h ALA 880 Cb 1.33 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 3e1f h ALA 880 CO 0.54 0.18 0.56 -0.98 0.00 0.00 0.00 179.25 179.55 3e1f s ARG 881 N -3.82 0.95 -0.32 0.00 1.70 -1.23 -0.97 118.95 115.26 3e1f s ARG 881 Ca -0.01 -0.49 -0.01 0.00 -0.47 0.00 0.00 55.73 54.75 3e1f s ARG 881 Cb 0.11 0.35 0.13 0.00 -0.57 0.00 0.00 34.95 34.96 3e1f s ARG 881 CO 0.60 -0.43 0.22 0.42 -1.08 0.00 0.00 175.30 175.02 3e1f s ILE 882 N -3.08 -0.12 0.00 4.99 1.01 0.35 -4.21 121.20 120.15 3e1f s ILE 882 Ca 0.11 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.76 3e1f s ILE 882 Cb -0.00 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.49 3e1f s ILE 882 CO -0.01 -0.73 0.00 0.61 0.00 0.00 0.00 174.94 174.81 3e1f n GLY 883 N 4.79 3.36 3.35 6.18 0.00 -1.05 -0.75 105.19 121.07 3e1f n GLY 883 Ca 0.02 -0.62 -0.18 0.00 0.00 0.00 0.00 46.02 45.24 3e1f n GLY 883 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e1f s LEU 884 N 0.00 2.24 0.07 0.99 1.43 0.95 -1.45 118.68 122.90 3e1f s LEU 884 Ca 0.00 -1.22 -0.26 0.00 -1.03 0.00 0.00 54.13 51.62 3e1f s LEU 884 Cb 0.00 -0.33 0.08 0.00 0.03 0.00 0.00 46.19 45.97 3e1f s LEU 884 CO 0.00 -0.49 0.69 0.54 0.23 0.00 0.00 176.35 177.33 3e1f s ASN 885 N -3.33 -0.54 -0.08 2.29 4.22 0.52 -0.99 114.94 117.03 3e1f s ASN 885 Ca 0.29 0.16 -0.30 0.00 -2.14 0.00 0.00 52.86 50.86 3e1f s ASN 885 Cb 0.05 0.53 0.12 0.00 1.28 0.00 0.00 41.25 43.23 3e1f s ASN 885 CO 0.09 -0.80 0.98 0.00 -2.04 0.00 0.00 177.10 175.33 3e1f s GLN 887 N -2.53 3.01 0.72 0.00 0.74 -1.23 -1.58 119.66 118.79 3e1f s GLN 887 Ca 0.04 -1.16 -0.13 0.00 0.05 0.00 0.00 55.36 54.16 3e1f s GLN 887 Cb -0.01 -4.08 0.03 0.00 1.10 0.00 0.00 33.01 30.05 3e1f s GLN 887 CO -0.06 -0.98 1.11 -0.51 -0.55 0.00 0.00 175.29 174.30 3e1f s LEU 888 N 1.83 3.22 0.01 3.68 1.43 -0.05 0.19 118.68 128.99 3e1f s LEU 888 Ca 0.06 1.96 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 3e1f s LEU 888 Cb -0.22 -4.54 -0.26 0.00 0.03 0.00 0.00 46.19 41.20 3e1f s LEU 888 CO 0.09 -1.89 0.86 0.00 0.23 0.00 0.00 176.35 175.64 3e1f h ALA 889 N -0.52 0.37 -2.34 4.21 0.00 -1.55 -2.01 119.26 117.43 3e1f h ALA 889 Ca -0.45 -1.15 -0.45 0.00 0.00 0.00 0.00 54.91 52.86 3e1f h ALA 889 Cb 1.24 0.27 0.16 0.00 0.00 0.00 0.00 17.79 19.47 3e1f h ALA 889 CO 0.52 1.23 0.20 -0.65 0.00 0.00 0.00 179.25 180.56 3e1f s GLN 890 N -2.62 0.29 -0.44 0.00 1.11 -1.26 -4.06 119.66 112.67 3e1f s GLN 890 Ca -0.08 0.38 0.05 0.00 0.01 0.00 0.00 55.36 55.72 3e1f s GLN 890 Cb 0.07 -1.73 0.17 0.00 -1.01 0.00 0.00 33.01 30.52 3e1f s GLN 890 CO 0.84 -2.79 0.52 0.08 0.01 0.00 0.00 175.29 173.94 3e1f s VAL 891 N -3.04 -0.44 0.66 1.09 1.01 -1.26 -2.46 120.40 115.96 3e1f s VAL 891 Ca 0.66 -1.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 3e1f s VAL 891 Cb -0.17 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.68 3e1f s VAL 891 CO 0.57 -0.51 1.03 0.00 0.00 0.00 0.00 175.10 176.19 3e1f s ALA 892 N 0.85 3.03 -0.06 5.51 0.00 -1.26 -5.01 121.76 124.82 3e1f s ALA 892 Ca 0.26 -0.39 0.13 0.00 0.00 0.00 0.00 51.96 51.97 3e1f s ALA 892 Cb -0.03 -2.92 -0.12 0.00 0.00 0.00 0.00 23.12 20.05 3e1f s ALA 892 CO -0.09 -0.97 1.08 0.93 0.00 0.00 0.00 175.76 176.72 3e1f h GLU 893 N -0.46 0.00 -5.54 0.00 5.08 -2.00 -3.42 114.58 108.24 3e1f h GLU 893 Ca -0.45 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.40 3e1f h GLU 893 Cb 1.24 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.35 3e1f h GLU 893 CO 0.63 0.56 -0.67 1.03 -1.00 0.00 0.00 179.01 179.56 3e1f s ARG 894 N -2.82 1.61 -0.04 2.33 1.81 -1.26 -1.39 118.95 119.18 3e1f s ARG 894 Ca -0.00 -1.83 -0.00 0.00 -1.72 0.00 0.00 55.73 52.18 3e1f s ARG 894 Cb 0.09 -1.21 0.03 0.00 -0.45 0.00 0.00 34.95 33.40 3e1f s ARG 894 CO 0.80 0.02 0.01 0.08 -0.68 0.00 0.00 175.30 175.53 3e1f s VAL 895 N -2.98 0.17 -0.06 3.52 1.01 0.13 -4.61 120.40 117.59 3e1f s VAL 895 Ca 0.31 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.47 3e1f s VAL 895 Cb 0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 36.12 3e1f s VAL 895 CO 0.13 0.17 -0.19 0.21 0.00 0.00 0.00 175.10 175.42 3e1f s ASN 896 N 1.34 2.44 -0.01 3.32 3.84 -0.72 -1.13 114.94 124.02 3e1f s ASN 896 Ca -0.05 -0.41 -0.20 0.00 0.21 0.00 0.00 52.86 52.40 3e1f s ASN 896 Cb -0.13 -0.77 0.04 0.00 -0.55 0.00 0.00 41.25 39.84 3e1f s ASN 896 CO -0.02 0.16 0.44 -1.66 -2.79 0.00 0.00 177.10 173.23 3e1f s TRP 897 N 0.09 -0.34 -0.42 0.43 -2.14 -0.15 0.12 118.94 116.53 3e1f s TRP 897 Ca -0.07 0.51 -0.10 0.00 2.66 0.00 0.00 56.10 59.11 3e1f s TRP 897 Cb -0.13 0.22 0.07 0.00 -3.10 0.00 0.00 33.47 30.53 3e1f s TRP 897 CO 0.03 -0.49 0.27 -1.17 -2.66 0.00 0.00 176.95 172.93 3e1f s LEU 898 N -1.43 5.19 0.00 -4.66 2.96 0.15 -0.30 118.68 120.58 3e1f s LEU 898 Ca -0.11 -1.44 0.00 0.00 -0.22 0.00 0.00 54.13 52.36 3e1f s