#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pjs n ASP 2 N 0.00 0.77 -3.89 6.12 3.85 -1.26 -4.92 116.55 117.22 1pjs n ASP 2 Ca 0.00 -0.64 -0.11 0.00 -0.71 0.00 0.00 54.79 53.32 1pjs n ASP 2 Cb 0.00 0.73 -0.12 0.00 -1.35 0.00 0.00 41.12 40.37 1pjs n ASP 2 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 1pjs s HIS 3 N -3.02 0.04 -0.35 2.11 3.76 -1.26 -5.13 115.29 111.44 1pjs s HIS 3 Ca 0.08 -0.07 -0.11 0.00 -0.15 0.00 0.00 55.06 54.82 1pjs s HIS 3 Cb 0.16 -0.05 0.01 0.00 1.11 0.00 0.00 32.58 33.82 1pjs s HIS 3 CO 0.80 -0.12 0.19 -1.17 -0.85 0.00 0.00 174.74 173.59 1pjs s LEU 4 N -0.62 4.49 0.22 0.89 2.96 -1.26 -5.07 118.68 120.29 1pjs s LEU 4 Ca -0.07 -0.77 -0.30 0.00 -0.22 0.00 0.00 54.13 52.78 1pjs s LEU 4 Cb -0.04 -2.03 -0.08 0.00 0.50 0.00 0.00 46.19 44.53 1pjs s LEU 4 CO 0.00 -0.30 1.10 -2.16 -1.32 0.00 0.00 176.35 173.67 1pjs s PRO 5 N 1.59 4.61 0.01 0.98 0.04 -1.26 -5.04 135.00 135.94 1pjs s PRO 5 Ca 0.03 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 1pjs s PRO 5 Cb -0.18 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1pjs s PRO 5 CO 0.07 0.13 0.05 0.96 0.04 0.00 0.00 177.00 178.24 1pjs s ILE 6 N -0.58 0.09 -0.41 0.56 -4.36 -1.26 -5.13 121.20 110.10 1pjs s ILE 6 Ca 0.48 -0.71 -0.09 0.00 -0.26 0.00 0.00 60.65 60.07 1pjs s ILE 6 Cb -0.30 -0.31 0.08 0.00 1.25 0.00 0.00 42.46 43.17 1pjs s ILE 6 CO 0.37 -0.39 0.25 -0.36 0.24 0.00 0.00 174.94 175.05 1pjs s PHE 7 N -1.23 3.34 0.15 1.37 0.40 -1.26 -5.08 117.98 115.66 1pjs s PHE 7 Ca -0.13 -1.52 -0.27 0.00 -0.60 0.00 0.00 56.93 54.41 1pjs s PHE 7 Cb -0.08 -2.92 -0.08 0.00 0.51 0.00 0.00 43.02 40.46 1pjs s PHE 7 CO 0.00 -0.84 0.82 0.00 0.70 0.00 0.00 175.22 175.90 1pjs s GLN 9 N -0.86 3.97 0.00 0.00 -0.44 -1.26 -4.93 119.66 116.14 1pjs s GLN 9 Ca 0.38 0.41 0.13 0.00 -2.50 0.00 0.00 55.36 53.79 1pjs s GLN 9 Cb -0.23 -3.70 0.12 0.00 -1.64 0.00 0.00 33.01 27.55 1pjs s GLN 9 CO 0.27 -0.54 0.93 1.28 0.50 0.00 0.00 175.29 177.74 1pjs n LEU 10 N 5.87 2.14 -4.70 3.68 4.77 -1.26 -4.91 117.00 122.59 1pjs n LEU 10 Ca -0.00 -1.05 -0.53 0.00 -0.03 0.00 0.00 56.01 54.39 1pjs n LEU 10 Cb 0.49 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1pjs n LEU 10 CO 0.45 0.41 1.41 0.54 -1.33 0.00 0.00 177.39 178.87 1pjs n ARG 11 N 0.73 1.65 -2.36 3.23 1.74 -1.21 -1.42 116.66 119.01 1pjs n ARG 11 Ca 0.08 0.61 -0.14 0.00 -0.77 0.00 0.00 57.85 57.62 1pjs n ARG 11 Cb 0.33 -2.37 -0.01 0.00 -1.02 0.00 0.00 32.46 29.39 1pjs n ARG 11 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1pjs n ASP 12 N 6.01 -4.36 -4.66 0.55 8.00 -0.18 -4.93 116.55 116.98 1pjs n ASP 12 Ca 0.25 0.16 -0.35 0.00 0.71 0.00 0.00 54.79 55.56 1pjs n ASP 12 Cb 0.21 -3.70 -0.10 0.00 -0.02 0.00 0.00 41.12 37.51 1pjs n ASP 12 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1pjs s ARG 13 N -4.91 3.20 0.10 -1.24 3.52 -0.51 -4.71 118.95 114.40 1pjs s ARG 13 Ca 0.00 -0.41 -0.31 0.00 -0.13 0.00 0.00 55.73 54.88 1pjs s ARG 13 Cb 0.00 -2.87 -0.08 0.00 -1.56 0.00 0.00 34.95 30.44 1pjs s ARG 13 CO 0.00 0.59 1.49 -0.51 -0.81 0.00 0.00 175.30 176.06 1pjs s ASP 14 N -0.57 6.73 0.03 -2.12 -0.00 -1.26 -0.67 116.67 118.81 1pjs s ASP 14 Ca 0.10 2.39 0.01 0.00 -0.00 0.00 0.00 52.55 55.05 1pjs s ASP 14 Cb -0.12 -2.58 -0.02 0.00 -0.00 0.00 0.00 42.92 40.20 1pjs s ASP 14 CO 0.02 -0.75 -0.06 0.00 -0.00 0.00 0.00 175.17 174.38 1pjs s LEU 16 N -1.55 1.96 -0.07 0.00 2.96 -0.13 -1.66 118.68 120.18 1pjs s LEU 16 Ca -0.12 -0.31 0.04 0.00 -0.22 0.00 0.00 54.13 53.51 1pjs s LEU 16 Cb -0.10 -0.88 0.00 0.00 0.50 0.00 0.00 46.19 45.72 1pjs s LEU 16 CO -0.00 0.17 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.38 1pjs s ILE 17 N -0.16 1.62 -0.27 6.68 1.01 -0.72 -1.18 121.20 128.19 1pjs s ILE 17 Ca 0.01 -0.79 -0.05 0.00 0.00 0.00 0.00 60.65 59.83 1pjs s ILE 17 Cb -0.09 -1.42 0.01 0.00 0.01 0.00 0.00 42.46 40.98 1pjs s ILE 17 CO 0.01 0.46 0.03 -0.69 0.00 0.00 0.00 174.94 174.75 1pjs s VAL 18 N 0.32 3.66 0.00 2.92 1.01 -0.49 -0.86 120.40 126.95 1pjs s VAL 18 Ca -0.12 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1pjs s VAL 18 Cb -0.15 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1pjs s VAL 18 CO 0.05 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1pjs n GLY 19 N 4.81 4.15 0.29 4.51 0.00 -0.02 0.27 105.19 119.21 1pjs n GLY 19 Ca -0.16 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1pjs n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pjs n GLY 20 N -1.66 -0.93 0.00 -0.02 0.00 -1.26 -4.57 105.19 96.75 1pjs n GLY 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pjs n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pjs n GLY 21 N 0.00 0.31 0.19 -0.02 0.00 -1.26 -2.08 105.19 102.32 1pjs n GLY 21 Ca 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1pjs n GLY 21 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pjs h ASP 22 N 0.00 0.55 -0.42 1.61 5.19 -1.99 -2.66 116.42 118.70 1pjs h ASP 22 Ca 0.00 -0.35 -0.05 0.00 -0.62 0.00 0.00 57.03 56.02 1pjs h ASP 22 Cb 0.00 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 39.33 1pjs h ASP 22 CO 0.00 1.08 0.08 0.58 -3.12 0.00 0.00 179.24 177.86 1pjs h VAL 23 N 0.33 1.24 -0.25 -1.35 2.07 -1.94 -2.71 116.25 113.63 1pjs h VAL 23 Ca -0.02 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 1pjs h VAL 23 Cb 1.27 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1pjs h VAL 23 CO 0.12 0.29 0.03 0.00 0.02 0.00 0.00 177.57 178.04 1pjs h ALA 24 N 0.94 1.58 -0.38 1.67 0.00 -1.74 -2.75 119.26 118.60 1pjs h ALA 24 Ca 0.13 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1pjs h ALA 24 Cb 0.35 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1pjs h ALA 24 CO 0.01 0.31 0.02 1.49 0.00 0.00 0.00 179.25 181.08 1pjs h GLU 25 N 0.36 0.58 -0.40 0.00 4.22 -1.15 -0.69 114.58 117.51 1pjs h GLU 25 Ca 0.09 -0.13 -0.14 0.00 0.08 0.00 0.00 59.36 59.26 1pjs h GLU 25 Cb 0.20 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1pjs h GLU 25 CO 0.00 0.59 -0.29 0.00 -2.18 0.00 0.00 179.01 177.13 1pjs h ARG 26 N 0.56 0.91 -0.52 1.92 3.08 -1.38 0.57 114.38 119.52 1pjs h ARG 26 Ca 0.12 -0.44 -0.06 0.00 0.07 0.00 0.00 59.98 59.67 1pjs h ARG 26 Cb 0.33 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1pjs h ARG 26 CO 0.01 1.09 0.07 0.87 -1.07 0.00 0.00 179.97 180.94 1pjs h LYS 27 N 0.73 0.83 -0.10 0.04 6.56 -1.39 -1.69 116.57 121.55 1pjs h LYS 27 Ca 0.08 -0.20 -0.22 0.00 -1.06 0.00 0.00 60.65 59.25 1pjs h LYS 27 Cb 0.88 -0.11 0.01 0.00 -0.57 0.00 0.00 32.23 32.44 1pjs h LYS 27 CO 0.08 0.79 -0.80 0.00 -2.06 0.00 0.00 179.45 177.46 1pjs h ALA 28 N 1.29 0.23 -0.55 3.86 0.00 -0.86 -1.24 119.26 121.98 1pjs h ALA 28 Ca 0.16 -0.61 0.04 0.00 0.00 0.00 0.00 54.91 54.50 1pjs h ALA 28 Cb 0.38 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1pjs h ALA 28 CO 0.01 0.62 0.31 -0.09 0.00 0.00 0.00 179.25 180.09 1pjs h ARG 29 N 0.40 0.58 0.09 0.00 2.43 -0.70 0.18 114.38 117.37 1pjs h ARG 29 Ca -0.07 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1pjs h ARG 29 Cb 1.44 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1pjs h ARG 29 CO 0.16 0.38 -0.04 1.25 -1.51 0.00 0.00 179.97 180.21 1pjs h LEU 30 N 0.60 -0.10 -1.28 3.80 5.85 -1.29 -1.31 115.31 121.57 1pjs h LEU 30 Ca 0.23 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1pjs h LEU 30 Cb 0.09 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1pjs h LEU 30 CO -0.13 0.16 0.50 -0.07 -0.34 0.00 0.00 178.44 178.56 1pjs h LEU 31 N -0.37 0.81 -0.46 2.25 4.07 -0.89 -2.15 115.31 118.58 1pjs h LEU 31 Ca -0.01 -0.01 -0.14 0.00 0.08 0.00 0.00 57.88 57.79 1pjs h LEU 31 Cb 0.31 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1pjs h LEU 31 CO 0.02 0.56 -0.27 -0.07 -1.08 0.00 0.00 178.44 177.60 1pjs h LEU 32 N 0.95 1.03 -1.77 1.67 3.38 -0.55 -0.92 115.31 119.09 1pjs h LEU 32 Ca 0.30 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1pjs h LEU 32 Cb 0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1pjs h LEU 32 CO -0.08 1.22 0.07 -0.33 0.09 0.00 0.00 178.44 179.41 1pjs h GLU 33 N 0.84 0.21 -0.01 1.13 5.08 -0.63 0.23 114.58 121.44 1pjs h GLU 33 Ca 0.10 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1pjs h GLU 33 Cb 0.86 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1pjs h GLU 33 CO 0.08 0.18 -0.05 0.00 -1.00 0.00 0.00 179.01 178.22 1pjs n ALA 34 N -2.51 2.69 -1.04 3.43 0.00 -0.88 -4.94 120.51 117.26 1pjs n ALA 34 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1pjs n ALA 34 Cb 0.11 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1pjs n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pjs n GLY 35 N 1.16 0.42 3.74 0.00 0.00 0.80 -3.36 105.19 107.95 1pjs n GLY 35 Ca 0.19 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 1pjs n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pjs s ALA 36 N -2.00 2.30 -0.77 4.61 0.00 -0.39 -1.01 121.76 124.49 1pjs s ALA 36 Ca 0.00 0.92 -0.17 0.00 0.00 0.00 0.00 51.96 52.70 1pjs s ALA 36 Cb 0.00 -3.46 0.15 0.00 0.00 0.00 0.00 23.12 19.81 1pjs s ALA 36 CO 0.00 -1.59 0.86 0.50 0.00 0.00 0.00 175.76 175.53 1pjs s ARG 37 N -3.71 3.40 -0.11 0.00 3.52 0.16 -4.72 118.95 117.48 1pjs s ARG 37 Ca 0.75 -1.83 -0.14 0.00 -0.13 0.00 0.00 55.73 54.38 1pjs s ARG 37 Cb -0.29 -4.52 -0.05 0.00 -1.56 0.00 0.00 34.95 28.53 1pjs s ARG 37 CO 0.41 -1.53 0.35 -1.17 -0.81 0.00 0.00 175.30 172.54 1pjs s LEU 38 N 1.87 4.32 -0.09 -0.88 2.96 -1.26 -1.57 118.68 124.02 1pjs s LEU 38 Ca 0.20 0.67 0.04 0.00 -0.22 0.00 0.00 54.13 54.82 1pjs s LEU 38 Cb -0.14 -2.46 -0.01 0.00 0.50 0.00 0.00 46.19 44.08 1pjs s LEU 38 CO -0.04 0.16 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.04 1pjs s THR 39 N 0.02 2.26 -0.14 3.68 2.01 -0.67 -1.56 115.64 121.24 1pjs s THR 39 Ca 0.20 -0.96 0.02 0.00 0.31 0.00 0.00 61.69 61.26 1pjs s THR 39 Cb -0.14 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.50 1pjs s THR 39 CO 0.07 0.56 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.68 1pjs s VAL 40 N 0.20 2.34 -0.21 3.82 1.01 0.07 -1.75 120.40 125.87 1pjs s VAL 40 Ca -0.13 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 60.96 1pjs s VAL 40 Cb -0.16 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.29 1pjs s VAL 40 CO 0.07 0.54 -0.14 0.21 0.00 0.00 0.00 175.10 175.77 1pjs s ASN 41 N 0.77 3.74 0.23 3.32 3.04 -0.04 -0.96 114.94 125.03 1pjs s ASN 41 Ca -0.07 -0.84 -0.21 0.00 0.04 0.00 0.00 52.86 51.78 1pjs s ASN 41 Cb -0.16 -1.55 0.04 0.00 -1.54 0.00 0.00 41.25 38.04 1pjs s ASN 41 CO -0.00 -0.07 0.65 0.00 -3.04 0.00 0.00 177.10 174.64 1pjs s ALA 42 N 1.27 -1.27 0.17 1.71 0.00 -0.96 -0.84 121.76 121.84 1pjs s ALA 42 Ca 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 1pjs s ALA 42 Cb -0.15 0.87 0.03 0.00 0.00 0.00 0.00 23.12 23.86 1pjs s ALA 42 CO -0.09 -0.91 1.40 -0.07 0.00 0.00 0.00 175.76 176.09 1pjs h LEU 43 N 2.04 0.42 -7.51 0.00 4.07 -1.86 0.13 115.31 112.59 1pjs h LEU 43 Ca -0.25 -0.30 -0.12 0.00 0.08 0.00 0.00 57.88 57.29 1pjs h LEU 43 Cb 1.27 -0.12 -0.21 0.00 1.08 0.00 0.00 40.66 42.68 1pjs h LEU 43 CO 0.30 1.06 -0.30 0.28 -1.08 0.00 0.00 178.44 178.70 1pjs s THR 44 N -3.45 0.05 -0.01 0.22 -1.32 -1.26 -4.55 115.64 105.32 1pjs s THR 44 Ca -0.05 -0.42 0.07 0.00 -1.21 0.00 0.00 61.69 60.08 1pjs s THR 44 Cb 0.10 -0.58 -0.02 0.00 -1.51 0.00 0.00 72.50 70.49 1pjs s THR 44 CO 0.84 -0.23 -0.22 -0.36 -2.21 0.00 0.00 174.62 172.44 1pjs s PHE 45 N -1.13 1.96 0.51 9.09 0.08 -1.26 -4.11 117.98 123.12 1pjs s PHE 45 Ca -0.12 -0.37 -0.18 0.00 0.12 0.00 0.00 56.93 56.39 1pjs s PHE 45 Cb -0.05 -1.25 -0.08 0.00 -0.57 0.00 0.00 43.02 41.07 1pjs s PHE 45 CO 0.04 -0.02 0.99 0.96 -0.10 0.00 0.00 175.22 177.09 1pjs s ILE 46 N -0.54 4.35 0.17 0.64 -4.36 -0.88 -4.92 121.20 115.66 1pjs s ILE 46 Ca 0.08 1.21 -0.03 0.00 -0.26 0.00 0.00 60.65 61.65 1pjs s ILE 46 Cb -0.08 -3.63 0.27 0.00 1.25 0.00 0.00 42.46 40.26 1pjs s ILE 46 CO -0.01 -0.56 0.93 -2.65 0.24 0.00 0.00 174.94 172.89 1pjs n PRO 47 N -1.43 -0.05 0.26 0.37 -0.02 -1.26 -0.55 135.00 132.31 1pjs n PRO 47 Ca 0.07 0.92 0.18 0.00 -2.02 0.00 0.00 63.50 62.65 1pjs n PRO 47 Cb 0.54 -1.39 0.91 0.00 -0.02 0.00 0.00 33.50 33.53 1pjs n PRO 47 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1pjs h GLN 48 N 0.00 0.00 0.01 -0.52 5.75 -1.98 0.34 115.11 118.71 1pjs h GLN 48 Ca 0.30 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.61 1pjs h GLN 48 Cb 0.51 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.04 1pjs h GLN 48 CO -0.60 0.00 -0.90 0.74 -2.65 0.00 0.00 178.83 175.42 1pjs h PHE 49 N 0.00 0.11 -0.24 3.99 -1.00 -1.18 -2.49 116.94 116.13 1pjs h PHE 49 Ca 0.05 -0.07 -0.19 0.00 2.81 0.00 0.00 57.97 60.57 1pjs h PHE 49 Cb 0.42 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.97 1pjs h PHE 49 CO 0.00 0.93 -0.59 1.15 -1.61 0.00 0.00 178.31 178.19 1pjs h THR 50 N 0.04 1.28 -0.74 -1.55 2.02 -1.08 -1.56 112.91 111.32 1pjs h THR 50 Ca -0.03 -1.78 -0.02 0.00 0.77 0.00 0.00 66.41 65.36 1pjs h THR 50 Cb 1.56 1.75 -0.04 0.00 -1.74 0.00 0.00 68.15 69.68 1pjs h THR 50 CO 0.13 0.57 0.40 0.58 0.37 0.00 0.00 175.52 177.57 1pjs h VAL 51 N 0.60 1.22 -0.02 3.16 2.07 -1.24 -0.06 116.25 121.98 1pjs h VAL 51 Ca -0.00 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 1pjs h VAL 51 Cb 1.21 0.23 0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1pjs h VAL 51 CO 0.13 0.25 -0.29 -0.50 0.02 0.00 0.00 177.57 177.18 1pjs h TRP 52 N 1.03 0.32 -0.96 1.57 6.55 -1.40 -3.23 115.95 119.82 1pjs h TRP 52 Ca 0.26 -0.16 0.13 0.00 0.95 0.00 0.00 58.89 60.06 1pjs h TRP 52 Cb 0.04 -0.04 -0.09 0.00 -0.86 0.00 0.00 29.16 28.21 1pjs h TRP 52 CO 0.01 0.94 0.59 0.00 -1.05 0.00 0.00 178.44 178.93 1pjs h ALA 53 N 0.31 1.45 0.00 1.49 0.00 -1.05 -0.29 119.26 121.17 1pjs h ALA 53 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pjs h ALA 53 Cb 1.01 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1pjs h ALA 53 CO 0.06 0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.55 1pjs n ASN 54 N -4.68 0.00 -2.72 0.00 3.02 -0.06 -2.96 115.26 107.87 1pjs n ASN 54 Ca 0.18 -1.19 -0.04 0.00 -0.03 0.00 0.00 54.58 53.51 1pjs n ASN 54 Cb 0.37 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.58 1pjs n ASN 54 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1pjs n GLU 55 N -0.80 1.97 -2.71 3.52 0.28 -0.16 -5.02 120.64 117.72 1pjs n GLU 55 Ca 0.12 -3.59 -0.12 0.00 -0.16 0.00 0.00 57.16 53.41 1pjs n GLU 55 Cb 0.05 -1.69 -0.01 0.00 1.43 0.00 0.00 31.44 31.23 1pjs n GLU 55 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1pjs n GLY 56 N -0.58 -0.49 0.10 -1.84 0.00 -1.14 -4.88 105.19 96.36 1pjs n GLY 56 Ca 0.12 0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.23 1pjs n GLY 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1pjs n MET 57 N -2.93 0.62 -3.86 1.61 2.81 -0.94 -5.01 117.12 109.42 1pjs n MET 57 Ca -0.07 0.14 -0.09 0.00 -1.81 0.00 0.00 57.70 55.88 1pjs n MET 57 Cb 0.56 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 1pjs n MET 57 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 1pjs s LEU 58 N -5.46 0.02 -0.06 4.03 0.05 -1.26 -4.63 118.68 111.37 1pjs s LEU 58 Ca -0.02 -0.99 0.05 0.00 0.05 0.00 0.00 54.13 53.22 1pjs s LEU 58 Cb 0.09 2.63 -0.02 0.00 -2.05 0.00 0.00 46.19 46.85 1pjs s LEU 58 CO 0.81 -1.52 -0.21 -0.89 -0.55 0.00 0.00 176.35 173.99 1pjs s THR 59 N -2.98 2.47 -0.07 5.48 2.01 -0.60 -4.54 115.64 117.40 1pjs s THR 59 Ca 0.16 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.25 1pjs s THR 59 Cb -0.05 -1.93 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 1pjs s THR 59 CO 0.11 0.57 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.74 1pjs s LEU 60 N -0.32 2.94 -0.36 4.42 1.43 -1.26 -0.75 118.68 124.77 1pjs s LEU 60 Ca 0.02 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 1pjs s LEU 60 Cb -0.13 -1.63 0.11 0.00 0.03 0.00 0.00 46.19 44.58 1pjs s LEU 60 CO 0.02 0.33 0.13 -0.69 0.23 0.00 0.00 176.35 176.37 1pjs s VAL 61 N -0.60 1.43 -0.12 -1.59 1.01 -0.14 -4.95 120.40 115.45 1pjs s VAL 61 Ca 0.09 -2.03 -0.29 0.00 0.00 0.00 0.00 61.98 59.75 1pjs s VAL 61 Cb -0.11 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 1pjs s VAL 61 CO 0.02 -0.72 0.97 -0.70 0.00 0.00 0.00 175.10 174.67 1pjs s GLU 62 N 1.01 4.39 0.00 2.72 2.12 -1.26 -2.27 118.70 125.42 1pjs s GLU 62 Ca 0.13 1.32 0.00 0.00 0.36 0.00 0.00 54.97 56.77 1pjs s GLU 62 Cb -0.20 -3.55 0.00 0.00 0.26 0.00 0.00 34.13 30.64 1pjs s GLU 62 CO -0.13 -0.33 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1pjs n GLY 63 N 3.16 -0.51 3.69 -1.50 0.00 0.46 -4.95 105.19 105.54 1pjs n GLY 63 Ca 0.08 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.15 1pjs n GLY 63 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pjs s PRO 64 N -1.66 -0.97 -0.18 1.61 0.04 -1.26 -3.15 135.00 129.43 1pjs s PRO 64 Ca 0.00 -0.30 -0.29 0.00 0.04 0.00 0.00 61.00 60.45 1pjs s PRO 64 Cb 0.00 -1.65 -0.05 0.00 0.04 0.00 0.00 34.50 32.85 1pjs s PRO 64 CO 0.00 -3.50 1.88 0.12 0.04 0.00 0.00 177.00 175.54 1pjs s PHE 65 N -3.32 1.63 -0.49 0.56 5.99 -1.26 -4.83 117.98 116.26 1pjs s PHE 65 Ca 0.74 0.34 -0.18 0.00 0.00 0.00 0.00 56.93 57.83 1pjs s PHE 65 Cb -0.06 -4.04 0.06 0.00 0.00 0.00 0.00 43.02 38.99 1pjs s PHE 65 CO 0.55 -3.82 0.54 0.34 -0.00 0.00 0.00 175.22 172.83 1pjs s ASP 66 N 5.64 6.20 0.44 6.13 -1.08 -1.26 -4.95 116.67 127.78 1pjs s ASP 66 Ca 0.84 -1.04 0.15 0.00 -0.52 0.00 0.00 52.55 51.98 1pjs s ASP 66 Cb -0.31 -2.25 1.07 0.00 -1.46 0.00 0.00 42.92 39.98 1pjs s ASP 66 CO 0.34 -0.79 1.96 -0.08 0.52 0.00 0.00 175.17 177.12 1pjs h GLU 67 N 8.90 0.36 0.00 4.34 4.81 -2.00 -0.96 114.58 130.03 1pjs h GLU 67 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1pjs h GLU 67 Cb 1.10 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1pjs h GLU 67 CO 0.93 0.24 0.00 0.25 -0.73 0.00 0.00 179.01 179.69 1pjs n THR 68 N -4.46 1.08 0.30 0.32 -2.24 -1.26 -1.70 114.28 106.32 1pjs n THR 68 Ca 0.11 0.41 0.14 0.00 -2.27 0.00 0.00 64.05 62.44 1pjs n THR 68 Cb 0.44 -1.33 0.67 0.00 -2.10 0.00 0.00 70.33 68.01 1pjs n THR 68 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1pjs h LEU 69 N 0.00 0.00 0.00 3.22 4.07 -1.59 -2.57 115.31 118.44 1pjs h LEU 69 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1pjs h LEU 69 Cb 0.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1pjs h LEU 69 CO 0.00 0.00 -0.73 -0.07 -1.08 0.00 0.00 178.44 176.56 1pjs h LEU 70 N 0.00 0.00 -1.98 1.67 3.38 -1.53 -3.41 115.31 113.44 1pjs h LEU 70 Ca 0.00 -0.21 0.43 0.00 0.09 0.00 0.00 57.88 58.18 1pjs h LEU 70 Cb 0.25 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1pjs h LEU 70 CO 0.00 0.11 1.06 0.44 0.09 0.00 0.00 178.44 180.13 1pjs h ASP 71 N 0.00 0.01 0.00 -0.43 3.32 -1.63 -1.55 116.42 116.13 1pjs h ASP 71 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1pjs h ASP 71 Cb 0.77 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.25 1pjs h ASP 71 CO 0.00 -0.00 -0.44 -1.54 -1.72 0.00 0.00 179.24 175.54 1pjs n SER 72 N -4.11 1.26 -4.90 6.45 3.41 -1.26 -5.07 113.62 109.40 1pjs n SER 72 Ca 0.32 -2.71 -0.29 0.00 -0.26 0.00 0.00 58.87 55.93 1pjs n SER 72 Cb 1.52 -0.36 -0.04 0.00 -0.26 0.00 0.00 64.21 65.08 1pjs n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pjs n TRP 74 N -0.53 0.00 -3.78 0.00 7.02 0.27 -4.94 117.44 115.47 1pjs n TRP 74 Ca -0.02 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.33 1pjs n TRP 74 Cb 0.53 -0.41 -0.11 0.00 -2.42 0.00 0.00 31.31 28.90 1pjs n TRP 74 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1pjs s LEU 75 N -4.24 0.99 0.02 -0.99 1.43 -1.24 -4.06 118.68 110.59 1pjs s LEU 75 Ca -0.06 0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1pjs s LEU 75 Cb 0.10 0.98 -0.01 0.00 0.03 0.00 0.00 46.19 47.29 1pjs s LEU 75 CO 0.70 -0.19 -0.06 0.00 0.23 0.00 0.00 176.35 177.02 1pjs s ALA 76 N -0.31 0.47 -0.06 4.21 0.00 -0.91 -0.96 121.76 124.21 1pjs s ALA 76 Ca -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1pjs s ALA 76 Cb -0.03 -0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.09 1pjs s ALA 76 CO 0.01 0.03 -0.05 0.42 0.00 0.00 0.00 175.76 176.18 1pjs s ILE 77 N -0.79 0.62 -0.50 0.00 1.01 -0.32 -1.28 121.20 119.94 1pjs s ILE 77 Ca -0.05 -0.13 -0.21 0.00 0.00 0.00 0.00 60.65 60.27 1pjs s ILE 77 Cb -0.06 -0.66 0.05 0.00 0.01 0.00 0.00 42.46 41.79 1pjs s ILE 77 CO 0.00 0.26 0.73 0.00 0.00 0.00 0.00 174.94 175.93 1pjs s ALA 78 N 1.22 3.31 -0.30 9.38 0.00 0.18 -1.39 121.76 134.16 1pjs s ALA 78 Ca -0.06 -1.48 0.11 0.00 0.00 0.00 0.00 51.96 50.53 1pjs s ALA 78 Cb -0.14 -3.46 0.47 0.00 0.00 0.00 0.00 23.12 19.99 1pjs s ALA 78 CO -0.02 -2.07 1.16 0.00 0.00 0.00 0.00 175.76 174.83 1pjs n ALA 79 N 6.58 4.44 -2.22 0.00 0.00 0.14 -1.55 120.51 127.91 1pjs n ALA 79 Ca -0.03 -3.59 -0.20 0.00 0.00 0.00 0.00 53.44 49.62 1pjs n ALA 79 Cb 0.46 -0.48 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 1pjs n ALA 79 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1pjs s THR 80 N -4.47 2.77 -0.27 0.00 -4.23 -1.18 -4.31 115.64 103.94 1pjs s THR 80 Ca 0.45 -1.31 0.13 0.00 -1.18 0.00 0.00 61.69 59.78 1pjs s THR 80 Cb 0.39 -3.02 0.80 0.00 1.34 0.00 0.00 72.50 72.02 1pjs s THR 80 CO 0.00 -0.01 1.76 -0.90 -0.54 0.00 0.00 174.62 174.92 1pjs n ASP 81 N -1.57 5.53 -4.22 3.99 5.68 -1.26 -4.79 116.55 119.91 1pjs n ASP 81 Ca 0.04 -2.99 -0.38 0.00 -0.50 0.00 0.00 54.79 50.96 1pjs n ASP 81 Cb 0.61 -0.70 -0.11 0.00 -1.14 0.00 0.00 41.12 39.78 1pjs n ASP 81 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1pjs s ASP 82 N -0.81 5.39 0.55 -1.12 -1.08 -1.26 -4.98 116.67 113.35 1pjs s ASP 82 Ca 0.54 -1.55 0.24 0.00 -0.52 0.00 0.00 52.55 51.27 1pjs s ASP 82 Cb 0.42 -1.89 1.46 0.00 -1.46 0.00 0.00 42.92 41.45 1pjs s ASP 82 CO 0.15 -0.47 2.08 0.44 0.52 0.00 0.00 175.17 177.90 1pjs h ASP 83 N 8.23 0.00 0.38 -0.34 3.32 -2.00 -1.90 116.42 124.11 1pjs h ASP 83 Ca -0.20 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.63 1pjs h ASP 83 Cb 1.07 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.62 1pjs h ASP 83 CO 0.69 0.00 -0.92 0.74 -1.72 0.00 0.00 179.24 178.03 1pjs h THR 84 N 0.00 1.42 -0.13 0.35 2.02 -1.99 -2.26 112.91 112.31 1pjs h THR 84 Ca 0.12 -2.46 -0.20 0.00 0.77 0.00 0.00 66.41 64.64 1pjs h THR 84 Cb 0.52 2.