LEU 898 Cb -0.03 -2.02 0.00 0.00 0.50 0.00 0.00 46.19 44.65 3e1f s LEU 898 CO 0.05 -0.54 0.00 0.61 -1.32 0.00 0.00 176.35 175.14 3e1f n GLY 899 N 4.96 -0.60 3.68 7.98 0.00 -0.40 -0.37 105.19 120.44 3e1f n GLY 899 Ca -0.10 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 3e1f n GLY 899 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e1f s LEU 900 N 0.00 4.24 0.00 0.99 1.43 -0.82 -1.98 118.68 122.55 3e1f s LEU 900 Ca 0.00 1.68 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 3e1f s LEU 900 Cb 0.00 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.67 3e1f s LEU 900 CO 0.00 -0.57 0.00 0.61 0.23 0.00 0.00 176.35 176.62 3e1f n GLY 901 N 3.31 1.79 0.12 -3.19 0.00 -0.34 -4.36 105.19 102.52 3e1f n GLY 901 Ca 0.11 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.42 3e1f n GLY 901 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3e1f h PRO 902 N 0.00 0.00 -7.44 1.61 0.13 -1.93 -1.19 132.00 123.18 3e1f h PRO 902 Ca 0.00 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.65 3e1f h PRO 902 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 3e1f h PRO 902 CO 0.00 0.68 0.35 -0.65 -0.23 0.00 0.00 178.00 178.15 3e1f s GLN 903 N -3.04 2.14 0.22 0.86 -0.21 -1.26 -4.97 119.66 113.40 3e1f s GLN 903 Ca 0.02 0.54 -0.32 0.00 0.02 0.00 0.00 55.36 55.61 3e1f s GLN 903 Cb 0.10 -1.93 -0.14 0.00 1.00 0.00 0.00 33.01 32.04 3e1f s GLN 903 CO 0.76 -1.56 1.41 -1.91 -2.12 0.00 0.00 175.29 171.88 3e1f n GLU 904 N -3.37 1.98 -3.77 2.91 2.13 -1.26 -4.91 120.64 114.35 3e1f n GLU 904 Ca 0.07 0.71 -0.13 0.00 0.66 0.00 0.00 57.16 58.47 3e1f n GLU 904 Cb 0.57 -2.37 -0.11 0.00 0.27 0.00 0.00 31.44 29.80 3e1f n GLU 904 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3e1f s ASN 905 N 0.36 -0.32 0.27 4.31 2.20 -0.09 -4.87 114.94 116.81 3e1f s ASN 905 Ca 0.70 0.61 0.10 0.00 -0.94 0.00 0.00 52.86 53.33 3e1f s ASN 905 Cb -0.67 0.61 -0.05 0.00 -2.00 0.00 0.00 41.25 39.14 3e1f s ASN 905 CO 0.48 -0.11 -0.16 -0.31 -2.94 0.00 0.00 177.10 174.06 3e1f s TYR 906 N 0.21 2.15 0.19 1.54 1.51 -0.96 -3.76 117.35 118.23 3e1f s TYR 906 Ca -0.00 -0.44 -0.16 0.00 -1.01 0.00 0.00 57.07 55.45 3e1f s TYR 906 Cb -0.02 -1.01 0.17 0.00 -0.11 0.00 0.00 41.96 40.98 3e1f s TYR 906 CO -0.00 0.58 1.31 -2.30 -1.11 0.00 0.00 175.55 174.03 3e1f n PRO 907 N -0.59 -0.22 -0.27 -1.71 -0.02 -1.26 0.10 135.00 131.03 3e1f n PRO 907 Ca -0.06 1.30 0.04 0.00 -2.02 0.00 0.00 63.50 62.76 3e1f n PRO 907 Cb 0.61 -1.92 0.15 0.00 -0.02 0.00 0.00 33.50 32.32 3e1f n PRO 907 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3e1f n ASP 908 N -5.22 2.33 -2.79 2.55 5.75 -1.26 -4.27 116.55 113.65 3e1f n ASP 908 Ca 0.08 -2.20 -0.09 0.00 -0.01 0.00 0.00 54.79 52.57 3e1f n ASP 908 Cb 0.32 -0.39 0.04 0.00 -1.03 0.00 0.00 41.12 40.06 3e1f n ASP 908 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3e1f n ARG 909 N 0.34 0.77 0.00 0.11 0.63 0.11 0.30 116.66 118.92 3e1f n ARG 909 Ca 0.11 -1.87 0.00 0.00 -0.92 0.00 0.00 57.85 55.18 3e1f n ARG 909 Cb 0.46 -1.45 0.00 0.00 0.45 0.00 0.00 32.46 31.92 3e1f n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 3e1f n LEU 910 N 1.65 0.00 -0.25 6.15 -0.00 -1.07 -2.26 117.00 121.23 3e1f n LEU 910 Ca 0.10 -0.03 -0.02 0.00 -0.00 0.00 0.00 56.01 56.06 3e1f n LEU 910 Cb 0.62 0.00 0.09 0.00 -0.00 0.00 0.00 43.42 44.13 3e1f n LEU 910 CO 0.05 0.04 1.12 0.71 -0.00 0.00 0.00 177.39 179.31 3e1f h THR 911 N 2.47 1.03 0.00 1.47 1.35 -1.90 -2.28 112.91 115.05 3e1f h THR 911 Ca 0.00 -0.27 -0.05 0.00 -0.55 0.00 0.00 66.41 65.54 3e1f h THR 911 Cb 0.87 0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.46 3e1f h THR 911 CO 0.00 0.14 -0.24 0.00 -0.25 0.00 0.00 175.52 175.18 3e1f h ALA 912 N 1.33 1.52 -2.72 6.62 0.00 -1.90 -3.44 119.26 120.67 3e1f h ALA 912 Ca 0.30 -0.22 -0.51 0.00 0.00 0.00 0.00 54.91 54.48 3e1f h ALA 912 Cb 0.11 -0.04 0.09 0.00 0.00 0.00 0.00 17.79 17.96 3e1f h ALA 912 CO -0.15 0.30 0.46 0.00 0.00 0.00 0.00 179.25 179.86 3e1f s ALA 913 N -4.41 2.69 0.16 0.00 0.00 -0.86 -5.01 121.76 114.32 3e1f s ALA 913 Ca -0.03 0.93 0.10 0.00 0.00 0.00 0.00 51.96 52.96 3e1f s ALA 913 Cb 0.15 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 3e1f s ALA 913 CO 0.69 -0.93 -0.21 0.00 0.00 0.00 0.00 175.76 175.31 3e1f s PHE 915 N -1.38 3.36 0.00 0.00 5.36 -1.26 -1.20 117.98 122.87 3e1f s PHE 915 Ca 0.19 0.92 -0.07 0.00 -0.96 0.00 0.00 56.93 57.01 3e1f s PHE 915 Cb -0.09 -2.81 0.02 0.00 -0.34 0.00 0.00 43.02 39.80 3e1f s PHE 915 CO 0.10 -0.20 0.32 -3.47 -1.46 0.00 0.00 175.22 170.50 3e1f n ASP 916 N 5.17 -0.32 -4.60 6.13 -0.08 -0.84 -4.86 116.55 117.14 3e1f n ASP 916 Ca -0.01 -1.08 -0.40 0.00 -1.51 0.00 0.00 54.79 51.79 3e1f n ASP 916 Cb 0.50 0.50 -0.08 0.00 2.34 0.00 0.00 41.12 44.38 3e1f n ASP 916 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 3e1f s ARG 917 N -2.00 3.99 -0.00 -0.67 6.06 -1.26 -1.28 118.95 123.78 3e1f s ARG 917 Ca 0.07 0.19 0.07 0.00 -2.50 0.00 0.00 55.73 53.57 3e1f s ARG 917 Cb -0.00 -3.68 -0.03 0.00 0.06 0.00 0.00 34.95 31.30 3e1f s ARG 917 CO 0.00 -0.39 -0.22 -1.58 -2.50 0.00 0.00 175.30 170.61 3e1f s TRP 918 N 2.28 2.44 -0.07 5.12 0.52 0.59 -4.97 118.94 124.85 3e1f s TRP 918 Ca 0.20 -0.34 -0.01 0.00 0.02 0.00 0.00 56.10 55.96 3e1f s TRP 918 Cb -0.16 -1.50 0.03 0.00 -1.15 0.00 0.00 33.47 30.70 3e1f s TRP 918 CO 0.10 0.09 -0.00 0.34 0.02 0.00 0.00 176.95 177.50 3e1f s ASP 919 N -0.92 1.62 0.09 2.95 -1.08 -1.26 -0.97 116.67 117.11 3e1f s ASP 919 Ca 0.11 -0.10 -0.04 0.00 -0.52 0.00 0.00 52.55 52.00 3e1f s ASP 919 Cb -0.10 -0.46 -0.02 0.00 -1.46 0.00 0.00 42.92 40.87 3e1f s ASP 919 CO 0.01 -0.19 0.10 -0.76 0.52 0.00 0.00 175.17 174.85 3e1f s LEU 920 N 1.96 1.80 0.32 -1.34 1.43 -0.28 -4.96 118.68 117.61 3e1f s LEU 920 Ca 0.05 -0.92 -0.28 0.00 -1.03 0.00 0.00 54.13 51.95 3e1f s LEU 920 Cb -0.12 0.61 -0.09 0.00 0.03 0.00 0.00 46.19 46.62 3e1f s LEU 920 CO -0.05 -0.71 1.12 -2.16 0.23 0.00 0.00 176.35 174.78 3e1f s PRO 921 N -3.94 4.47 0.35 1.29 0.04 -1.26 0.17 135.00 136.12 3e1f s PRO 921 Ca 0.11 1.81 0.24 0.00 0.04 0.00 0.00 61.00 63.20 3e1f s PRO 921 Cb 0.06 -3.02 1.22 0.00 0.04 0.00 0.00 34.50 32.81 3e1f s PRO 921 CO -0.06 0.05 1.34 -0.11 0.04 0.00 0.00 177.00 178.26 3e1f n LEU 922 N 0.83 0.23 -0.02 -3.56 7.94 -0.49 -0.09 117.00 121.83 3e1f n LEU 922 Ca 0.01 1.28 0.00 0.00 -1.11 0.00 0.00 56.01 56.19 3e1f n LEU 922 Cb 0.45 -0.63 0.30 0.00 0.53 0.00 0.00 43.42 44.08 3e1f n LEU 922 CO 0.53 -1.41 0.99 0.77 -1.11 0.00 0.00 177.39 177.16 3e1f h SER 923 N 0.00 0.54 0.00 1.96 4.64 -1.90 -2.35 113.55 116.44 3e1f h SER 923 Ca 0.74 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 3e1f h SER 923 Cb 2.22 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 64.17 3e1f h SER 923 CO -0.50 0.55 0.00 0.47 -0.87 0.00 0.00 176.83 176.48 3e1f n ASP 924 N -4.32 0.00 -1.37 4.97 8.00 0.87 -1.85 116.55 122.85 3e1f n ASP 924 Ca 0.02 -0.68 0.09 0.00 0.71 0.00 0.00 54.79 54.93 3e1f n ASP 924 Cb 0.20 -0.00 0.31 0.00 -0.02 0.00 0.00 41.12 41.61 3e1f n ASP 924 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3e1f n MET 925 N -1.00 3.18 -4.15 -1.24 2.81 -0.88 -4.80 117.12 111.04 3e1f n MET 925 Ca 0.16 -2.45 -0.24 0.00 -1.81 0.00 0.00 57.70 53.37 3e1f n MET 925 Cb 0.08 -1.75 -0.17 0.00 -0.71 0.00 0.00 33.22 30.67 3e1f n MET 925 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3e1f s TYR 926 N -1.66 1.20 -0.37 2.03 5.04 -0.77 -4.37 117.35 118.44 3e1f s TYR 926 Ca 0.44 -0.48 -0.14 0.00 -2.44 0.00 0.00 57.07 54.45 3e1f s TYR 926 Cb 0.27 -1.00 -0.00 0.00 0.35 0.00 0.00 41.96 41.59 3e1f s TYR 926 CO 0.23 -0.34 0.27 0.99 -1.34 0.00 0.00 175.55 175.36 3e1f s THR 927 N 1.25 5.27 0.00 4.34 2.01 -1.26 -4.98 115.64 122.26 3e1f s THR 927 Ca -0.05 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 3e1f s THR 927 Cb -0.14 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.50 3e1f s THR 927 CO -0.02 -0.15 1.08 -0.81 -0.69 0.00 0.00 174.62 174.02 3e1f n PRO 928 N 5.15 0.45 -1.70 4.92 -0.04 -1.26 -4.91 135.00 137.61 3e1f n PRO 928 Ca -0.12 -0.18 -0.43 0.00 -0.04 0.00 0.00 63.50 62.73 3e1f n PRO 928 Cb 0.48 -1.54 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 3e1f n PRO 928 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3e1f n TYR 929 N 2.52 2.62 -0.30 0.54 4.01 -1.26 -4.83 117.16 120.46 3e1f n TYR 929 Ca 0.08 0.07 0.14 0.00 -0.16 0.00 0.00 57.90 58.02 3e1f n TYR 929 Cb 0.21 -2.65 0.31 0.00 -0.31 0.00 0.00 39.34 36.90 3e1f n TYR 929 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3e1f h VAL 930 N 3.88 0.39 -3.54 -0.72 2.07 -1.96 -3.26 116.25 113.11 3e1f h VAL 930 Ca -0.44 -0.10 -0.70 0.00 0.82 0.00 0.00 66.70 66.28 3e1f h VAL 930 Cb 1.22 0.06 -0.19 0.00 -1.52 0.00 0.00 31.29 30.85 3e1f h VAL 930 CO 0.94 0.06 -0.30 0.12 0.02 0.00 0.00 177.57 178.40 3e1f s PHE 931 N -5.89 3.20 0.40 1.57 5.36 -1.26 -0.90 117.98 120.46 3e1f s PHE 931 Ca -0.12 -0.42 -0.26 0.00 -0.96 0.00 0.00 56.93 55.17 3e1f s PHE 931 Cb 0.26 -2.75 -0.10 0.00 -0.34 0.00 0.00 43.02 40.08 3e1f s PHE 931 CO 0.78 -0.63 1.30 -2.30 -1.46 0.00 0.00 175.22 172.91 3e1f n PRO 932 N 5.41 2.04 -3.83 10.12 -0.02 -1.23 -4.96 135.00 142.54 3e1f n PRO 932 Ca -0.09 0.72 -0.02 0.00 -2.02 0.00 0.00 63.50 62.10 3e1f n PRO 932 Cb 0.47 -2.41 0.01 0.00 -0.02 0.00 0.00 33.50 31.56 3e1f n PRO 932 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3e1f s SER 933 N -0.45 -0.05 0.17 2.55 1.04 -1.26 -4.74 113.70 110.96 3e1f s SER 933 Ca 0.59 -0.46 -0.33 0.00 0.48 0.00 0.00 55.95 56.23 3e1f s SER 933 Cb -0.51 0.39 -0.15 0.00 0.10 0.00 0.00 66.02 65.85 3e1f s SER 933 CO 0.59 -0.76 1.27 1.21 0.98 