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1pjs h THR 84 CO -0.00 0.73 -0.73 0.58 0.37 0.00 0.00 175.52 176.47 1pjs h VAL 85 N 0.21 1.32 -0.55 3.16 2.07 -1.80 -2.45 116.25 118.22 1pjs h VAL 85 Ca -0.07 -2.01 -0.06 0.00 0.82 0.00 0.00 66.70 65.38 1pjs h VAL 85 Cb 1.55 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 33.29 1pjs h VAL 85 CO 0.16 0.62 0.11 0.78 0.02 0.00 0.00 177.57 179.26 1pjs h ASN 86 N 0.43 0.80 -0.82 0.57 2.35 -1.42 -1.74 115.58 115.76 1pjs h ASN 86 Ca -0.04 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1pjs h ASN 86 Cb 1.33 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.45 1pjs h ASN 86 CO 0.14 0.81 0.49 1.56 -1.65 0.00 0.00 177.43 178.77 1pjs h GLN 87 N 0.82 1.12 -0.04 0.81 1.08 -1.21 -0.42 115.11 117.27 1pjs h GLN 87 Ca 0.17 -0.10 -0.17 0.00 -1.45 0.00 0.00 58.65 57.10 1pjs h GLN 87 Cb 0.34 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 1pjs h GLN 87 CO 0.00 0.79 -0.73 -0.09 -0.95 0.00 0.00 178.83 177.85 1pjs h ARG 88 N 1.14 0.25 -0.27 1.46 2.43 -0.91 -1.29 114.38 117.19 1pjs h ARG 88 Ca 0.30 -0.21 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1pjs h ARG 88 Cb -0.03 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1pjs h ARG 88 CO -0.05 0.87 -0.09 0.28 -1.51 0.00 0.00 179.97 179.47 1pjs h VAL 89 N 0.16 1.29 -0.03 0.20 2.07 -0.77 -0.16 116.25 119.01 1pjs h VAL 89 Ca -0.03 -1.14 0.01 0.00 0.82 0.00 0.00 66.70 66.36 1pjs h VAL 89 Cb 1.30 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 1pjs h VAL 89 CO 0.11 0.36 -0.01 -1.28 0.02 0.00 0.00 177.57 176.77 1pjs h SER 90 N 0.29 -0.05 -0.89 0.57 0.87 -1.03 0.74 113.55 114.04 1pjs h SER 90 Ca 0.07 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1pjs h SER 90 Cb 0.58 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.53 1pjs h SER 90 CO 0.03 -0.02 0.52 0.44 -0.53 0.00 0.00 176.83 177.27 1pjs h ASP 91 N -0.01 1.09 0.49 6.23 3.45 -1.13 0.12 116.42 126.65 1pjs h ASP 91 Ca 0.02 -0.08 -0.09 0.00 0.43 0.00 0.00 57.03 57.31 1pjs h ASP 91 Cb 0.04 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.52 1pjs h ASP 91 CO -0.04 0.85 -0.44 0.00 -1.57 0.00 0.00 179.24 178.04 1pjs h ALA 92 N 1.28 1.22 0.05 3.45 0.00 -0.72 -1.86 119.26 122.68 1pjs h ALA 92 Ca 0.32 -0.40 -0.23 0.00 0.00 0.00 0.00 54.91 54.60 1pjs h ALA 92 Cb -0.02 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.72 1pjs h ALA 92 CO -0.06 0.55 -0.92 0.00 0.00 0.00 0.00 179.25 178.82 1pjs h ALA 93 N 1.56 0.04 -0.07 0.00 0.00 -0.02 -3.27 119.26 117.51 1pjs h ALA 93 Ca -0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 54.91 54.11 1pjs h ALA 93 Cb 0.80 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1pjs h ALA 93 CO 0.06 0.53 -0.50 1.49 0.00 0.00 0.00 179.25 180.83 1pjs h GLU 94 N 0.10 0.17 -0.40 0.00 4.22 -0.71 0.58 114.58 118.54 1pjs h GLU 94 Ca -0.13 -0.10 -0.06 0.00 0.08 0.00 0.00 59.36 59.15 1pjs h GLU 94 Cb 1.62 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.86 1pjs h GLU 94 CO 0.18 0.63 -0.01 0.66 -2.18 0.00 0.00 179.01 178.29 1pjs h SER 95 N 0.14 0.62 -0.61 1.04 4.64 -1.43 -2.61 113.55 115.34 1pjs h SER 95 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1pjs h SER 95 Cb 0.93 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1pjs h SER 95 CO 0.07 0.70 0.00 -2.11 -0.87 0.00 0.00 176.83 174.62 1pjs n ARG 96 N -4.24 4.53 -3.60 4.77 1.85 -1.13 -4.96 116.66 113.89 1pjs n ARG 96 Ca 0.02 -3.09 -0.21 0.00 -1.00 0.00 0.00 57.85 53.57 1pjs n ARG 96 Cb 0.28 -2.15 0.06 0.00 -1.05 0.00 0.00 32.46 29.60 1pjs n ARG 96 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1pjs n ARG 97 N 0.82 -6.08 -4.19 2.89 1.74 -0.98 -4.99 116.66 105.86 1pjs n ARG 97 Ca 0.27 0.74 -0.34 0.00 -0.77 0.00 0.00 57.85 57.75 1pjs n ARG 97 Cb 1.10 -5.58 -0.13 0.00 -1.02 0.00 0.00 32.46 26.82 1pjs n ARG 97 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1pjs s ILE 98 N -3.46 3.59 0.18 0.55 1.01 0.16 -5.02 121.20 118.20 1pjs s ILE 98 Ca 0.14 -0.44 -0.32 0.00 0.00 0.00 0.00 60.65 60.04 1pjs s ILE 98 Cb -0.07 -2.60 -0.11 0.00 0.01 0.00 0.00 42.46 39.69 1pjs s ILE 98 CO 0.77 0.45 1.74 -0.36 0.00 0.00 0.00 174.94 177.54 1pjs s PHE 99 N 0.95 2.68 0.01 3.97 0.40 -1.26 -4.27 117.98 120.46 1pjs s PHE 99 Ca -0.00 0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.62 1pjs s PHE 99 Cb -0.15 -4.13 -0.01 0.00 0.51 0.00 0.00 43.02 39.24 1pjs s PHE 99 CO 0.01 -4.39 -0.11 0.00 0.70 0.00 0.00 175.22 171.43 1pjs s ASN 101 N -0.59 3.95 -0.42 0.00 3.84 -0.40 -1.34 114.94 119.98 1pjs s ASN 101 Ca 0.02 -0.42 -0.16 0.00 0.21 0.00 0.00 52.86 52.51 1pjs s ASN 101 Cb -0.05 -1.64 0.02 0.00 -0.55 0.00 0.00 41.25 39.03 1pjs s ASN 101 CO 0.00 0.06 0.36 -0.69 -2.79 0.00 0.00 177.10 174.04 1pjs s VAL 102 N 0.99 5.19 -0.84 -5.21 1.01 -1.26 -0.64 120.40 119.63 1pjs s VAL 102 Ca -0.01 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 1pjs s VAL 102 Cb -0.15 -3.98 0.21 0.00 0.00 0.00 0.00 36.38 32.47 1pjs s VAL 102 CO -0.01 -0.36 0.74 -0.69 0.00 0.00 0.00 175.10 174.78 1pjs s VAL 103 N 1.87 4.96 0.11 2.92 1.01 -0.59 -2.71 120.40 127.97 1pjs s VAL 103 Ca 0.08 -3.02 0.00 0.00 0.00 0.00 0.00 61.98 59.04 1pjs s VAL 103 Cb -0.18 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.12 1pjs s VAL 103 CO 0.11 -1.03 0.00 -0.90 0.00 0.00 0.00 175.10 173.29 1pjs n ASP 104 N 3.32 -0.96 -4.19 3.32 5.68 -1.26 -4.71 116.55 117.75 1pjs n ASP 104 Ca 0.15 0.28 -0.40 0.00 -0.50 0.00 0.00 54.79 54.33 1pjs n ASP 104 Cb 0.41 1.14 -0.09 0.00 -1.14 0.00 0.00 41.12 41.44 1pjs n ASP 104 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pjs s ALA 105 N -2.00 3.32 0.45 2.12 0.00 -1.10 -5.01 121.76 119.55 1pjs s ALA 105 Ca 0.00 -2.50 0.14 0.00 0.00 0.00 0.00 51.96 49.60 1pjs s ALA 105 Cb 0.00 -2.71 1.06 0.00 0.00 0.00 0.00 23.12 21.48 1pjs s ALA 105 CO 0.00 -1.85 2.01 -1.00 0.00 0.00 0.00 175.76 174.91 1pjs h PRO 106 N 8.35 0.34 -0.56 0.00 0.13 -1.95 -3.03 132.00 135.28 1pjs h PRO 106 Ca -0.19 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1pjs h PRO 106 Cb 1.07 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1pjs h PRO 106 CO 0.81 0.23 0.00 0.36 -0.23 0.00 0.00 178.00 179.17 1pjs n LYS 107 N -4.47 2.82 0.06 0.86 2.85 -1.26 -4.30 118.16 114.72 1pjs n LYS 107 Ca 0.08 -2.40 -0.16 0.00 -1.05 0.00 0.00 58.31 54.78 1pjs n LYS 107 Cb 0.32 -1.44 -0.14 0.00 -0.65 0.00 0.00 35.03 33.12 1pjs n LYS 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1pjs h ALA 108 N 3.26 0.29 -1.07 0.58 0.00 -1.88 -3.48 119.26 116.95 1pjs h ALA 108 Ca 0.00 -1.11 -0.61 0.00 0.00 0.00 0.00 54.91 53.19 1pjs h ALA 108 Cb 0.89 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.84 1pjs h ALA 108 CO 0.01 1.15 -0.49 0.00 0.00 0.00 0.00 179.25 179.92 1pjs s ALA 109 N -2.62 3.81 0.21 0.00 0.00 -1.26 -5.04 121.76 116.86 1pjs s ALA 109 Ca -0.08 -1.49 -0.06 0.00 0.00 0.00 0.00 51.96 50.33 1pjs s ALA 109 Cb 0.07 -0.22 0.36 0.00 0.00 0.00 0.00 23.12 23.34 1pjs s ALA 109 CO 0.85 -0.16 1.18 0.43 0.00 0.00 0.00 175.76 178.06 1pjs n SER 110 N -1.29 -0.26 -4.04 0.00 7.64 -0.71 -4.74 113.62 110.22 1pjs n SER 110 Ca -0.07 1.31 -0.08 0.00 1.01 0.00 0.00 58.87 61.04 1pjs n SER 110 Cb 0.66 -0.40 -0.10 0.00 -1.01 0.00 0.00 64.21 63.36 1pjs n SER 110 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1pjs s PHE 111 N -5.94 0.42 -0.10 1.43 -0.71 -0.45 -4.82 117.98 107.82 1pjs s PHE 111 Ca -0.11 -0.90 -0.02 0.00 -1.04 0.00 0.00 56.93 54.85 1pjs s PHE 111 Cb 0.21 -0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.67 1pjs s PHE 111 CO 0.59 -0.37 -0.00 0.42 -1.34 0.00 0.00 175.22 174.52 1pjs s ILE 112 N -3.48 4.26 -0.37 -4.49 1.01 -1.26 -4.27 121.20 112.60 1pjs s ILE 112 Ca 0.03 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.24 1pjs s ILE 112 Cb 0.05 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.72 1pjs s ILE 112 CO -0.08 0.58 0.50 -0.32 0.00 0.00 0.00 174.94 175.62 1pjs s MET 113 N -0.67 3.49 0.73 2.79 -2.45 -1.26 -5.06 119.30 116.88 1pjs s MET 113 Ca 0.11 -0.31 -0.12 0.00 -1.25 0.00 0.00 55.69 54.12 1pjs s MET 113 Cb -0.12 -3.85 0.03 0.00 1.25 0.00 0.00 34.83 32.14 1pjs s MET 113 CO 0.02 -0.70 1.11 -1.25 1.05 0.00 0.00 175.02 175.25 1pjs s PRO 114 N 2.36 2.65 0.04 4.11 0.04 -1.26 -5.03 135.00 137.90 1pjs s PRO 114 Ca 0.17 0.45 -0.30 0.00 0.04 0.00 0.00 61.00 61.36 1pjs s PRO 114 Cb -0.16 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1pjs s PRO 114 CO 0.14 -1.18 1.07 -1.12 0.04 0.00 0.00 177.00 175.94 1pjs s SER 115 N -4.32 7.27 -0.06 6.66 0.01 -0.27 -4.85 113.70 118.13 1pjs s SER 115 Ca 0.59 1.82 0.01 0.00 1.31 0.00 0.00 55.95 59.68 1pjs s SER 115 Cb -0.12 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 1pjs s SER 115 CO 0.52 -0.32 -0.06 -0.63 0.41 0.00 0.00 173.24 173.16 1pjs s ILE 116 N 0.89 3.79 -0.30 1.44 1.01 -1.26 -1.15 121.20 125.63 1pjs s ILE 116 Ca 0.54 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.70 1pjs s ILE 116 Cb -0.25 -2.57 0.05 0.00 0.01 0.00 0.00 42.46 39.70 1pjs s ILE 116 CO 0.29 0.58 -0.01 -0.63 0.00 0.00 0.00 174.94 175.18 1pjs s ILE 117 N -0.84 2.99 -0.38 2.92 1.01 -0.08 -5.02 121.20 121.81 1pjs s ILE 117 Ca 0.13 -1.34 -0.15 0.00 0.00 0.00 0.00 60.65 59.29 1pjs s ILE 117 Cb -0.11 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.66 1pjs s ILE 117 CO 0.02 -0.08 0.31 -0.62 0.00 0.00 0.00 174.94 174.57 1pjs s ASP 118 N 1.26 6.11 -0.21 3.58 3.68 -1.26 -2.07 116.67 127.76 1pjs s ASP 118 Ca -0.05 -0.61 0.20 0.00 2.13 0.00 0.00 52.55 54.22 1pjs s ASP 118 Cb -0.19 -2.17 0.48 0.00 -1.45 0.00 0.00 42.92 39.59 1pjs s ASP 118 CO -0.01 -0.37 1.14 0.54 0.13 0.00 0.00 175.17 176.60 1pjs n ARG 119 N 5.23 1.76 -0.99 4.34 5.12 0.50 -5.04 116.66 127.58 1pjs n ARG 119 Ca -0.11 -3.34 -0.39 0.00 -1.93 0.00 0.00 57.85 52.08 1pjs n ARG 119 Cb 0.48 -1.44 -0.05 0.00 -1.16 0.00 0.00 32.46 30.29 1pjs n ARG 119 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1pjs n SER 120 N -0.45 -0.01 0.00 0.55 2.88 -1.26 -0.85 113.62 114.48 1pjs n SER 120 Ca 0.15 0.77 0.10 0.00 -1.33 0.00 0.00 58.87 58.55 1pjs n SER 120 Cb 0.89 -0.61 0.57 0.00 -0.75 0.00 0.00 64.21 64.32 1pjs n SER 120 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1pjs n PRO 121 N 0.99 0.57 -3.09 -1.46 -0.04 -1.26 -4.45 135.00 126.26 1pjs n PRO 121 Ca 0.13 0.02 -0.39 0.00 -0.04 0.00 0.00 63.50 63.21 1pjs n PRO 121 Cb 0.05 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.96 1pjs n PRO 121 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1pjs s LEU 122 N -2.08 4.29 -0.05 1.53 1.98 -0.03 -5.05 118.68 119.28 1pjs s LEU 122 Ca 0.28 1.10 -0.06 0.00 -2.89 0.00 0.00 54.13 52.56 1pjs s LEU 122 Cb 0.14 -3.00 0.01 0.00 0.66 0.00 0.00 46.19 43.99 1pjs s LEU 122 CO 0.24 -0.11 0.15 -0.04 -1.89 0.00 0.00 176.35 174.70 1pjs s MET 123 N 0.89 0.25 0.02 1.98 -1.94 -1.26 -0.37 119.30 118.86 1pjs s MET 123 Ca 0.35 0.09 0.07 0.00 -1.71 0.00 0.00 55.69 54.49 1pjs s MET 123 Cb -0.17 0.11 -0.02 0.00 2.01 0.00 0.00 34.83 36.76 1pjs s MET 123 CO 0.16 -0.04 -0.20 0.08 -0.01 0.00 0.00 175.02 175.01 1pjs s VAL 124 N -0.23 1.58 -0.01 -6.03 1.01 -0.88 -5.02 120.40 110.83 1pjs s VAL 124 Ca -0.03 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.94 1pjs s VAL 124 Cb -0.03 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.99 1pjs s VAL 124 CO 0.00 0.28 -0.10 0.00 0.00 0.00 0.00 175.10 175.29 1pjs s ALA 125 N -0.67 0.84 -0.02 5.51 0.00 -1.26 -0.90 121.76 125.27 1pjs s ALA 125 Ca 0.07 -0.45 0.05 0.00 0.00 0.00 0.00 51.96 51.63 1pjs s ALA 125 Cb -0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 1pjs s ALA 125 CO 0.01 0.20 -0.17 0.08 0.00 0.00 0.00 175.76 175.88 1pjs s VAL 126 N -0.26 1.36 0.00 0.00 1.01 -0.30 -4.96 120.40 117.24 1pjs s VAL 126 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1pjs s VAL 126 Cb -0.04 -1.14 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1pjs s VAL 126 CO -0.00 0.39 0.00 -0.24 0.00 0.00 0.00 175.10 175.24 1pjs n SER 127 N 2.80 0.14 -0.07 3.32 2.88 -1.26 -1.12 113.62 120.30 1pjs n SER 127 Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 1pjs n SER 127 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1pjs n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pjs n GLY 129 N 0.35 0.80 0.41 0.46 0.00 -1.26 -4.97 105.19 100.98 1pjs n GLY 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pjs n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pjs n GLY 130 N 0.00 0.51 0.14 -0.02 0.00 -1.26 -4.91 105.19 99.65 1pjs n GLY 130 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1pjs n GLY 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1pjs h THR 131 N 0.00 0.18 -3.11 2.61 1.35 -2.03 -3.45 112.91 108.46 1pjs h THR 131 Ca 0.00 -0.92 -0.55 0.00 -0.55 0.00 0.00 66.41 64.39 1pjs h THR 131 Cb 0.00 0.32 -0.40 0.00 -1.73 0.00 0.00 68.15 66.34 1pjs h THR 131 CO 0.00 0.05 -0.76 -0.55 -0.25 0.00 0.00 175.52 174.01 1pjs s SER 132 N -5.32 3.59 0.49 5.36 0.15 -1.26 -4.96 113.70 111.74 1pjs s SER 132 Ca -0.05 -1.32 0.24 0.00 0.70 0.00 0.00 55.95 55.51 1pjs s SER 132 Cb 0.00 -0.67 1.25 0.00 -1.71 0.00 0.00 66.02 64.89 1pjs s SER 132 CO 0.18 -0.39 2.01 1.55 1.20 0.00 0.00 173.24 177.79 1pjs h PRO 133 N 8.21 0.00 -0.39 5.44 0.13 -2.00 -1.95 132.00 141.43 1pjs h PRO 133 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1pjs h PRO 133 Cb 1.04 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1pjs h PRO 133 CO 0.42 0.17 0.25 0.28 -0.23 0.00 0.00 178.00 178.89 1pjs h VAL 134 N 0.00 1.11 -0.75 1.56 2.07 -2.00 -1.37 116.25 116.87 1pjs h VAL 134 Ca -0.00 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1pjs h VAL 134 Cb 0.41 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1pjs h VAL 134 CO 0.02 0.11 0.30 0.25 0.02 0.00 0.00 177.57 178.28 1pjs h LEU 135 N 0.52 1.04 -0.73 2.57 6.46 -1.79 -1.47 115.31 121.91 1pjs h LEU 135 Ca 0.14 -0.17 0.04 0.00 -0.12 0.00 0.00 57.88 57.77 1pjs h LEU 135 Cb -0.03 -0.27 -0.05 0.00 -0.73 0.00 0.00 40.66 39.58 1pjs h LEU 135 CO -0.03 0.92 0.45 0.00 -0.62 0.00 0.00 178.44 179.17 1pjs h ALA 136 N 1.15 0.97 -0.50 1.25 0.00 -0.99 -0.74 119.26 120.40 1pjs h ALA 136 Ca 0.25 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1pjs h ALA 136 Cb 0.21 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1pjs h ALA 136 CO -0.02 0.22 -0.11 0.00 0.00 0.00 0.00 179.25 179.34 1pjs h ARG 137 N 0.87 0.93 -0.78 0.00 3.08 -0.93 -0.19 114.38 117.36 1pjs h ARG 137 Ca 0.30 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1pjs h ARG 137 Cb 0.06 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1pjs h ARG 137 CO -0.13 0.99 0.50 -0.07 -1.07 0.00 0.00 179.97 180.19 1pjs h LEU 138 N 0.83 0.90 -0.05 3.04 3.38 -0.50 -0.44 115.31 122.49 1pjs h LEU 138 Ca 0.13 -0.03 -0.20 0.00 0.09 0.00 0.00 57.88 57.87 1pjs h LEU 138 Cb 0.65 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.18 1pjs h LEU 138 CO 0.04 0.67 -0.74 -0.07 0.09 0.00 0.00 178.44 178.43 1pjs h LEU 139 N 1.06 0.73 -0.39 1.67 3.38 -0.78 -2.63 115.31 118.35 1pjs h LEU 139 Ca 0.28 -0.71 0.04 0.00 0.09 0.00 0.00 57.88 57.58 1pjs h LEU 139 Cb -0.10 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.39 1pjs h LEU 139 CO -0.06 1.34 0.16 -0.09 0.09 0.00 0.00 178.44 179.88 1pjs h ARG 140 N 0.19 0.32 -0.26 1.13 2.43 -0.69 0.54 114.38 118.05 1pjs h ARG 140 Ca -0.08 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1pjs h ARG 140 Cb 1.41 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.85 1pjs h ARG 140 CO 0.15 0.21 0.02 1.49 -1.51 0.00 0.00 179.97 180.33 1pjs h GLU 141 N 0.33 0.10 -0.27 0.20 4.81 -1.11 0.18 114.58 118.81 1pjs h GLU 141 Ca 0.17 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.32 1pjs h GLU 141 Cb 0.13 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1pjs h GLU 141 CO -0.16 0.07 -0.15 0.87 -0.73 0.00 0.00 179.01 178.91 1pjs h LYS 142 N 0.10 0.47 0.00 1.92 1.79 -1.06 -2.78 116.57 117.02 1pjs h LYS 142 Ca 0.12 -0.14 -0.20 0.00 -2.18 0.00 0.00 60.65 58.25 1pjs h LYS 142 Cb 0.14 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1pjs h LYS 142 CO -0.19 0.61 -0.89 -0.07 -1.08 0.00 0.00 179.45 177.83 1pjs h LEU 143 N 0.43 0.31 -0.62 2.94 3.38 -0.27 -3.02 115.31 118.46 1pjs h LEU 143 Ca 0.08 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 1pjs h LEU 143 Cb 0.52 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1pjs h LEU 143 CO 0.03 1.05 0.06 -0.33 0.09 0.00 0.00 178.44 179.34 1pjs h GLU 144 N 0.13 1.06 0.00 1.13 4.39 -0.52 -2.03 114.58 118.74 1pjs h GLU 144 Ca -0.05 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.32 1pjs h GLU 144 Cb 1.52 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 30.06 1pjs h GLU 144 CO 0.14 1.01 -0.11 0.66 -1.16 0.00 0.00 179.01 179.55 1pjs h SER 145 N 0.97 0.00 0.75 1.42 4.64 -1.52 -3.12 113.55 116.69 1pjs h SER 145 Ca 0.18 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.41 1pjs h SER 145 Cb 0.49 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.57 1pjs h SER 145 CO 0.02 0.11 -1.31 0.18 -0.87 0.00 0.00 176.83 174.95 1pjs n LEU 146 N -3.24 0.77 -4.46 5.97 4.77 -1.04 -4.65 117.00 115.12 1pjs n LEU 146 Ca 0.01 0.32 -0.43 0.00 -0.03 0.00 0.00 56.01 55.87 1pjs n LEU 146 Cb 0.38 0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.40 1pjs n LEU 146 CO 0.30 0.00 0.02 -0.76 -1.33 0.00 0.00 177.39 175.63 1pjs s LEU 147 N -5.50 5.06 0.53 2.23 1.43 -0.79 -4.98 118.68 116.66 1pjs s LEU 147 Ca -0.02 -0.85 -0.21 0.00 -1.03 0.00 0.00 54.13 52.02 1pjs s LEU 147 Cb 0.09 -2.26 -0.07 0.00 0.03 0.00 0.00 46.19 43.98 1pjs s LEU 147 CO 0.81 -0.53 0.93 -0.81 0.23 0.00 0.00 176.35 176.98 1pjs n PRO 148 N 5.37 1.04 -0.30 1.29 -0.04 -1.26 -4.87 135.00 136.22 1pjs n PRO 148 Ca -0.10 0.39 0.14 0.00 -0.04 0.00 0.00 63.50 63.89 1pjs n PRO 148 Cb 0.47 -2.07 0.31 0.00 -0.04 0.00 0.00 33.50 32.16 1pjs n PRO 148 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1pjs h GLN 149 N 0.86 0.22 -0.65 0.54 5.75 -1.97 -2.34 115.11 117.52 1pjs h GLN 149 Ca -0.47 -0.01 -0.32 0.00 -0.15 0.00 0.00 58.65 57.70 1pjs h GLN 149 Cb 1.36 -0.05 -0.19 0.00 1.07 0.00 0.00 27.48 29.67 1pjs h GLN 149 CO 0.53 0.14 0.26 0.72 -2.65 0.00 0.00 178.83 177.83 1pjs n HIS 150 N -5.21 2.02 0.06 3.99 8.25 -1.26 -4.56 115.22 118.50 1pjs n HIS 150 Ca 0.22 -1.67 0.05 0.00 -0.26 0.00 0.00 57.72 56.07 1pjs n HIS 150 Cb 0.71 -0.70 0.48 0.00 1.12 0.00 0.00 29.99 31.61 1pjs n HIS 150 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1pjs h LEU 151 N 1.12 0.35 -1.73 2.41 7.12 -1.74 -1.73 115.31 121.11 1pjs h LEU 151 Ca 0.40 -0.01 -0.02 0.00 0.13 0.00 0.00 57.88 58.38 1pjs h LEU 151 Cb 2.22 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 42.26 1pjs h LEU 151 CO 0.71 0.25 -0.03 1.23 -0.13 0.00 0.00 178.44 180.47 1pjs h GLY 152 N 0.41 0.14 0.91 3.75 0.00 -1.76 -2.75 103.07 103.77 1pjs h GLY 152 Ca 0.12 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.41 1pjs h GLY 152 CO -0.03 0.06 0.46 1.46 0.00 0.00 0.00 176.54 178.49 1pjs h GLN 153 N 0.13 0.88 0.00 4.80 1.08 -1.56 -1.32 115.11 119.12 1pjs h GLN 153 Ca 0.03 -0.05 -0.14 0.00 -1.45 0.00 0.00 58.65 57.04 1pjs h GLN 153 Cb 0.14 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1pjs h GLN 153 CO 0.01 0.58 -0.65 -0.39 -0.95 0.00 0.00 178.83 177.43 1pjs h VAL 154 N 0.91 1.13 -0.45 -0.54 -1.51 -1.61 -1.68 116.25 112.49 1pjs h VAL 154 Ca 0.28 -2.55 -0.04 0.00 -1.23 0.00 0.00 66.70 63.16 1pjs h VAL 154 Cb -0.02 2.53 -0.02 0.00 -2.13 0.00 0.00 31.29 31.65 1pjs h VAL 154 CO -0.09 0.64 0.13 0.00 -1.23 0.00 0.00 177.57 177.02 1pjs h ALA 155 N 1.35 0.59 -0.28 5.19 0.00 -1.19 -0.99 119.26 123.94 1pjs h ALA 155 Ca -0.01 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1pjs h ALA 155 Cb 1.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1pjs h ALA 155 CO 0.08 0.25 -0.42 -0.09 0.00 0.00 0.00 179.25 179.08 1pjs h ARG 156 N 0.59 0.68 -0.03 0.00 9.65 -1.20 -3.23 114.38 120.84 1pjs h ARG 156 Ca 0.14 -0.36 -0.14 0.00 -1.10 0.00 0.00 59.98 58.52 1pjs h ARG 156 Cb 0.28 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.86 1pjs h ARG 156 CO -0.00 0.97 -0.63 -0.92 2.80 0.00 0.00 179.97 182.18 1pjs h TYR 157 N 0.55 0.16 -1.15 2.20 3.20 -1.08 -3.28 116.97 117.58 1pjs h TYR 157 Ca 0.04 -0.07 0.38 0.00 3.14 0.00 0.00 58.73 62.22 1pjs h TYR 157 Cb 0.96 -0.03 -0.13 0.00 1.54 0.00 0.00 36.73 39.06 1pjs h TYR 157 CO 0.05 0.72 0.71 0.00 -1.64 0.00 0.00 178.16 178.00 1pjs h ALA 158 N 1.26 2.38 -0.93 1.82 0.00 -1.20 0.29 119.26 122.88 1pjs h ALA 158 Ca -0.01 0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1pjs h ALA 158 Cb 1.13 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 1pjs h ALA 158 CO 0.09 -0.99 0.57 0.78 0.00 0.00 0.00 179.25 179.70 1pjs h GLY 159 N 0.19 1.46 -0.58 0.00 0.00 -1.77 -1.36 103.07 101.01 1pjs h GLY 159 Ca 0.77 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1pjs h GLY 159 CO -0.49 0.18 0.00 -1.06 0.00 0.00 0.00 176.54 175.17 1pjs n GLN 160 N -4.65 0.95 0.00 4.80 6.02 0.09 -3.30 117.38 121.30 1pjs n GLN 160 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1pjs n GLN 160 Cb 0.29 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.27 1pjs n GLN 160 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1pjs n LEU 161 N -0.20 0.00 -0.24 1.08 4.77 -0.58 -4.87 117.00 116.97 1pjs n LEU 161 Ca 0.00 -0.05 0.04 0.00 -0.03 0.00 0.00 56.01 55.97 1pjs n LEU 161 Cb 0.14 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.38 