0.00 0.00 173.24 176.53 3e1f n GLU 934 N -0.64 1.41 -3.82 4.02 4.07 0.09 -4.93 120.64 120.84 3e1f n GLU 934 Ca -0.04 0.51 -0.06 0.00 -0.06 0.00 0.00 57.16 57.51 3e1f n GLU 934 Cb 0.60 -2.08 -0.02 0.00 -0.06 0.00 0.00 31.44 29.89 3e1f n GLU 934 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3e1f s ASN 935 N 0.19 -0.23 0.00 4.31 2.20 -1.26 -4.93 114.94 115.23 3e1f s ASN 935 Ca 0.74 -0.53 0.00 0.00 -0.94 0.00 0.00 52.86 52.13 3e1f s ASN 935 Cb -0.81 0.64 0.00 0.00 -2.00 0.00 0.00 41.25 39.08 3e1f s ASN 935 CO 0.50 -1.18 0.00 0.61 -2.94 0.00 0.00 177.10 174.09 3e1f n GLY 936 N -0.46 0.52 3.67 0.45 0.00 -1.26 -4.81 105.19 103.29 3e1f n GLY 936 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 3e1f n GLY 936 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3e1f n LEU 937 N 0.00 4.83 -3.79 0.99 7.94 -1.26 -4.54 117.00 121.17 3e1f n LEU 937 Ca 0.00 0.83 -0.21 0.00 -1.11 0.00 0.00 56.01 55.52 3e1f n LEU 937 Cb 0.08 -1.48 -0.17 0.00 0.53 0.00 0.00 43.42 42.38 3e1f n LEU 937 CO 0.00 -1.38 -0.38 -0.13 -1.11 0.00 0.00 177.39 174.39 3e1f s ARG 938 N -3.01 0.55 0.38 1.96 3.00 0.86 -0.91 118.95 121.78 3e1f s ARG 938 Ca 0.78 0.08 0.05 0.00 0.00 0.00 0.00 55.73 56.64 3e1f s ARG 938 Cb -0.40 -0.84 -0.00 0.00 0.00 0.00 0.00 34.95 33.70 3e1f s ARG 938 CO 0.44 -0.24 0.54 0.00 0.00 0.00 0.00 175.30 176.05 3e1f n GLY 940 N -1.80 -0.39 3.68 0.00 0.00 -1.19 -1.94 105.19 103.56 3e1f n GLY 940 Ca 0.01 0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3e1f n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3e1f s THR 941 N -3.44 5.27 -0.06 2.61 2.01 0.26 -3.35 115.64 118.94 3e1f s THR 941 Ca 0.17 0.14 0.21 0.00 0.31 0.00 0.00 61.69 62.52 3e1f s THR 941 Cb -0.08 -3.42 -0.32 0.00 0.01 0.00 0.00 72.50 68.69 3e1f s THR 941 CO 0.76 0.40 0.40 0.54 -0.69 0.00 0.00 174.62 176.04 3e1f n ARG 942 N 3.88 0.66 -3.69 4.92 5.12 0.50 -1.51 116.66 126.55 3e1f n ARG 942 Ca -0.16 -0.17 -0.13 0.00 -1.93 0.00 0.00 57.85 55.47 3e1f n ARG 942 Cb 0.52 -1.51 -0.13 0.00 -1.16 0.00 0.00 32.46 30.18 3e1f n ARG 942 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3e1f s GLU 943 N -3.32 0.19 -0.10 5.56 2.12 -1.16 -1.71 118.70 120.28 3e1f s GLU 943 Ca -0.08 0.68 0.03 0.00 0.36 0.00 0.00 54.97 55.96 3e1f s GLU 943 Cb 0.12 -0.05 0.01 0.00 0.26 0.00 0.00 34.13 34.47 3e1f s GLU 943 CO 0.88 -0.23 -0.21 -1.17 -0.54 0.00 0.00 175.26 173.99 3e1f s LEU 944 N 1.89 1.97 -0.17 2.70 2.96 0.27 0.31 118.68 128.62 3e1f s LEU 944 Ca -0.04 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 3e1f s LEU 944 Cb -0.11 -1.28 0.03 0.00 0.50 0.00 0.00 46.19 45.33 3e1f s LEU 944 CO -0.09 0.11 -0.15 0.20 -1.32 0.00 0.00 176.35 175.10 3e1f s ASN 945 N 0.53 2.98 -0.08 3.68 0.01 0.33 -0.42 114.94 121.96 3e1f s ASN 945 Ca -0.15 -0.63 -0.03 0.00 -0.71 0.00 0.00 52.86 51.34 3e1f s ASN 945 Cb -0.17 -1.27 0.04 0.00 0.41 0.00 0.00 41.25 40.26 3e1f s ASN 945 CO 0.05 -0.06 0.11 -0.47 -1.51 0.00 0.00 177.10 175.22 3e1f s TYR 946 N 1.41 -0.01 0.00 2.20 5.04 -1.00 -1.76 117.35 123.23 3e1f s TYR 946 Ca 0.03 0.27 0.00 0.00 -2.44 0.00 0.00 57.07 54.93 3e1f s TYR 946 Cb -0.14 -0.44 0.00 0.00 0.35 0.00 0.00 41.96 41.73 3e1f s TYR 946 CO -0.11 -0.29 0.00 0.41 -1.34 0.00 0.00 175.55 174.22 3e1f n GLY 947 N 5.31 3.26 0.21 8.97 0.00 -1.26 -1.45 105.19 120.22 3e1f n GLY 947 Ca -0.04 -0.24 0.14 0.00 0.00 0.00 0.00 46.02 45.88 3e1f n GLY 947 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3e1f h PRO 948 N 0.00 0.00 -7.26 1.61 0.13 -1.96 -3.47 132.00 121.05 3e1f h PRO 948 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 3e1f h PRO 948 Cb 0.00 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.19 3e1f h PRO 948 CO 0.00 0.00 0.38 -1.01 -0.23 0.00 0.00 178.00 177.14 3e1f s HIS 949 N -3.39 3.22 -0.21 1.56 3.76 -0.53 -0.57 115.29 119.12 3e1f s HIS 949 Ca 0.05 1.44 -0.10 0.00 -0.15 0.00 0.00 55.06 56.30 3e1f s HIS 949 Cb 0.08 -2.88 0.07 0.00 1.11 0.00 0.00 32.58 30.97 3e1f s HIS 949 CO 0.55 -0.93 0.49 -1.14 -0.85 0.00 0.00 174.74 172.87 3e1f s GLN 950 N -4.51 0.46 -0.06 1.40 0.74 -0.69 -2.38 119.66 114.62 3e1f s GLN 950 Ca 0.60 0.98 0.05 0.00 0.05 0.00 0.00 55.36 57.03 3e1f s GLN 950 Cb -0.13 0.13 -0.01 0.00 1.10 0.00 0.00 33.01 34.09 3e1f s GLN 950 CO 0.43 -0.18 -0.22 -1.58 -0.55 0.00 0.00 175.29 173.20 3e1f s TRP 951 N 1.77 2.51 0.05 1.67 0.51 0.44 -2.05 118.94 123.85 3e1f s TRP 951 Ca -0.08 -0.61 0.06 0.00 -2.12 0.00 0.00 56.10 53.34 3e1f s TRP 951 Cb -0.08 -1.63 -0.02 0.00 -0.81 0.00 0.00 33.47 30.93 3e1f s TRP 951 CO -0.15 -0.15 -0.16 1.03 -0.51 0.00 0.00 176.95 177.02 3e1f s ARG 952 N -0.22 0.99 0.00 4.98 0.52 -0.49 -0.56 118.95 124.17 3e1f s ARG 952 Ca -0.01 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.34 3e1f s ARG 952 Cb -0.13 -1.04 0.00 0.00 0.52 0.00 0.00 34.95 34.30 3e1f s ARG 952 CO 0.03 0.25 0.00 0.41 0.02 0.00 0.00 175.30 176.01 3e1f n GLY 953 N 1.71 -0.45 2.48 -3.53 0.00 -0.70 -1.17 105.19 103.53 3e1f n GLY 953 Ca -0.19 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 3e1f n GLY 953 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3e1f n ASP 954 N 0.00 -1.43 -4.37 1.61 2.03 -1.24 -4.04 116.55 109.11 3e1f n ASP 954 Ca 0.00 -3.03 -0.29 0.00 0.52 0.00 0.00 54.79 51.99 3e1f n ASP 954 Cb 0.00 0.67 -0.06 0.00 -0.72 0.00 0.00 41.12 41.00 3e1f n ASP 954 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 3e1f n PHE 955 N 1.50 0.93 -4.41 -0.67 1.16 -0.57 -4.85 117.46 110.55 3e1f n PHE 955 Ca 0.15 -2.38 -0.25 0.00 -1.87 0.00 0.00 57.45 53.10 3e1f n PHE 955 Cb 0.59 -0.26 -0.10 0.00 -1.61 0.00 0.00 39.48 38.10 3e1f n PHE 955 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3e1f s GLN 956 N -3.68 1.78 0.08 3.97 -1.52 0.13 -0.58 119.66 119.85 3e1f s GLN 956 Ca 0.04 -1.60 -0.26 0.00 -1.95 0.00 0.00 55.36 51.59 3e1f s GLN 956 Cb 0.00 -1.89 0.08 0.00 -0.22 0.00 0.00 33.01 30.98 3e1f s GLN 956 CO 0.03 0.36 0.75 -0.59 -0.25 0.00 0.00 175.29 175.59 3e1f s PHE 957 N -2.19 -0.42 -0.08 0.91 -0.71 -0.53 -0.85 117.98 114.10 3e1f s PHE 957 Ca 0.27 0.24 -0.06 0.00 -1.04 0.00 0.00 56.93 56.35 3e1f s PHE 957 Cb -0.06 0.56 0.03 0.00 -1.21 0.00 0.00 43.02 42.33 3e1f s PHE 957 CO 0.15 -0.71 0.21 0.54 -1.34 0.00 0.00 175.22 174.06 3e1f s ASN 958 N -2.63 -0.21 -0.07 1.98 2.20 -1.00 -0.10 114.94 115.11 3e1f s ASN 958 Ca 0.04 0.43 -0.01 0.00 -0.94 0.00 0.00 52.86 52.37 3e1f s ASN 958 Cb -0.01 0.38 0.03 0.00 -2.00 0.00 0.00 41.25 39.64 3e1f s ASN 958 CO -0.10 -0.11 0.01 -0.51 -2.94 0.00 0.00 177.10 173.45 3e1f s ILE 959 N 0.62 0.32 0.14 0.54 2.07 -1.26 -2.13 121.20 121.50 3e1f s ILE 959 Ca -0.04 0.15 -0.04 0.00 -1.41 0.00 0.00 60.65 59.31 3e1f s ILE 959 Cb -0.06 -0.48 0.02 0.00 0.13 0.00 0.00 42.46 42.07 3e1f s ILE 959 CO -0.03 0.25 0.26 -1.54 -1.91 0.00 0.00 174.94 171.96 3e1f n SER 960 N 5.11 -0.73 -1.15 4.50 3.41 -0.99 -4.63 113.62 119.13 3e1f n SER 960 Ca -0.07 -1.64 0.08 0.00 -0.26 0.00 0.00 58.87 56.98 3e1f n SER 960 Cb 0.50 1.26 0.26 0.00 -0.26 0.00 0.00 64.21 65.97 3e1f n SER 960 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3e1f n ARG 961 N -0.21 2.66 -5.02 4.33 5.12 -1.26 -0.00 116.66 122.28 3e1f n ARG 961 Ca -0.02 -2.11 -0.29 0.00 -1.93 0.00 0.00 57.85 53.50 3e1f n ARG 961 Cb 0.22 -1.57 -0.17 0.00 -1.16 0.00 0.00 32.46 29.78 3e1f n ARG 961 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3e1f s TYR 962 N -1.47 2.15 0.47 -1.55 2.02 -1.26 -1.26 117.35 116.45 3e1f s TYR 962 Ca 0.39 -0.79 -0.19 0.00 -0.37 0.00 0.00 57.07 56.11 3e1f s TYR 962 Cb 0.22 -1.45 -0.09 0.00 -0.40 0.00 0.00 41.96 40.23 3e1f s TYR 962 CO 0.23 -0.31 0.98 -1.54 -1.57 0.00 0.00 175.55 173.33 3e1f s SER 963 N 0.28 6.72 0.34 2.29 1.04 -1.26 -4.82 113.70 118.29 3e1f s SER 963 Ca -0.13 1.68 0.07 0.00 0.48 0.00 0.00 55.95 58.05 3e1f s SER 963 Cb -0.16 -2.53 0.75 0.00 0.10 0.00 0.00 66.02 64.18 3e1f s SER 963 CO 0.06 -0.52 1.87 1.56 0.98 0.00 0.00 173.24 177.19 3e1f h GLN 964 N 1.47 0.74 0.34 4.02 1.08 -2.00 -0.93 115.11 119.84 3e1f h GLN 964 Ca -0.48 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 56.66 3e1f h GLN 964 Cb 1.19 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 3e1f h GLN 964 CO 0.61 0.49 -0.17 0.37 -0.95 0.00 0.00 178.83 179.19 3e1f h GLN 965 N 0.77 -0.45 -0.38 1.46 4.15 -1.99 -1.51 115.11 117.17 3e1f h GLN 965 Ca 0.44 0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.96 3e1f h GLN 965 Cb 0.62 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 28.35 3e1f h GLN 965 CO -0.21 -0.26 0.03 0.37 -1.93 0.00 0.00 178.83 176.84 3e1f h GLN 966 N -0.53 0.13 -0.92 1.69 4.15 -1.71 -1.47 115.11 116.46 3e1f h GLN 966 Ca -0.05 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.51 3e1f h GLN 966 Cb 0.39 -0.03 -0.09 0.00 0.21 0.00 0.00 27.48 27.96 3e1f h GLN 966 CO 0.08 0.09 0.53 -0.07 -1.93 0.00 0.00 178.83 177.52 3e1f h LEU 967 N 0.14 0.70 0.00 -2.39 3.38 -1.04 0.20 115.31 116.30 3e1f h LEU 967 Ca 0.18 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3e1f h LEU 967 Cb 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3e1f h LEU 967 CO -0.28 0.32 -0.17 1.15 0.09 0.00 0.00 178.44 179.56 3e1f n MET 968 N -4.77 0.03 -0.00 1.13 0.00 -0.58 -3.35 117.12 109.58 3e1f n MET 968 Ca 0.18 0.02 0.10 0.00 0.00 0.00 0.00 57.70 57.99 3e1f n MET 968 Cb 0.42 -1.52 -0.13 0.00 0.00 0.00 0.00 33.22 31.99 3e1f n MET 968 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 3e1f n GLU 969 N -1.57 0.56 -3.72 3.17 1.02 -0.24 -4.94 120.64 114.93 3e1f n GLU 969 Ca 0.06 -0.06 -0.37 0.00 -0.02 0.00 0.00 57.16 56.77 3e1f n GLU 969 Cb 0.35 -1.44 -0.06 0.00 -0.02 0.00 0.00 31.44 30.26 3e1f