1pjs n LEU 161 CO 0.00 0.00 0.86 -0.09 -1.33 0.00 0.00 177.39 176.83 1pjs h ARG 162 N 0.00 0.15 0.41 3.23 2.43 -1.37 -0.00 114.38 119.23 1pjs h ARG 162 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1pjs h ARG 162 Cb 0.00 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1pjs h ARG 162 CO 0.00 0.10 -0.20 0.00 -1.51 0.00 0.00 179.97 178.36 1pjs h ALA 163 N 1.64 -0.55 -0.35 2.80 0.00 -1.89 -2.23 119.26 118.68 1pjs h ALA 163 Ca 0.39 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.25 1pjs h ALA 163 Cb 0.68 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1pjs h ALA 163 CO -0.58 -0.77 0.25 -0.09 0.00 0.00 0.00 179.25 178.07 1pjs h ARG 164 N -0.64 0.02 -0.23 0.00 2.43 -1.70 -1.75 114.38 112.51 1pjs h ARG 164 Ca -0.06 -0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.95 1pjs h ARG 164 Cb 0.47 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1pjs h ARG 164 CO 0.09 0.01 -0.48 0.28 -1.51 0.00 0.00 179.97 178.36 1pjs h VAL 165 N 0.02 1.30 0.00 0.20 2.07 -0.70 -2.66 116.25 116.48 1pjs h VAL 165 Ca 0.17 -1.69 -0.05 0.00 0.82 0.00 0.00 66.70 65.94 1pjs h VAL 165 Cb 0.64 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1pjs h VAL 165 CO -0.00 0.54 -0.26 0.11 0.02 0.00 0.00 177.57 177.97 1pjs h LYS 166 N 0.45 0.00 0.10 1.57 1.57 -0.74 -1.09 116.57 118.43 1pjs h LYS 166 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 1pjs h LYS 166 Cb 1.09 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.41 1pjs h LYS 166 CO 0.11 0.26 -0.67 -0.22 -0.57 0.00 0.00 179.45 178.36 1pjs h LYS 167 N 0.00 0.28 0.00 3.15 3.64 -1.27 -3.35 116.57 119.02 1pjs h LYS 167 Ca -0.00 -0.43 -0.05 0.00 -1.27 0.00 0.00 60.65 58.90 1pjs h LYS 167 Cb 0.64 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 1pjs h LYS 167 CO 0.03 1.18 -0.89 1.96 -2.27 0.00 0.00 179.45 179.46 1pjs h GLN 168 N -0.41 0.00 -4.72 1.90 4.20 -1.49 -3.43 115.11 111.17 1pjs h GLN 168 Ca -0.11 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 57.92 1pjs h GLN 168 Cb 1.49 0.00 -0.36 0.00 0.30 0.00 0.00 27.48 28.91 1pjs h GLN 168 CO 0.13 0.11 -0.71 -0.06 -0.67 0.00 0.00 178.83 177.63 1pjs s PHE 169 N -3.20 3.48 -2.56 2.96 2.99 -0.41 -4.98 117.98 116.26 1pjs s PHE 169 Ca 0.01 -2.45 0.24 0.00 0.00 0.00 0.00 56.93 54.73 1pjs s PHE 169 Cb 0.08 -2.51 0.57 0.00 0.00 0.00 0.00 43.02 41.16 1pjs s PHE 169 CO 0.77 -0.90 1.47 0.00 -0.00 0.00 0.00 175.22 176.56 1pjs n ALA 170 N 4.45 2.49 -3.17 5.36 0.00 -1.26 -4.36 120.51 124.01 1pjs n ALA 170 Ca -0.06 -0.69 -0.32 0.00 0.00 0.00 0.00 53.44 52.36 1pjs n ALA 170 Cb 0.42 -0.97 -0.16 0.00 0.00 0.00 0.00 19.45 18.74 1pjs n ALA 170 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1pjs s THR 171 N -1.79 2.38 0.29 0.00 -1.32 -1.26 -5.02 115.64 108.92 1pjs s THR 171 Ca 0.34 -0.91 0.03 0.00 -1.21 0.00 0.00 61.69 59.95 1pjs s THR 171 Cb 0.20 -1.94 0.32 0.00 -1.51 0.00 0.00 72.50 69.57 1pjs s THR 171 CO 0.30 0.55 1.64 -0.03 -2.21 0.00 0.00 174.62 174.87 1pjs h MET 172 N 6.70 0.20 -0.34 7.08 1.85 -2.00 0.35 114.93 128.78 1pjs h MET 172 Ca -0.21 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.87 1pjs h MET 172 Cb 1.23 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 33.20 1pjs h MET 172 CO 0.50 0.13 0.22 0.78 -0.40 0.00 0.00 176.91 178.14 1pjs h GLY 173 N 0.21 0.47 0.95 1.39 0.00 -1.99 -1.56 103.07 102.54 1pjs h GLY 173 Ca 0.57 -0.18 -0.17 0.00 0.00 0.00 0.00 47.33 47.56 1pjs h GLY 173 CO -0.66 0.17 -0.57 0.83 0.00 0.00 0.00 176.54 176.31 1pjs h GLU 174 N 0.46 0.59 0.00 4.80 5.08 -0.73 -2.88 114.58 121.90 1pjs h GLU 174 Ca 0.12 -0.48 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 1pjs h GLU 174 Cb -0.05 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1pjs h GLU 174 CO -0.03 1.11 -0.33 0.00 -1.00 0.00 0.00 179.01 178.76 1pjs h ARG 175 N 0.23 0.00 -0.01 2.33 3.08 -0.96 -2.00 114.38 117.05 1pjs h ARG 175 Ca -0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1pjs h ARG 175 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 1pjs h ARG 175 CO 0.12 0.33 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.23 1pjs h ARG 176 N 0.00 0.04 -0.52 0.04 2.43 -1.30 -2.56 114.38 112.51 1pjs h ARG 176 Ca -0.00 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.26 1pjs h ARG 176 Cb 0.65 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 1pjs h ARG 176 CO 0.04 0.58 0.36 0.00 -1.51 0.00 0.00 179.97 179.45 1pjs h ARG 177 N -0.50 0.16 0.51 0.20 3.08 -1.29 -0.05 114.38 116.49 1pjs h ARG 177 Ca 0.00 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1pjs h ARG 177 Cb 0.58 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1pjs h ARG 177 CO 0.01 0.10 -0.24 0.35 -1.07 0.00 0.00 179.97 179.12 1pjs h PHE 178 N 0.16 -0.63 -0.56 3.04 3.57 -1.12 -2.03 116.94 119.37 1pjs h PHE 178 Ca 0.25 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.79 1pjs h PHE 178 Cb 0.75 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 1pjs h PHE 178 CO -0.00 -0.35 0.37 -1.49 -2.23 0.00 0.00 178.31 174.61 1pjs h TRP 179 N -0.77 0.52 -0.54 0.41 -0.00 -0.74 0.28 115.95 115.11 1pjs h TRP 179 Ca -0.07 0.01 -0.04 0.00 -0.00 0.00 0.00 58.89 58.79 1pjs h TRP 179 Cb 0.56 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 29.52 1pjs h TRP 179 CO -0.02 0.28 0.16 0.93 -0.00 0.00 0.00 178.44 179.79 1pjs h GLU 180 N 0.52 0.81 0.16 0.49 5.08 -0.82 0.14 114.58 120.96 1pjs h GLU 180 Ca 0.24 -0.15 -0.29 0.00 -1.00 0.00 0.00 59.36 58.16 1pjs h GLU 180 Cb 0.29 -0.13 0.03 0.00 0.50 0.00 0.00 28.75 29.44 1pjs h GLU 180 CO -0.07 0.71 -1.24 -0.22 -1.00 0.00 0.00 179.01 177.19 1pjs h LYS 181 N 0.79 0.57 -0.63 2.33 3.64 -0.33 -3.28 116.57 119.65 1pjs h LYS 181 Ca 0.18 -0.82 -0.05 0.00 -1.27 0.00 0.00 60.65 58.70 1pjs h LYS 181 Cb 0.25 0.28 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1pjs h LYS 181 CO -0.01 1.38 0.22 0.35 -2.27 0.00 0.00 179.45 179.12 1pjs h PHE 182 N 0.16 1.00 0.00 1.91 3.57 -0.29 -3.03 116.94 120.26 1pjs h PHE 182 Ca -0.20 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1pjs h PHE 182 Cb 1.94 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 40.38 1pjs h PHE 182 CO 0.13 0.81 0.00 1.19 -2.23 0.00 0.00 178.31 178.21 1pjs n PHE 183 N -4.39 0.00 -0.15 0.41 3.01 0.46 -2.55 117.46 114.26 1pjs n PHE 183 Ca 0.04 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.54 1pjs n PHE 183 Cb 0.20 -0.38 0.11 0.00 -0.01 0.00 0.00 39.48 39.40 1pjs n PHE 183 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1pjs n VAL 184 N -1.38 1.03 -2.69 -4.37 0.24 -1.16 -4.89 118.33 105.12 1pjs n VAL 184 Ca 0.09 -1.03 -0.42 0.00 -2.04 0.00 0.00 64.34 60.94 1pjs n VAL 184 Cb 0.22 0.48 -0.03 0.00 -1.47 0.00 0.00 33.84 33.04 1pjs n VAL 184 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1pjs s ASN 185 N -1.04 6.43 0.29 -1.34 3.84 -1.06 -4.83 114.94 117.24 1pjs s ASN 185 Ca 0.17 -1.36 0.10 0.00 0.21 0.00 0.00 52.86 51.97 1pjs s ASN 185 Cb 0.09 -2.51 0.43 0.00 -0.55 0.00 0.00 41.25 38.71 1pjs s ASN 185 CO 0.11 -1.45 1.66 0.44 -2.79 0.00 0.00 177.10 175.07 1pjs h ASP 186 N 9.57 0.03 -0.53 -4.21 3.32 -1.90 -2.82 116.42 119.88 1pjs h ASP 186 Ca 0.04 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 1pjs h ASP 186 Cb 1.03 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 1pjs h ASP 186 CO 1.29 0.58 0.15 0.03 -1.72 0.00 0.00 179.24 179.58 1pjs h ARG 187 N 0.02 0.84 -0.46 3.56 3.08 -2.00 -1.11 114.38 118.31 1pjs h ARG 187 Ca -0.00 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 1pjs h ARG 187 Cb 0.99 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 1pjs h ARG 187 CO 0.07 0.78 0.12 1.25 -1.07 0.00 0.00 179.97 181.12 1pjs h LEU 188 N 0.74 0.69 -1.01 3.04 5.85 -1.92 -0.56 115.31 122.13 1pjs h LEU 188 Ca 0.17 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.69 1pjs h LEU 188 Cb 0.30 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.09 1pjs h LEU 188 CO -0.00 0.74 0.66 0.00 -0.34 0.00 0.00 178.44 179.50 1pjs h ALA 189 N 0.98 1.32 -0.09 1.25 0.00 -1.25 -1.03 119.26 120.45 1pjs h ALA 189 Ca 0.14 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1pjs h ALA 189 Cb 0.31 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1pjs h ALA 189 CO 0.00 0.59 -0.05 1.96 0.00 0.00 0.00 179.25 181.75 1pjs h GLN 190 N 1.31 0.20 -0.74 0.00 1.08 -0.95 -2.18 115.11 113.82 1pjs h GLN 190 Ca 0.39 -0.09 0.09 0.00 -1.45 0.00 0.00 58.65 57.59 1pjs h GLN 190 Cb -0.05 -0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.31 1pjs h GLN 190 CO -0.11 0.57 0.40 0.77 -0.95 0.00 0.00 178.83 179.51 1pjs h SER 191 N -0.18 0.56 -0.55 1.46 0.02 -0.76 0.35 113.55 114.45 1pjs h SER 191 Ca 0.02 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1pjs h SER 191 Cb 0.51 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1pjs h SER 191 CO 0.01 0.33 0.08 -0.07 -1.14 0.00 0.00 176.83 176.04 1pjs h LEU 192 N 0.69 0.91 -1.12 5.07 3.38 -1.16 0.80 115.31 123.88 1pjs h LEU 192 Ca 0.36 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1pjs h LEU 192 Cb 0.33 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1pjs h LEU 192 CO -0.24 0.93 -0.04 0.00 0.09 0.00 0.00 178.44 179.18 1pjs h ALA 193 N 1.18 1.00 0.00 1.53 0.00 -0.46 -2.70 119.26 119.81 1pjs h ALA 193 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1pjs h ALA 193 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1pjs h ALA 193 CO 0.01 0.05 -0.86 0.09 0.00 0.00 0.00 179.25 178.54 1pjs n ASN 194 N -3.13 0.63 -3.12 0.00 3.02 0.11 -4.96 115.26 107.80 1pjs n ASN 194 Ca 0.01 -0.24 -0.15 0.00 -0.03 0.00 0.00 54.58 54.18 1pjs n ASN 194 Cb 0.37 0.61 0.08 0.00 -0.61 0.00 0.00 39.78 40.23 1pjs n ASN 194 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pjs n ALA 195 N -1.73 -1.74 -3.31 5.41 0.00 0.20 -4.93 120.51 114.41 1pjs n ALA 195 Ca 0.03 -0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 1pjs n ALA 195 Cb 0.41 -2.28 -0.01 0.00 0.00 0.00 0.00 19.45 17.57 1pjs n ALA 195 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1pjs n ASP 196 N -2.84 5.47 -0.33 0.00 -0.08 -0.74 -4.93 116.55 113.10 1pjs n ASP 196 Ca -0.24 -3.17 0.18 0.00 -1.51 0.00 0.00 54.79 50.04 1pjs n ASP 196 Cb 0.64 -1.27 0.42 0.00 2.34 0.00 0.00 41.12 43.26 1pjs n ASP 196 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1pjs h GLU 197 N 6.10 0.55 -0.32 -0.67 4.81 -1.92 -0.73 114.58 122.41 1pjs h GLU 197 Ca 0.18 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.21 1pjs h GLU 197 Cb 0.78 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 1pjs h GLU 197 CO 1.07 0.36 -0.46 0.87 -0.73 0.00 0.00 179.01 180.12 1pjs h LYS 198 N 0.57 0.85 -0.03 1.92 1.57 -1.99 -1.82 116.57 117.63 1pjs h LYS 198 Ca 0.58 -0.48 -0.15 0.00 -1.87 0.00 0.00 60.65 58.73 1pjs h LYS 198 Cb 1.19 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1pjs h LYS 198 CO -0.35 1.12 -0.65 0.00 -0.57 0.00 0.00 179.45 179.00 1pjs h ALA 199 N 0.80 0.85 -0.45 3.86 0.00 -1.79 0.60 119.26 123.12 1pjs h ALA 199 Ca 0.04 -0.58 -0.10 0.00 0.00 0.00 0.00 54.91 54.27 1pjs h ALA 199 Cb 1.