n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3e1f s THR 970 N -3.04 5.36 -0.12 2.62 2.01 0.54 -5.01 115.64 117.99 3e1f s THR 970 Ca 0.02 0.40 0.16 0.00 0.31 0.00 0.00 61.69 62.59 3e1f s THR 970 Cb 0.14 -3.52 -0.23 0.00 0.01 0.00 0.00 72.50 68.91 3e1f s THR 970 CO 0.82 0.55 0.46 -1.54 -0.69 0.00 0.00 174.62 174.22 3e1f n SER 971 N 2.40 0.47 -4.13 3.53 3.41 -1.26 -4.29 113.62 113.76 3e1f n SER 971 Ca -0.17 0.22 -0.22 0.00 -0.26 0.00 0.00 58.87 58.44 3e1f n SER 971 Cb 0.53 0.54 -0.15 0.00 -0.26 0.00 0.00 64.21 64.88 3e1f n SER 971 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3e1f s HIS 972 N -2.70 1.31 0.65 7.33 3.76 -1.26 -4.15 115.29 120.23 3e1f s HIS 972 Ca -0.07 -0.27 0.38 0.00 -0.15 0.00 0.00 55.06 54.95 3e1f s HIS 972 Cb 0.08 -0.82 2.10 0.00 1.11 0.00 0.00 32.58 35.04 3e1f s HIS 972 CO 0.83 -0.00 2.24 0.07 -0.85 0.00 0.00 174.74 177.03 3e1f h ARG 973 N 5.56 0.00 -0.00 1.40 0.11 -1.22 -1.51 114.38 118.72 3e1f h ARG 973 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 3e1f h ARG 973 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 3e1f h ARG 973 CO 0.48 0.00 -0.12 -2.39 0.10 0.00 0.00 179.97 178.04 3e1f n HIS 974 N -3.27 0.00 -0.01 4.08 1.44 -1.26 -3.26 115.22 112.94 3e1f n HIS 974 Ca -0.02 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.79 3e1f n HIS 974 Cb 0.16 -0.22 0.24 0.00 0.12 0.00 0.00 29.99 30.29 3e1f n HIS 974 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3e1f n LEU 975 N -1.06 3.51 -4.73 2.39 4.77 -0.57 -4.93 117.00 116.39 3e1f n LEU 975 Ca 0.13 -1.73 -0.40 0.00 -0.03 0.00 0.00 56.01 53.97 3e1f n LEU 975 Cb 0.28 -0.33 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 3e1f n LEU 975 CO 0.25 0.82 0.49 -0.76 -1.33 0.00 0.00 177.39 176.85 3e1f s LEU 976 N -1.21 4.38 -0.08 2.23 1.43 -1.20 -5.03 118.68 119.21 3e1f s LEU 976 Ca 0.39 1.40 0.03 0.00 -1.03 0.00 0.00 54.13 54.92 3e1f s LEU 976 Cb 0.22 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 3e1f s LEU 976 CO 0.29 -0.10 -0.18 -1.38 0.23 0.00 0.00 176.35 175.22 3e1f s HIS 977 N 0.50 2.65 0.57 0.29 -3.43 -1.26 -5.10 115.29 109.51 3e1f s HIS 977 Ca 0.41 -0.51 -0.21 0.00 -0.80 0.00 0.00 55.06 53.96 3e1f s HIS 977 Cb -0.20 -1.69 -0.04 0.00 -1.43 0.00 0.00 32.58 29.22 3e1f s HIS 977 CO 0.22 -0.08 1.27 0.00 -2.00 0.00 0.00 174.74 174.15 3e1f n ALA 978 N 2.92 1.21 -2.41 -1.38 0.00 -1.26 -4.84 120.51 114.75 3e1f n ALA 978 Ca -0.18 0.09 -0.23 0.00 0.00 0.00 0.00 53.44 53.12 3e1f n ALA 978 Cb 0.52 -2.30 -0.06 0.00 0.00 0.00 0.00 19.45 17.62 3e1f n ALA 978 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3e1f s GLU 979 N -2.92 2.37 0.22 0.00 2.02 -0.38 -5.05 118.70 114.96 3e1f s GLU 979 Ca 0.74 -1.64 -0.31 0.00 0.02 0.00 0.00 54.97 53.77 3e1f s GLU 979 Cb -0.42 -2.17 -0.11 0.00 0.10 0.00 0.00 34.13 31.53 3e1f s GLU 979 CO 0.47 -0.05 1.65 -1.21 0.02 0.00 0.00 175.26 176.14 3e1f s GLU 980 N -3.94 4.15 2.04 1.61 2.02 -1.26 -4.74 118.70 118.58 3e1f s GLU 980 Ca 0.42 2.53 0.00 0.00 0.02 0.00 0.00 54.97 57.93 3e1f s GLU 980 Cb -0.00 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 31.14 3e1f s GLU 980 CO 0.24 -0.68 0.00 0.41 0.02 0.00 0.00 175.26 175.25 3e1f n GLY 981 N 3.47 -0.96 3.01 -1.39 0.00 -1.26 -4.84 105.19 103.23 3e1f n GLY 981 Ca 0.13 -1.18 -0.28 0.00 0.00 0.00 0.00 46.02 44.69 3e1f n GLY 981 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3e1f s THR 982 N 0.00 1.40 -0.03 2.61 2.01 -0.75 -4.70 115.64 116.18 3e1f s THR 982 Ca 0.00 -0.55 -0.30 0.00 0.31 0.00 0.00 61.69 61.15 3e1f s THR 982 Cb 0.00 -1.32 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 3e1f s THR 982 CO 0.00 0.43 1.08 0.26 -0.69 0.00 0.00 174.62 175.70 3e1f s TRP 983 N 1.28 3.47 -0.17 4.92 0.52 1.00 -0.87 118.94 129.09 3e1f s TRP 983 Ca -0.01 1.48 -0.01 0.00 0.02 0.00 0.00 56.10 57.58 3e1f s TRP 983 Cb -0.14 -3.27 -0.01 0.00 -1.15 0.00 0.00 33.47 28.91 3e1f s TRP 983 CO -0.06 -0.63 -0.11 -1.17 0.02 0.00 0.00 176.95 175.00 3e1f s LEU 984 N 1.54 2.66 -0.30 2.99 2.96 -0.61 -2.35 118.68 125.57 3e1f s LEU 984 Ca 0.53 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 54.05 3e1f s LEU 984 Cb -0.23 -1.63 0.07 0.00 0.50 0.00 0.00 46.19 44.90 3e1f s LEU 984 CO 0.24 0.07 -0.03 0.20 -1.32 0.00 0.00 176.35 175.52 3e1f s ASN 985 N 0.90 4.67 -0.35 3.68 0.01 -0.90 -2.34 114.94 120.61 3e1f s ASN 985 Ca -0.03 -1.61 -0.07 0.00 -0.71 0.00 0.00 52.86 50.44 3e1f s ASN 985 Cb -0.15 -1.62 0.04 0.00 0.41 0.00 0.00 41.25 39.93 3e1f s ASN 985 CO -0.00 -0.28 0.13 -0.63 -1.51 0.00 0.00 177.10 174.81 3e1f s ILE 986 N 1.08 3.96 -0.13 0.60 1.01 -0.17 -2.39 121.20 125.16 3e1f s ILE 986 Ca -0.02 -1.09 -0.07 0.00 0.00 0.00 0.00 60.65 59.47 3e1f s ILE 986 Cb -0.20 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3e1f s ILE 986 CO -0.05 -0.20 0.13 -1.81 0.00 0.00 0.00 174.94 173.00 3e1f s ASP 987 N 1.46 6.25 0.07 3.58 1.01 -0.03 -0.03 116.67 128.97 3e1f s ASP 987 Ca -0.01 0.39 0.14 0.00 0.71 0.00 0.00 52.55 53.79 3e1f s ASP 987 Cb -0.20 -2.02 -0.15 0.00 1.01 0.00 0.00 42.92 41.56 3e1f s ASP 987 CO 0.04 0.36 0.92 1.23 0.21 0.00 0.00 175.17 177.93 3e1f h GLY 988 N 5.31 0.00 -5.41 0.21 0.00 -1.23 0.41 103.07 102.37 3e1f h GLY 988 Ca -0.52 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.68 3e1f h GLY 988 CO 0.61 0.00 -0.30 -1.36 0.00 0.00 0.00 176.54 175.49 3e1f s PHE 989 N -2.80 -0.45 -0.05 5.60 0.40 -0.98 -4.79 117.98 114.91 3e1f s PHE 989 Ca -0.02 1.06 0.02 0.00 -0.60 0.00 0.00 56.93 57.39 3e1f s PHE 989 Cb 0.08 0.16 0.01 0.00 0.51 0.00 0.00 43.02 43.79 3e1f s PHE 989 CO 0.81 -0.24 -0.09 -1.58 0.70 0.00 0.00 175.22 174.82 3e1f s HIS 990 N 0.56 1.13 0.62 0.36 2.46 -1.26 -0.50 115.29 118.66 3e1f s HIS 990 Ca -0.03 -0.37 -0.18 0.00 0.47 0.00 0.00 55.06 54.95 3e1f s HIS 990 Cb -0.05 -0.86 -0.02 0.00 -0.13 0.00 0.00 32.58 31.52 3e1f s HIS 990 CO -0.03 -0.22 1.20 1.41 -2.47 0.00 0.00 174.74 174.63 3e1f s MET 991 N 0.67 2.83 0.87 2.88 1.75 -0.14 -4.74 119.30 123.41 3e1f s MET 991 Ca -0.12 1.79 -0.11 0.00 -1.25 0.00 0.00 55.69 56.01 3e1f s MET 991 Cb -0.14 -1.91 0.11 0.00 2.84 0.00 0.00 34.83 35.73 3e1f s MET 991 CO 0.02 -1.31 1.10 0.20 -0.65 0.00 0.00 175.02 174.38 3e1f s GLY 992 N -1.72 1.66 0.12 2.11 0.00 -0.30 -4.80 107.32 104.39 3e1f s GLY 992 Ca 0.76 0.26 0.18 0.00 0.00 0.00 0.00 44.72 45.93 3e1f s GLY 992 CO 0.36 0.69 0.95 0.16 0.00 0.00 0.00 173.10 175.25 3e1f h ILE 993 N -1.53 0.40 -1.12 0.90 3.07 -1.91 -3.48 117.51 113.83 3e1f h ILE 993 Ca -0.46 -1.75 0.00 0.00 1.55 0.00 0.00 64.86 64.20 3e1f h ILE 993 Cb 1.26 1.94 0.00 0.00 -0.27 0.00 0.00 36.82 39.75 3e1f h ILE 993 CO 0.49 0.23 0.00 0.61 -1.05 0.00 0.00 178.15 178.43 3e1f n GLY 994 N 1.32 -1.13 0.00 0.16 0.00 -1.26 -4.76 105.19 99.52 3e1f n GLY 994 Ca -0.06 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.83 3e1f n GLY 994 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1f n GLY 995 N 0.00 -0.80 0.34 -0.02 0.00 -1.25 -2.00 105.19 101.45 3e1f n GLY 995 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 3e1f n GLY 995 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3e1f h ASP 996 N 0.00 0.00 -4.03 1.61 3.32 -1.77 -1.91 116.42 113.64 3e1f h ASP 996 Ca 0.00 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.27 3e1f h ASP 996 Cb 0.00 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.34 3e1f h ASP 996 CO 0.00 0.00 0.78 1.51 -1.72 0.00 0.00 179.24 179.81 3e1f s ASP 997 N -4.77 -0.16 -0.35 6.45 1.47 -1.26 -4.17 116.67 113.88 3e1f s ASP 997 Ca -0.04 0.07 0.07 0.00 1.18 0.00 0.00 52.55 53.83 3e1f s ASP 997 Cb 0.11 0.16 0.54 0.00 -0.34 0.00 0.00 42.92 43.39 3e1f s ASP 997 CO 0.34 -0.23 1.58 -1.20 0.68 0.00 0.00 175.17 176.34 3e1f n SER 998 N 0.14 3.07 -0.34 2.11 7.64 -1.26 -4.52 113.62 120.45 3e1f n SER 998 Ca -0.02 -3.76 0.02 0.00 1.01 0.00 0.00 58.87 56.13 3e1f n SER 998 Cb 0.58 -0.69 0.03 0.00 -1.01 0.00 0.00 64.21 63.13 3e1f n SER 998 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 3e1f n TRP 999 N -1.11 0.00 -3.59 1.43 2.14 -1.26 -4.08 117.44 110.97 3e1f n TRP 999 Ca 0.41 -0.25 -0.09 0.00 2.07 0.00 0.00 57.50 59.64 3e1f n TRP 999 Cb 1.16 -0.07 -0.05 0.00 -0.81 0.00 0.00 31.31 31.54 3e1f n TRP 999 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 3e1f s SER 1000N -1.36 -0.33 -0.40 -0.67 1.04 -1.26 -4.57 113.70 106.14 3e1f s SER 1000Ca 0.08 0.40 -0.45 0.00 0.48 0.00 0.00 55.95 56.46 3e1f s SER 1000Cb 0.07 0.33 -0.19 0.00 0.10 0.00 0.00 66.02 66.33 3e1f s SER 1000CO 0.01 -0.27 1.60 -2.65 0.98 0.00 0.00 173.24 172.91 3e1f n PRO 1001N 0.90 0.32 -0.19 4.02 -0.02 -1.26 -4.81 135.00 133.95 3e1f n PRO 1001Ca -0.09 0.12 0.04 0.00 -2.02 0.00 0.00 63.50 61.54 3e1f n PRO 1001Cb 0.58 -1.67 0.05 0.00 -0.02 0.00 0.00 33.50 32.44 3e1f n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3e1f n SER 1002N 4.18 1.18 -4.61 2.55 3.41 -1.26 -5.03 113.62 114.04 3e1f n SER 1002Ca 0.29 -2.26 -0.40 0.00 -0.26 0.00 0.00 58.87 56.24 3e1f n SER 1002Cb 0.00 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 63.65 3e1f n SER 1002CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3e1f s VAL 1003N -1.22 5.06 0.36 -3.33 1.01 -1.26 -3.86 120.40 117.15 3e1f s VAL 1003Ca 0.12 0.83 -0.28 0.00 0.00 0.00 0.00 61.98 62.65 3e1f s VAL 1003Cb 0.10 -3.85 -0.12 0.00 0.00 0.00 0.00 36.38 32.52 3e1f s VAL 1003CO 0.01 0.05 1.33 -0.24 0.00 0.00 0.00 175.10 176.25 3e1f n SER 1004N 5.58 2.97 -0.26 3.32 2.88 -1.26 -4.89 113.62 121.96 3e1f n SER 1004Ca -0.04 1.20 0.07 0.00 -1.33 0.00 0.00 58.87 58.77 3e1f n SER 1004Cb 0.50 -1.52 0.21 0.00 -0.75 0.00 0.00 64.21 62.64 3e1f n SER 1004CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3e1f