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1pjs h ALA 199 CO 0.10 0.78 -0.11 0.28 0.00 0.00 0.00 179.25 180.30 1pjs h VAL 200 N 0.10 1.26 0.01 0.00 2.07 -1.07 0.34 116.25 118.96 1pjs h VAL 200 Ca -0.01 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 1pjs h VAL 200 Cb 1.16 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1pjs h VAL 200 CO 0.09 0.41 -0.11 0.78 0.02 0.00 0.00 177.57 178.76 1pjs h ASN 201 N 0.73 0.09 -0.80 0.57 2.35 -1.08 -1.46 115.58 115.98 1pjs h ASN 201 Ca 0.12 -0.85 0.10 0.00 -0.55 0.00 0.00 56.30 55.12 1pjs h ASN 201 Cb 0.60 -0.03 -0.05 0.00 0.05 0.00 0.00 38.32 38.89 1pjs h ASN 201 CO 0.04 0.92 0.52 0.00 -1.65 0.00 0.00 177.43 177.26 1pjs h ALA 202 N 0.17 1.76 0.00 -0.83 0.00 0.30 -0.05 119.26 120.61 1pjs h ALA 202 Ca -0.02 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1pjs h ALA 202 Cb 0.95 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1pjs h ALA 202 CO 0.02 0.08 -0.88 1.15 0.00 0.00 0.00 179.25 179.62 1pjs h THR 203 N 0.73 0.42 -0.09 0.00 2.02 -0.39 -3.01 112.91 112.59 1pjs h THR 203 Ca 0.37 -1.70 -0.12 0.00 0.77 0.00 0.00 66.41 65.73 1pjs h THR 203 Cb 0.45 2.02 0.01 0.00 -1.74 0.00 0.00 68.15 68.88 1pjs h THR 203 CO -0.14 0.24 -0.43 0.74 0.37 0.00 0.00 175.52 176.30 1pjs h THR 204 N 0.00 1.39 -0.41 3.16 2.02 -0.19 -3.06 112.91 115.81 1pjs h THR 204 Ca -0.06 -1.79 -0.13 0.00 0.77 0.00 0.00 66.41 65.21 1pjs h THR 204 Cb 1.32 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 69.96 1pjs h THR 204 CO 0.03 0.53 -0.25 -0.33 0.37 0.00 0.00 175.52 175.87 1pjs h GLU 205 N 0.01 0.86 0.00 6.66 4.39 -1.17 -2.11 114.58 123.22 1pjs h GLU 205 Ca -0.03 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1pjs h GLU 205 Cb 1.08 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1pjs h GLU 205 CO 0.09 1.01 0.00 -0.09 -1.16 0.00 0.00 179.01 178.86 1pjs h ARG 206 N 0.73 0.00 0.04 2.33 2.43 -1.58 1.25 114.38 119.59 1pjs h ARG 206 Ca 0.09 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 59.04 1pjs h ARG 206 Cb 0.80 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 1pjs h ARG 206 CO 0.07 0.00 -1.01 -0.07 -1.51 0.00 0.00 179.97 177.45 1pjs h LEU 207 N 0.00 0.32 0.00 3.80 3.38 -1.27 -2.94 115.31 118.60 1pjs h LEU 207 Ca 0.00 -0.29 -0.20 0.00 0.09 0.00 0.00 57.88 57.47 1pjs h LEU 207 Cb 0.18 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1pjs h LEU 207 CO 0.00 1.15 -1.81 0.49 0.09 0.00 0.00 178.44 178.35 1pjs n PHE 208 N -3.60 0.53 0.51 1.13 3.01 -0.31 -4.39 117.46 114.35 1pjs n PHE 208 Ca -0.05 0.18 0.13 0.00 1.01 0.00 0.00 57.45 58.72 1pjs n PHE 208 Cb 0.89 -0.97 0.35 0.00 -0.01 0.00 0.00 39.48 39.75 1pjs n PHE 208 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1pjs h SER 209 N 0.00 0.00 -2.16 4.37 0.87 0.14 -3.46 113.55 113.31 1pjs h SER 209 Ca -0.25 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 59.83 1pjs h SER 209 Cb 1.70 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.64 1pjs h SER 209 CO 0.04 0.00 -0.46 -1.83 -0.53 0.00 0.00 176.83 174.05 1pjs s GLU 210 N -3.14 3.23 0.44 2.24 -1.05 -1.11 -5.02 118.70 114.29 1pjs s GLU 210 Ca 0.09 -0.89 -0.25 0.00 -0.15 0.00 0.00 54.97 53.78 1pjs s GLU 210 Cb 0.10 -2.77 -0.09 0.00 -0.44 0.00 0.00 34.13 30.94 1pjs s GLU 210 CO 0.61 0.39 1.23 -2.30 0.95 0.00 0.00 175.26 176.14 1pjs n PRO 211 N -1.34 1.78 -0.19 -4.83 -0.02 -1.26 -4.88 135.00 124.26 1pjs n PRO 211 Ca -0.08 0.64 -0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1pjs n PRO 211 Cb 0.57 -2.34 0.09 0.00 -0.02 0.00 0.00 33.50 31.81 1pjs n PRO 211 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1pjs h LEU 212 N 1.89 -0.08 0.00 2.45 5.85 -1.94 -1.27 115.31 122.20 1pjs h LEU 212 Ca -0.48 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.36 1pjs h LEU 212 Cb 1.30 0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.51 1pjs h LEU 212 CO 0.59 -0.02 0.00 0.47 -0.34 0.00 0.00 178.44 179.13 1pjs n ASP 213 N -5.17 0.00 -4.76 1.25 8.00 -1.26 -4.79 116.55 109.82 1pjs n ASP 213 Ca 0.08 -1.64 -0.36 0.00 0.71 0.00 0.00 54.79 53.58 1pjs n ASP 213 Cb 0.31 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.33 1pjs n ASP 213 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1pjs s HIS 214 N -2.00 3.37 -0.31 1.24 3.76 -0.48 -4.95 115.29 115.92 1pjs s HIS 214 Ca 0.10 0.32 0.19 0.00 -0.15 0.00 0.00 55.06 55.51 1pjs s HIS 214 Cb 0.04 -1.91 0.47 0.00 1.11 0.00 0.00 32.58 32.30 1pjs s HIS 214 CO 0.07 0.53 1.02 0.54 -0.85 0.00 0.00 174.74 176.05 1pjs n ARG 215 N 2.33 1.53 -1.67 1.40 3.00 0.66 -4.82 116.66 119.09 1pjs n ARG 215 Ca -0.19 -3.43 -0.42 0.00 -0.01 0.00 0.00 57.85 53.80 1pjs n ARG 215 Cb 0.54 -1.45 -0.03 0.00 0.00 0.00 0.00 32.46 31.52 1pjs n ARG 215 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1pjs s GLY 216 N -3.38 1.41 -0.15 -0.13 0.00 -0.84 -2.78 107.32 101.44 1pjs s GLY 216 Ca 0.29 1.38 -0.34 0.00 0.00 0.00 0.00 44.72 46.05 1pjs s GLY 216 CO 0.00 3.38 1.20 -1.83 0.00 0.00 0.00 173.10 175.85 1pjs s GLU 217 N 3.90 0.36 -0.06 2.90 -1.05 -1.05 -4.51 118.70 119.19 1pjs s GLU 217 Ca 0.86 -0.14 0.03 0.00 -0.15 0.00 0.00 54.97 55.57 1pjs s GLU 217 Cb -0.44 0.16 0.00 0.00 -0.44 0.00 0.00 34.13 33.41 1pjs s GLU 217 CO 0.40 -0.16 -0.16 0.08 0.95 0.00 0.00 175.26 176.38 1pjs s VAL 218 N -2.47 1.36 -0.12 1.83 1.01 -0.87 -0.37 120.40 120.77 1pjs s VAL 218 Ca 0.10 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1pjs s VAL 218 Cb -0.00 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1pjs s VAL 218 CO -0.05 0.40 -0.12 -0.69 0.00 0.00 0.00 175.10 174.64 1pjs s VAL 219 N 0.35 1.35 -0.20 2.92 1.01 0.92 -1.57 120.40 125.18 1pjs s VAL 219 Ca -0.10 -0.52 -0.20 0.00 0.00 0.00 0.00 61.98 61.17 1pjs s VAL 219 Cb -0.14 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 1pjs s VAL 219 CO 0.04 0.42 0.57 -0.76 0.00 0.00 0.00 175.10 175.37 1pjs s LEU 220 N 1.36 4.14 -0.10 3.92 1.02 -0.52 -0.08 118.68 128.42 1pjs s LEU 220 Ca 0.00 0.75 0.03 0.00 0.02 0.00 0.00 54.13 54.93 1pjs s LEU 220 Cb -0.13 -2.80 0.01 0.00 0.02 0.00 0.00 46.19 43.29 1pjs s LEU 220 CO -0.06 -0.23 -0.18 -0.69 0.02 0.00 0.00 176.35 175.21 1pjs s VAL 221 N 1.80 1.62 -0.35 -1.59 1.01 0.05 -0.23 120.40 122.71 1pjs s VAL 221 Ca 0.26 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 1pjs s VAL 221 Cb -0.16 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1pjs s VAL 221 CO 0.10 0.46 1.02 -0.83 0.00 0.00 0.00 175.10 175.86 1pjs s GLY 222 N 0.68 1.54 0.37 4.51 0.00 0.06 -0.78 107.32 113.70 1pjs s GLY 222 Ca -0.13 -0.24 0.20 0.00 0.00 0.00 0.00 44.72 44.55 1pjs s GLY 222 CO 0.03 2.18 1.65 0.00 0.00 0.00 0.00 173.10 176.96 1pjs h ALA 223 N 8.34 0.88 0.00 3.20 0.00 -0.20 -3.39 119.26 128.09 1pjs h ALA 223 Ca -0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1pjs h ALA 223 Cb 1.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1pjs h ALA 223 CO 1.02 0.42 0.00 0.41 0.00 0.00 0.00 179.25 181.10 1pjs n GLY 224 N 0.66 0.67 0.00 0.00 0.00 -0.92 -4.11 105.19 101.50 1pjs n GLY 224 Ca 0.01 -1.94 0.04 0.00 0.00 0.00 0.00 46.02 44.13 1pjs n GLY 224 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pjs n PRO 225 N 0.98 0.00 0.00 1.61 -0.04 -1.21 -1.68 135.00 134.66 1pjs n PRO 225 Ca 0.00 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1pjs n PRO 225 Cb 0.00 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 1pjs n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pjs n GLY 226 N -0.65 1.91 3.64 0.55 0.00 -1.26 -4.77 105.19 104.61 1pjs n GLY 226 Ca 0.02 -0.17 -0.46 0.00 0.00 0.00 0.00 46.02 45.41 1pjs n GLY 226 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pjs n ASP 227 N 0.00 3.52 0.10 1.61 -0.08 -1.25 -4.58 116.55 115.87 1pjs n ASP 227 Ca 0.00 0.75 0.19 0.00 -1.51 0.00 0.00 54.79 54.22 1pjs n ASP 227 Cb 0.00 -1.45 0.76 0.00 2.34 0.00 0.00 41.12 42.77 1pjs n ASP 227 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1pjs h ALA 228 N 11.10 2.12 0.00 -1.67 0.00 -1.91 0.13 119.26 129.03 1pjs h ALA 228 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1pjs h ALA 228 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1pjs h ALA 228 CO 0.95 -0.53 0.00 0.78 0.00 0.00 0.00 179.25 180.45 1pjs h GLY 229 N 0.00 0.00 -0.36 0.00 0.00 -1.96 -2.77 103.07 97.99 1pjs h GLY 229 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1pjs h GLY 229 CO -0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1pjs n LEU 230 N -2.86 1.34 -4.77 3.11 4.32 0.46 -4.84 117.00 113.76 1pjs n LEU 230 Ca 0.01 -0.47 -0.35 0.00 -0.02 0.00 0.00 56.01 55.17 1pjs n LEU 230 Cb 0.26 -0.02 0.01 0.00 -1.62 0.00 0.00 43.42 42.05 1pjs n LEU 230 CO 0.24 0.24 0.78 -0.22 -1.22 0.00 0.00 177.39 177.21 1pjs s LEU 231 N -1.90 3.68 0.49 2.23 2.96 -1.05 -4.48 118.68 120.62 1pjs s LEU 231 Ca 0.38 2.16 -0.08 0.00 -0.22 0.00 0.00 54.13 56.37 1pjs s LEU 231 Cb 0.20 -4.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.27 1pjs s LEU 231 CO 0.32 -1.31 0.83 0.42 -1.32 0.00 0.00 176.35 175.29 1pjs s THR 232 N -1.85 4.84 0.20 3.68 -4.23 -1.26 -4.94 115.64 112.07 1pjs s THR 232 Ca 0.72 0.44 -0.10 0.00 -1.18 0.00 0.00 61.69 61.57 1pjs s THR 232 Cb -0.24 -3.83 0.12 0.00 1.34 0.00 0.00 72.50 69.89 1pjs s THR 232 CO 0.30 -0.82 1.78 -0.07 -0.54 0.00 0.00 174.62 175.27 1pjs h LEU 233 N 0.38 0.93 -0.63 4.79 4.07 -1.95 -1.05 115.31 121.85 1pjs h LEU 233 Ca -0.46 -0.13 -0.07 0.00 0.08 0.00 0.00 57.88 57.29 1pjs h LEU 233 Cb 1.20 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.67 1pjs h LEU 233 CO 0.62 0.80 0.12 0.50 -1.08 0.00 0.00 178.44 179.40 1pjs h LYS 234 N 0.99 1.04 -0.66 1.13 3.64 -1.94 -0.51 116.57 120.26 1pjs h LYS 234 Ca 0.24 -0.27 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1pjs h LYS 234 Cb 0.12 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1pjs h LYS 234 CO -0.03 0.96 0.44 0.78 -2.27 0.00 0.00 179.45 179.32 1pjs h GLY 235 N 0.95 0.90 0.83 5.01 0.00 -1.77 0.25 103.07 109.24 1pjs h GLY 235 Ca 0.19 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.10 1pjs h GLY 235 CO 0.01 0.27 -0.36 -2.00 0.00 0.00 0.00 176.54 174.45 1pjs h LEU 236 N 0.78 0.55 -0.67 3.11 6.46 -0.68 -1.67 115.31 123.20 1pjs h LEU 236 Ca 0.27 -0.59 0.05 0.00 -0.12 0.00 0.00 57.88 57.49 1pjs h LEU 236 Cb 0.08 -0.16 -0.05 0.00 -0.73 0.00 0.00 40.66 39.80 1pjs h LEU 236 CO -0.07 1.04 0.39 1.56 -0.62 0.00 0.00 178.44 180.73 1pjs h GLN 237 N 0.09 0.70 -0.52 1.25 4.20 -0.24 -0.25 115.11 120.34 1pjs h GLN 237 Ca -0.01 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 1pjs h GLN 237 Cb 0.98 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 1pjs h GLN 237 CO 0.08 0.47 0.07 1.96 -0.67 0.00 0.00 178.83 180.73 1pjs h GLN 238 N 0.73 0.88 -0.14 1.46 1.08 -0.52 -2.87 115.11 115.72 1pjs h GLN 238 Ca 0.29 -0.24 