h ALA 1005N 2.56 1.04 0.00 -1.46 0.00 -1.96 0.96 119.26 120.40 3e1f h ALA 1005Ca -0.47 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3e1f h ALA 1005Cb 1.28 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3e1f h ALA 1005CO 0.62 -0.35 0.00 -0.85 0.00 0.00 0.00 179.25 178.68 3e1f n GLU 1006N -5.15 0.00 -0.35 0.00 0.00 -1.26 -1.29 120.64 112.59 3e1f n GLU 1006Ca 0.16 0.44 0.08 0.00 0.00 0.00 0.00 57.16 57.84 3e1f n GLU 1006Cb 0.51 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.67 3e1f n GLU 1006CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3e1f n PHE 1007N -1.48 0.74 -3.95 -1.84 3.72 0.33 -4.96 117.46 110.02 3e1f n PHE 1007Ca 0.01 -0.83 -0.35 0.00 -0.05 0.00 0.00 57.45 56.22 3e1f n PHE 1007Cb 0.02 -0.25 -0.12 0.00 -0.94 0.00 0.00 39.48 38.20 3e1f n PHE 1007CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3e1f s GLN 1008N -2.53 3.69 -1.04 -1.08 -0.21 -0.41 -1.15 119.66 116.92 3e1f s GLN 1008Ca 0.37 -0.48 -0.25 0.00 0.02 0.00 0.00 55.36 55.02 3e1f s GLN 1008Cb 0.29 -3.19 -0.15 0.00 1.00 0.00 0.00 33.01 30.97 3e1f s GLN 1008CO 0.09 -0.02 2.08 -0.51 -2.12 0.00 0.00 175.29 174.81 3e1f s LEU 1009N 1.13 2.76 0.00 2.90 1.43 -1.26 -4.52 118.68 121.11 3e1f s LEU 1009Ca 0.03 -0.99 0.02 0.00 -1.03 0.00 0.00 54.13 52.17 3e1f s LEU 1009Cb -0.14 -2.58 -0.00 0.00 0.03 0.00 0.00 46.19 43.49 3e1f s LEU 1009CO 0.02 -3.85 0.33 -1.54 0.23 0.00 0.00 176.35 171.55 3e1f n SER 1010N 17.16 0.65 0.29 2.29 3.41 -1.26 -4.10 113.62 132.06 3e1f n SER 1010Ca 0.43 -0.83 0.12 0.00 -0.26 0.00 0.00 58.87 58.34 3e1f n SER 1010Cb 0.46 0.50 0.57 0.00 -0.26 0.00 0.00 64.21 65.48 3e1f n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3e1f h ALA 1011N 0.39 1.67 0.00 7.33 0.00 -1.99 -3.45 119.26 123.21 3e1f h ALA 1011Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3e1f h ALA 1011Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3e1f h ALA 1011CO 0.00 -0.61 0.00 0.41 0.00 0.00 0.00 179.25 179.05 3e1f n GLY 1012N -1.34 1.93 3.07 0.00 0.00 -1.26 -4.88 105.19 102.71 3e1f n GLY 1012Ca 0.01 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 3e1f n GLY 1012CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3e1f s ARG 1013N 0.00 2.43 0.24 1.61 0.52 -1.26 0.86 118.95 123.34 3e1f s ARG 1013Ca 0.00 -0.63 0.11 0.00 -0.52 0.00 0.00 55.73 54.69 3e1f s ARG 1013Cb 0.00 -2.09 -0.05 0.00 0.52 0.00 0.00 34.95 33.33 3e1f s ARG 1013CO 0.00 -0.12 -0.20 0.71 0.02 0.00 0.00 175.30 175.71 3e1f s TYR 1014N 1.14 2.14 -0.17 -0.53 1.51 -0.17 -5.00 117.35 116.27 3e1f s TYR 1014Ca -0.02 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 55.57 3e1f s TYR 1014Cb -0.14 -0.98 0.07 0.00 -0.11 0.00 0.00 41.96 40.80 3e1f s TYR 1014CO -0.05 0.57 0.38 -1.58 -1.11 0.00 0.00 175.55 173.76 3e1f s HIS 1015N -2.37 -0.61 0.03 2.71 2.46 -1.26 -1.31 115.29 114.94 3e1f s HIS 1015Ca 0.25 1.27 -0.02 0.00 0.47 0.00 0.00 55.06 57.03 3e1f s HIS 1015Cb -0.05 0.22 -0.02 0.00 -0.13 0.00 0.00 32.58 32.60 3e1f s HIS 1015CO 0.12 -0.37 0.01 1.52 -2.47 0.00 0.00 174.74 173.55 3e1f s TYR 1016N 1.86 0.31 -0.03 3.88 1.13 -0.95 -5.03 117.35 118.51 3e1f s TYR 1016Ca -0.06 -0.66 0.02 0.00 -1.41 0.00 0.00 57.07 54.96 3e1f s TYR 1016Cb -0.10 -0.23 0.01 0.00 -1.10 0.00 0.00 41.96 40.54 3e1f s TYR 1016CO -0.12 -0.30 -0.07 1.14 -2.51 0.00 0.00 175.55 173.69 3e1f s GLN 1017N -2.51 0.84 0.15 -3.49 -2.07 -1.26 -1.23 119.66 110.09 3e1f s GLN 1017Ca -0.06 -0.23 0.10 0.00 -1.82 0.00 0.00 55.36 53.35 3e1f s GLN 1017Cb -0.02 -0.80 -0.04 0.00 -1.09 0.00 0.00 33.01 31.06 3e1f s GLN 1017CO -0.05 0.05 -0.22 -0.51 -1.32 0.00 0.00 175.29 173.24 3e1f s LEU 1018N 0.36 2.37 -0.24 2.60 1.43 0.77 -4.36 118.68 121.61 3e1f s LEU 1018Ca -0.05 -0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 52.26 3e1f s LEU 1018Cb -0.09 -1.01 0.07 0.00 0.03 0.00 0.00 46.19 45.18 3e1f s LEU 1018CO 0.00 0.08 -0.01 -0.69 0.23 0.00 0.00 176.35 175.96 3e1f s VAL 1019N -1.48 1.21 -0.07 -1.59 1.01 -0.32 0.33 120.40 119.49 3e1f s VAL 1019Ca 0.14 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 60.88 3e1f s VAL 1019Cb -0.08 -1.62 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 3e1f s VAL 1019CO 0.07 -0.22 0.31 0.86 0.00 0.00 0.00 175.10 176.11 3e1f s TRP 1020N 1.52 3.64 0.19 5.22 -0.11 0.97 -1.40 118.94 128.97 3e1f s TRP 1020Ca -0.02 0.78 -0.22 0.00 1.22 0.00 0.00 56.10 57.86 3e1f s TRP 1020Cb -0.18 -2.20 0.07 0.00 -1.50 0.00 0.00 33.47 29.65 3e1f s TRP 1020CO -0.09 0.58 0.99 0.00 -4.62 0.00 0.00 176.95 173.82 3e1f s GLN 1022N -2.51 3.87 0.00 0.00 0.74 -1.26 -1.70 119.66 118.80 3e1f s GLN 1022Ca 0.18 -0.37 0.30 0.00 0.05 0.00 0.00 55.36 55.52 3e1f s GLN 1022Cb -0.02 -3.44 1.76 0.00 1.10 0.00 0.00 33.01 32.42 3e1f s GLN 1022CO 0.05 -0.05 2.10 0.36 -0.55 0.00 0.00 175.29 177.20