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 1pjs h GLN 238 Cb 0.14 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 1pjs h GLN 238 CO -0.16 0.87 -0.18 0.82 -0.95 0.00 0.00 178.83 179.22 1pjs h ILE 239 N 0.76 1.20 0.00 2.54 2.04 -0.68 -2.22 117.51 121.15 1pjs h ILE 239 Ca 0.16 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1pjs h ILE 239 Cb 0.43 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1pjs h ILE 239 CO 0.01 0.28 0.00 0.00 0.00 0.00 0.00 178.15 178.45 1pjs n GLN 240 N -4.22 0.21 -0.08 2.37 6.02 -0.16 -3.25 117.38 118.27 1pjs n GLN 240 Ca -0.01 0.01 0.05 0.00 -0.01 0.00 0.00 57.00 57.05 1pjs n GLN 240 Cb 0.31 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.16 1pjs n GLN 240 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1pjs n GLN 241 N -1.39 1.65 -2.53 -1.09 1.13 -0.86 -4.78 117.38 109.51 1pjs n GLN 241 Ca 0.10 -1.55 -0.36 0.00 -1.94 0.00 0.00 57.00 53.25 1pjs n GLN 241 Cb 0.28 -1.22 -0.04 0.00 0.11 0.00 0.00 30.24 29.37 1pjs n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1pjs s ALA 242 N -0.92 3.08 -0.12 -1.58 0.00 -1.04 -4.91 121.76 116.27 1pjs s ALA 242 Ca 0.16 0.71 0.15 0.00 0.00 0.00 0.00 51.96 52.98 1pjs s ALA 242 Cb 0.10 -3.28 -0.24 0.00 0.00 0.00 0.00 23.12 19.70 1pjs s ALA 242 CO 0.13 -0.23 0.37 -0.25 0.00 0.00 0.00 175.76 175.78 1pjs n ASP 243 N -0.09 0.51 -3.71 0.00 8.00 -0.71 -4.77 116.55 115.78 1pjs n ASP 243 Ca 0.05 0.21 -0.13 0.00 0.71 0.00 0.00 54.79 55.63 1pjs n ASP 243 Cb 0.50 0.41 -0.13 0.00 -0.02 0.00 0.00 41.12 41.87 1pjs n ASP 243 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1pjs s ILE 244 N -2.55 -0.16 -0.23 0.53 2.07 -1.14 -0.73 121.20 118.99 1pjs s ILE 244 Ca -0.08 0.19 -0.05 0.00 -1.41 0.00 0.00 60.65 59.30 1pjs s ILE 244 Cb 0.07 -0.40 -0.01 0.00 0.13 0.00 0.00 42.46 42.25 1pjs s ILE 244 CO 0.82 0.08 -0.01 -0.69 -1.91 0.00 0.00 174.94 173.23 1pjs s VAL 245 N 1.64 3.58 -0.35 4.00 1.01 0.10 -0.98 120.40 129.40 1pjs s VAL 245 Ca -0.06 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.33 1pjs s VAL 245 Cb -0.11 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 1pjs s VAL 245 CO -0.09 0.37 0.23 -0.69 0.00 0.00 0.00 175.10 174.93 1pjs s VAL 246 N 1.50 5.11 0.17 2.92 1.01 0.16 -0.95 120.40 130.32 1pjs s VAL 246 Ca 0.05 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1pjs s VAL 246 Cb -0.15 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 1pjs s VAL 246 CO -0.02 -0.07 -0.05 -0.72 0.00 0.00 0.00 175.10 174.24 1pjs s TYR 247 N 1.68 1.30 0.42 5.22 -0.85 -0.62 -0.61 117.35 123.90 1pjs s TYR 247 Ca 0.05 -0.86 0.02 0.00 -0.52 0.00 0.00 57.07 55.75 1pjs s TYR 247 Cb -0.18 -0.71 0.02 0.00 0.38 0.00 0.00 41.96 41.47 1pjs s TYR 247 CO 0.09 -0.02 0.13 -0.40 -1.52 0.00 0.00 175.55 173.83 1pjs n ASP 248 N -0.25 2.84 0.22 -0.18 5.68 -1.25 -1.12 116.55 122.50 1pjs n ASP 248 Ca -0.08 -2.68 0.09 0.00 -0.50 0.00 0.00 54.79 51.61 1pjs n ASP 248 Cb 0.62 0.16 0.51 0.00 -1.14 0.00 0.00 41.12 41.27 1pjs n ASP 248 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1pjs h ARG 249 N 0.00 0.00 0.00 0.11 9.65 -1.93 -2.95 114.38 119.26 1pjs h ARG 249 Ca -0.32 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 1pjs h ARG 249 Cb 1.03 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.61 1pjs h ARG 249 CO 0.51 0.24 0.00 1.28 2.80 0.00 0.00 179.97 184.81 1pjs n LEU 250 N -3.61 0.00 -4.64 3.80 4.77 -1.26 -4.60 117.00 111.47 1pjs n LEU 250 Ca -0.01 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.58 1pjs n LEU 250 Cb 0.38 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.39 1pjs n LEU 250 CO 0.34 0.00 0.17 -0.69 -1.33 0.00 0.00 177.39 175.87 1pjs s VAL 251 N -2.00 5.13 0.91 4.08 1.01 -1.12 -4.54 120.40 123.87 1pjs s VAL 251 Ca 0.17 0.79 -0.11 0.00 0.00 0.00 0.00 61.98 62.83 1pjs s VAL 251 Cb 0.08 -3.78 0.14 0.00 0.00 0.00 0.00 36.38 32.82 1pjs s VAL 251 CO 0.13 0.16 1.12 -0.55 0.00 0.00 0.00 175.10 175.96 1pjs s SER 252 N 1.35 3.11 -0.01 3.32 0.15 -1.26 -4.89 113.70 115.48 1pjs s SER 252 Ca 0.20 1.97 -0.25 0.00 0.70 0.00 0.00 55.95 58.56 1pjs s SER 252 Cb -0.15 -2.49 -0.19 0.00 -1.71 0.00 0.00 66.02 61.48 1pjs s SER 252 CO 0.09 -2.94 1.28 0.44 1.20 0.00 0.00 173.24 173.31 1pjs h ASP 253 N -1.76 -0.09 -0.95 5.45 3.32 -1.94 -1.92 116.42 118.53 1pjs h ASP 253 Ca -0.46 -0.35 0.13 0.00 0.02 0.00 0.00 57.03 56.37 1pjs h ASP 253 Cb 1.27 0.02 -0.09 0.00 0.22 0.00 0.00 39.33 40.75 1pjs h ASP 253 CO 0.46 0.32 0.57 0.44 -1.72 0.00 0.00 179.24 179.31 1pjs h ASP 254 N -0.53 0.79 -0.65 6.45 3.32 -1.94 -0.45 116.42 123.42 1pjs h ASP 254 Ca -0.01 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1pjs h ASP 254 Cb 0.44 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 1pjs h ASP 254 CO 0.02 0.39 0.34 0.40 -1.72 0.00 0.00 179.24 178.67 1pjs h ILE 255 N 0.86 1.21 0.00 0.35 1.08 -1.77 -2.89 117.51 116.36 1pjs h ILE 255 Ca 0.49 -0.56 -0.07 0.00 -0.39 0.00 0.00 64.86 64.34 1pjs h ILE 255 Cb 0.57 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 1pjs h ILE 255 CO -0.30 0.24 -0.33 0.24 -0.69 0.00 0.00 178.15 177.31 1pjs h MET 256 N 0.90 0.00 0.00 2.37 2.86 -0.30 -2.48 114.93 118.28 1pjs h MET 256 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1pjs h MET 256 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1pjs h MET 256 CO -0.03 0.33 0.00 0.09 1.06 0.00 0.00 176.91 178.35 1pjs n ASN 257 N -3.84 0.64 0.05 1.22 3.02 -0.65 -1.12 115.26 114.59 1pjs n ASN 257 Ca -0.01 0.67 0.13 0.00 -0.03 0.00 0.00 54.58 55.34 1pjs n ASN 257 Cb 0.40 -0.80 0.34 0.00 -0.61 0.00 0.00 39.78 39.11 1pjs n ASN 257 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1pjs n LEU 258 N -2.22 0.58 -4.72 3.41 4.77 -0.93 -4.85 117.00 113.03 1pjs n LEU 258 Ca 0.02 0.35 -0.34 0.00 -0.03 0.00 0.00 56.01 56.01 1pjs n LEU 258 Cb 0.21 -0.29 0.10 0.00 -2.33 0.00 0.00 43.42 41.10 1pjs n LEU 258 CO 0.18 -0.06 0.79 -0.69 -1.33 0.00 0.00 177.39 176.28 1pjs s VAL 259 N -3.09 2.31 -1.81 4.08 1.01 -0.27 -4.63 120.40 117.99 1pjs s VAL 259 Ca 0.10 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.30 1pjs s VAL 259 Cb 0.15 -2.67 0.19 0.00 0.00 0.00 0.00 36.38 34.05 1pjs s VAL 259 CO 0.64 -0.09 0.99 -1.14 0.00 0.00 0.00 175.10 175.50 1pjs n ARG 260 N -2.86 0.20 -1.67 2.72 0.63 -1.25 -4.97 116.66 109.46 1pjs n ARG 260 Ca 0.13 0.07 -0.01 0.00 -0.92 0.00 0.00 57.85 57.12 1pjs n ARG 260 Cb 0.50 -1.50 -0.01 0.00 0.45 0.00 0.00 32.46 31.90 1pjs n ARG 260 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1pjs n ARG 261 N -1.10 -1.21 -3.49 -0.14 1.74 -1.26 -4.73 116.66 106.48 1pjs n ARG 261 Ca 0.05 1.27 -0.20 0.00 -0.77 0.00 0.00 57.85 58.21 1pjs n ARG 261 Cb 0.04 -1.92 0.06 0.00 -1.02 0.00 0.00 32.46 29.62 1pjs n ARG 261 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1pjs n ASP 262 N 0.44 -3.68 -4.19 0.55 9.92 -1.26 -4.99 116.55 113.35 1pjs n ASP 262 Ca -0.08 -0.76 -0.32 0.00 -0.53 0.00 0.00 54.79 53.09 1pjs n ASP 262 Cb 0.13 -4.58 -0.17 0.00 -0.64 0.00 0.00 41.12 35.86 1pjs n ASP 262 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1pjs s ALA 263 N -3.48 2.18 0.35 2.24 0.00 -1.26 -5.06 121.76 116.73 1pjs s ALA 263 Ca 0.21 -1.02 -0.27 0.00 0.00 0.00 0.00 51.96 50.88 1pjs s ALA 263 Cb -0.04 -0.90 -0.09 0.00 0.00 0.00 0.00 23.12 22.08 1pjs s ALA 263 CO 0.78 0.11 1.21 -0.51 0.00 0.00 0.00 175.76 177.34 1pjs s ASP 264 N 0.61 6.75 -0.12 0.00 1.01 0.09 -4.80 116.67 120.21 1pjs s ASP 264 Ca -0.12 2.46 -0.00 0.00 0.71 0.00 0.00 52.55 55.60 1pjs s ASP 264 Cb -0.17 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.12 1pjs s ASP 264 CO 0.03 -0.52 -0.12 -0.13 0.21 0.00 0.00 175.17 174.64 1pjs s ARG 265 N -1.94 3.29 -0.27 8.23 0.52 -1.26 0.00 118.95 127.52 1pjs s ARG 265 Ca 0.52 -0.66 0.02 0.00 -0.52 0.00 0.00 55.73 55.09 1pjs s ARG 265 Cb -0.34 -2.64 0.07 0.00 0.52 0.00 0.00 34.95 32.56 1pjs s ARG 265 CO 0.45 0.29 -0.05 0.08 0.02 0.00 0.00 175.30 176.09 1pjs s VAL 266 N 0.16 1.91 -0.34 3.52 1.01 -0.13 -4.97 120.40 121.55 1pjs s VAL 266 Ca -0.06 -1.64 -0.28 0.00 0.00 0.00 0.00 61.98 60.00 1pjs s VAL 266 Cb -0.15 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.08 1pjs s VAL 266 CO 0.04 -0.21 1.04 0.12 0.00 0.00 0.00 175.10 176.10 1pjs s PHE 267 N 1.19 3.10 -0.55 5.22 5.36 -1.26 -1.59 117.98 129.45 1pjs s PHE 267 Ca -0.03 1.05 0.14 0.00 -0.96 0.00 0.00 56.93 57.14 1pjs s PHE 267 Cb -0.19 -3.74 0.45 0.00 -0.34 0.00 0.00 43.02 39.20 1pjs s PHE 267 CO -0.07 -0.82 1.37 1.33 -1.46 0.00 0.00 175.22 175.57 1pjs n VAL 268 N 5.98 1.72 -1.61 3.12 0.24 -0.27 -4.98 118.33 122.53 1pjs n VAL 268 Ca 0.11 -1.46 -0.29 0.00 -2.04 0.00 0.00 64.34 60.66 1pjs n VAL 268 Cb 0.47 0.09 0.15 0.00 -1.47 0.00 0.00 33.84 33.08 1pjs n VAL 268 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1pjs s GLY 269 N -1.46 1.61 -0.81 7.63 0.00 -1.24 -3.96 107.32 109.09 1pjs s GLY 269 Ca 0.35 -0.71 -0.26 0.00 0.00 0.00 0.00 44.72 44.10 1pjs s GLY 269 CO 0.13 -0.09 1.50 0.54 0.00 0.00 0.00 173.10 175.18 1pjs s LYS 270 N -5.44 3.13 0.18 2.90 1.02 -1.26 -4.43 119.74 115.83 1pjs s LYS 270 Ca 0.66 -0.33 -0.31 0.00 0.02 0.00 0.00 55.97 56.01 1pjs s LYS 270 Cb -0.12 -4.63 -0.10 0.00 -0.52 0.00 0.00 37.83 32.47 1pjs s LYS 270 CO 0.53 -2.40 1.48 1.03 -0.92 0.00 0.00 175.35 175.07 1pjs s ARG 271 N 5.91 4.26 -0.11 1.68 3.00 -1.26 -3.71 118.95 128.72 1pjs s ARG 271 Ca 0.48 2.27 0.00 0.00 0.00 0.00 0.00 55.73 58.47 1pjs s ARG 271 Cb -0.07 -3.16 0.00 0.00 0.00 0.00 0.00 34.95 31.72 1pjs s ARG 271 CO 0.08 -0.50 0.00 0.00 0.00 0.00 0.00 175.30 174.88 1pjs n ALA 272 N 3.43 -0.02 0.00 2.13 0.00 -1.26 -0.67 120.51 124.12 1pjs n ALA 272 Ca 0.11 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1pjs n ALA 272 Cb 0.40 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1pjs n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pjs n GLY 273 N 0.15 2.99 0.73 0.00 0.00 -1.24 -4.95 105.19 102.86 1pjs n GLY 273 Ca -0.01 -0.89 0.07 0.00 0.00 0.00 0.00 46.02 45.18 1pjs n GLY 273 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pjs n TYR 274 N 0.00 0.72 -1.79 1.61 4.02 0.16 -4.84 117.16 117.04 1pjs n TYR 274 Ca 0.00 -1.04 0.04 0.00 -0.01 0.00 0.00 57.90 56.89 1pjs n TYR 274 Cb 0.00 -0.30 0.07 0.00 -0.02 0.00 0.00 39.34 39.08 1pjs n TYR 274 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1pjs n HIS 275 N -0.85 0.00 -1.51 -0.72 8.25 -1.03 -4.96 115.22 114.40 1pjs n HIS 275 Ca 0.22 -0.54 -0.43 0.00 -0.26 0.00 0.00 57.72 56.71 1pjs n HIS 275 Cb 0.85 -0.12 -0.00 0.00 1.12 0.00 0.00 29.99 31.84 1pjs n HIS 275 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pjs s VAL 277 N -1.29 4.40 0.54 0.00 1.01 -1.25 -5.01 120.40 118.79 1pjs s VAL 277 Ca 0.62 1.69 -0.22 0.00 0.00 0.00 0.00 61.98 64.07 1pjs s VAL 277 Cb -0.65 -4.10 -0.06 0.00 0.00 0.00 0.00 36.38 31.58 1pjs s VAL 277 CO 0.58 -0.16 1.26 -0.81 0.00 0.00 0.00 175.10 175.97 1pjs n PRO 278 N 6.54 1.55 -0.25 2.72 -0.04 -1.26 -4.82 135.00 139.44 1pjs n PRO 278 Ca 0.13 0.57 0.03 0.00 -0.04 0.00 0.00 63.50 64.19 1pjs n PRO 278 Cb 0.45 -2.45 0.15 0.00 -0.04 0.00 0.00 33.50 31.61 1pjs n PRO 278 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1pjs h GLN 279 N 1.33 0.57 -0.64 0.54 5.75 -1.99 -2.48 115.11 118.19 1pjs h GLN 279 Ca -0.50 -0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.01 1pjs h GLN 279 Cb 1.32 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.70 1pjs h GLN 279 CO 0.56 0.38 0.42 1.05 -2.65 0.00 0.00 178.83 178.59 1pjs h GLU 280 N 0.59 0.71 -0.14 1.69 -0.00 -1.99 0.16 114.58 115.60 1pjs h GLU 280 Ca 0.37 -0.04 -0.15 0.00 -0.00 0.00 0.00 59.36 59.54 1pjs h GLU 280 Cb 0.43 -0.16 -0.01 0.00 -0.00 0.00 0.00 28.75 29.02 1pjs h GLU 280 CO -0.30 0.47 -0.55 0.93 -0.00 0.00 0.00 179.01 179.56 1pjs h GLU 281 N 0.73 0.43 -0.32 1.06 5.08 -1.82 0.19 114.58 119.93 1pjs h GLU 281 Ca 0.26 -0.27 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1pjs h GLU 281 Cb 0.13 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1pjs h GLU 281 CO -0.07 0.87 -0.21 0.82 -1.00 0.00 0.00 179.01 179.42 1pjs h ILE 282 N 0.33 1.29 -0.25 3.13 2.04 -1.03 -1.81 117.51 121.22 1pjs h ILE 282 Ca 0.00 -1.35 0.02 0.00 1.00 0.00 0.00 64.86 64.54 1pjs h ILE 282 Cb 1.07 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1pjs h ILE 282 CO 0.10 0.44 0.11 0.78 0.00 0.00 0.00 178.15 179.57 1pjs h ASN 283 N 0.47 0.14 -0.77 1.72 2.35 -0.48 -2.75 115.58 116.27 1pjs h ASN 283 Ca 0.06 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1pjs h ASN 283 Cb 0.76 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.09 1pjs h ASN 283 CO 0.06 0.12 0.43 1.56 -1.65 0.00 0.00 177.43 177.94 1pjs h GLN 284 N 0.23 1.06 -0.09 0.81 1.08 -0.50 -2.05 115.11 115.66 1pjs h GLN 284 Ca 0.10 -0.12 -0.11 0.00 -1.45 0.00 0.00 58.65 57.07 1pjs h GLN 284 Cb 0.05 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 1pjs h GLN 284 CO -0.09 0.78 -0.45 -0.84 -0.95 0.00 0.00 178.83 177.29 1pjs h ILE 285 N 1.06 1.33 -0.42 2.54 3.07 -1.22 0.94 117.51 124.81 1pjs h ILE 285 Ca 0.27 -1.60 -0.05 0.00 1.55 0.00 0.00 64.86 65.03 1pjs h ILE 285 Cb 0.02 1.76 -0.02 0.00 -0.27 0.00 0.00 36.82 38.31 1pjs h ILE 285 CO -0.04 0.47 0.09 -0.07 -1.05 0.00 0.00 178.15 177.55 1pjs h LEU 286 N 0.17 0.66 -0.16 0.16 3.38 -1.22 0.15 115.31 118.44 1pjs h LEU 286 Ca 0.01 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.63 1pjs h LEU 286 Cb 0.86 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1pjs h LEU 286 CO 0.07 0.73 -0.32 0.25 0.09 0.00 0.00 178.44 179.27 1pjs h LEU 287 N 0.55 0.56 0.47 1.67 6.46 -1.06 -2.81 115.31 121.15 1pjs h LEU 287 Ca 0.13 -0.55 -0.02 0.00 -0.12 0.00 0.00 57.88 57.32 1pjs h LEU 287 Cb 0.35 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.11 1pjs h LEU 287 CO 0.00 1.01 -0.28 -0.09 -0.62 0.00 0.00 178.44 178.46 1pjs h ARG 288 N 0.14 -0.69 0.00 1.25 2.43 0.11 -0.69 114.38 116.94 1pjs h ARG 288 Ca 0.01 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1pjs h ARG 288 Cb 0.91 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1pjs h ARG 288 CO 0.07 -0.46 -0.08 0.93 -1.51 0.00 0.00 179.97 178.92 1pjs h GLU 289 N -0.71 0.00 0.12 0.20 3.07 -0.81 -1.74 114.58 114.71 1pjs h GLU 289 Ca -0.05 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.53 1pjs h GLU 289 Cb 0.58 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.50 1pjs h GLU 289 CO 0.06 0.08 -1.22 0.00 -1.40 0.00 0.00 179.01 176.53 1pjs h ALA 290 N 1.92 0.10 -0.00 3.43 0.00 -1.29 -1.95 119.26 121.46 1pjs h ALA 290 Ca -0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 54.91 54.05 1pjs h ALA 290 Cb 0.44 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1pjs h ALA 290 CO 0.01 0.88 -0.10 1.96 0.00 0.00 0.00 179.25 182.01 1pjs h GLN 291 N 0.13 0.00 0.00 0.00 4.20 -0.29 0.20 115.11 119.35 1pjs h GLN 291 Ca -0.15 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1pjs h GLN 291 Cb 1.92 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.70 1pjs h GLN 291 CO 0.21 0.10 0.00 1.63 -0.67 0.00 0.00 178.83 180.10 1pjs n LYS 292 N -4.42 0.94 -0.56 1.46 5.02 -0.78 -4.87 118.16 114.95 1pjs n LYS 292 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1pjs n LYS 292 Cb 0.17 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1pjs n LYS 292 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pjs n GLY 293 N 0.78 0.68 3.85 0.72 0.00 0.69 -4.88 105.19 107.04 1pjs n GLY 293 Ca 0.18 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1pjs n GLY 293 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pjs s LYS 294 N -0.85 3.82 -0.69 1.61 1.02 -0.74 0.24 119.74 124.16 1pjs s LYS 294 Ca 0.00 0.28 -0.27 0.00 0.02 0.00 0.00 55.97 56.00 1pjs s LYS 294 Cb 0.00 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.22 1pjs s LYS 294 CO 0.00 0.64 1.26 0.50 -0.92 0.00 0.00 175.35 176.83 1pjs s ARG 295 N -1.43 3.29 -0.20 1.68 3.52 -1.12 -2.51 118.95 122.18 1pjs s ARG 295 Ca 0.27 -0.07 -0.15 0.00 -0.13 0.00 0.00 55.73 55.65 1pjs s ARG 295 Cb -0.15 -4.13 -0.04 0.00 -1.56 0.00 0.00 34.95 29.07 1pjs s ARG 295 CO 0.15 -2.01 0.38 0.08 -0.81 0.00 0.00 175.30 173.08 1pjs s VAL 296 N 5.54 5.22 -0.22 7.11 1.01 0.50 -1.74 120.40 137.81 1pjs s VAL 296 Ca 0.38 0.66 -0.03 0.00 0.00 0.00 0.00 61.98 62.99 1pjs s VAL 296 Cb -0.08 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1pjs s VAL 296 CO 0.18 0.27 -0.07 -0.69 0.00 0.00 0.00 175.10 174.79 1pjs s VAL 297 N 1.24 3.10 -0.56 2.92 1.01 -0.15 -0.05 120.40 127.91 1pjs s VAL 297 Ca 0.18 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 1pjs s VAL 297 Cb -0.15 -2.42 0.08 0.00 0.00 0.00 0.00 36.38 33.90 1pjs s VAL 297 CO 0.07 0.41 0.68 -0.60 0.00 0.00 0.00 175.10 175.67 1pjs s ARG 298 N 1.43 3.08 -0.55 2.72 6.06 0.88 -0.67 118.95 131.90 1pjs s ARG 298 Ca 0.05 -1.13 -0.24 0.00 -2.50 0.00 0.00 55.73 51.90 1pjs s ARG 298 Cb -0.14 -4.20 0.04 0.00 0.06 0.00 0.00 34.95 30.71 1pjs s ARG 298 CO -0.05 -1.42 0.96 -0.51 -2.50 0.00 0.00 175.30 171.78 1pjs s LEU 299 N 2.71 4.05 0.06 -0.88 1.43 0.22 -0.77 118.68 125.50 1pjs s LEU 299 Ca 0.13 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1pjs s LEU 299 Cb -0.22 -2.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 1pjs s LEU 299 CO 0.09 -1.25 0.15 -0.54 0.23 0.00 0.00 176.35 175.03 1pjs s LYS 300 N 4.03 3.21 0.24 1.70 -0.14 0.04 -3.85 119.74 124.98 1pjs s LYS 300 Ca 0.31 -0.53 -0.30 0.00 -1.36 0.00 0.00 55.97 54.10 1pjs s LYS 300 Cb -0.12 -2.92 -0.09 0.00 -1.68 0.00 0.00 37.83 33.02 1pjs s LYS 300 CO 0.20 0.60 1.16 0.20 -0.76 0.00 0.00 175.35 176.74 1pjs s GLY 301 N -2.41 2.90 0.00 -3.33 0.00 -1.26 0.07 107.32 103.29 1pjs s GLY 301 Ca 0.32 0.95 0.00 0.00 0.00 0.00 0.00 44.72 45.99 1pjs s GLY 301 CO 0.25 1.69 0.00 0.61 0.00 0.00 0.00 173.10 175.64 1pjs n GLY 302 N 1.58 3.75 3.42 0.20 0.00 -0.68 -4.60 105.19 108.87 1pjs n GLY 302 Ca 0.01 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1pjs n GLY 302 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pjs s ASP 303 N -4.00 3.88 0.39 1.61 -1.08 -1.26 -2.17 116.67 114.05 1pjs s ASP 303 Ca 0.00 -0.27 0.10 0.00 -0.52 0.00 0.00 52.55 51.86 1pjs s ASP 303 Cb 0.00 -1.02 0.89 0.00 -1.46 0.00 0.00 42.92 41.34 1pjs s ASP 303 CO 0.00 0.29 1.95 -0.65 0.52 0.00 0.00 175.17 177.28 1pjs h PRO 304 N 5.77 0.57 -0.50 4.34 0.11 -1.86 -3.13 132.00 137.29 1pjs h PRO 304 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1pjs h PRO 304 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pjs h PRO 304 CO 0.51 0.37 0.00 1.19 -0.21 0.00 0.00 178.00 179.86 1pjs n PHE 305 N -4.49 1.48 -3.78 0.65 0.99 -1.26 -2.54 117.46 108.51 1pjs n PHE 305 Ca 0.12 -0.72 -0.29 0.00 -0.00 0.00 0.00 57.45 56.56 1pjs n PHE 305 Cb 0.34 -0.34 -0.13 0.00 -1.00 0.00 0.00 39.48 38.35 1pjs n PHE 305 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1pjs s ILE 306 N -2.38 1.84 -0.92 4.37 1.01 -1.19 -4.84 121.20 119.09 1pjs s ILE 306 Ca 0.48 -2.98 -0.03 0.00 0.00 0.00 0.00 60.65 58.12 1pjs s ILE 306 Cb 0.35 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.55 1pjs s ILE 306 CO 0.17 -0.90 0.39 0.49 0.00 0.00 0.00 174.94 175.08 1pjs n PHE 307 N 3.19 -1.22 -2.73 3.97 0.99 -1.26 -4.79 117.46 115.61 1pjs n PHE 307 Ca 0.10 0.34 -0.07 0.00 -0.00 0.00 0.00 57.45 57.82 1pjs n PHE 307 Cb 0.35 -3.12 0.05 0.00 -1.00 0.00 0.00 39.48 35.75 1pjs n PHE 307 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pjs n GLY 308 N -1.23 -0.43 3.43 1.37 0.00 -1.26 -5.10 105.19 101.97 1pjs n GLY 308 Ca -0.06 0.38 -0.11 0.00 0.00 0.00 0.00 46.02 46.22 1pjs n GLY 308 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pjs n ARG 309 N 1.72 0.07 0.24 1.61 3.00 -1.26 -4.59 116.66 117.45 1pjs n ARG 309 Ca 0.08 -1.26 0.17 0.00 -0.01 0.00 0.00 57.85 56.83 1pjs n ARG 309 Cb 0.64 -3.17 0.79 0.00 0.00 0.00 0.00 32.46 30.72 1pjs n ARG 309 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1pjs h GLY 310 N 19.07 0.00 0.99 -0.13 0.00 -1.89 -0.08 103.07 121.03 1pjs h GLY 310 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1pjs h GLY 310 CO 1.01 0.00 0.25 -1.33 0.00 0.00 0.00 176.54 176.47 1pjs h GLY 311 N 1.12 0.94 1.03 4.60 0.00 -1.86 -2.27 103.07 106.64 1pjs h GLY 311 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 46.72 1pjs h GLY 311 CO 0.00 0.48 -0.14 0.83 0.00 0.00 0.00 176.54 177.71 1pjs h GLU 312 N 0.82 0.88 0.00 4.80 5.08 -1.41 -2.33 114.58 122.41 1pjs h GLU 312 Ca 0.20 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1pjs h GLU 312 Cb 0.19 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1pjs h GLU 312 CO -0.02 0.99 0.00 0.39 -1.00 0.00 0.00 179.01 179.38 1pjs n GLU 313 N -4.24 0.76 -0.01 2.33 1.02 -1.09 -3.68 120.64 115.73 1pjs n GLU 313 Ca -0.01 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.12 1pjs n GLU 313 Cb 0.40 -1.32 -0.01 0.00 -0.02 0.00 0.00 31.44 30.49 1pjs n GLU 313 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1pjs n LEU 314 N -0.82 0.97 0.00 -4.62 4.77 -0.87 -4.67 117.00 111.75 1pjs n LEU 314 Ca 0.12 -0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.12 1pjs n LEU 314 Cb 0.05 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.31 1pjs n LEU 314 CO 0.09 0.20 0.37 -1.84 -1.33 0.00 0.00 177.39 174.88 1pjs n GLU 315 N -2.23 0.40 0.00 3.23 0.28 -0.91 -0.85 120.64 120.56 1pjs n GLU 315 Ca -0.03 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.00 1pjs n GLU 315 Cb 0.55 -1.22 -0.00 0.00 1.43 0.00 0.00 31.44 32.20 1pjs n GLU 315 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1pjs n THR 316 N -0.72 0.00 -0.03 3.84 -2.24 -1.26 -4.45 114.28 109.41 1pjs n THR 316 Ca 0.04 -0.43 -0.21 0.00 -2.27 0.00 0.00 64.05 61.18 1pjs n THR 316 Cb 0.02 1.08 -0.13 0.00 -2.10 0.00 0.00 70.33 69.20 1pjs n THR 316 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1pjs n LEU 317 N -0.32 2.58 -2.47 3.22 4.32 -0.03 -4.13 117.00 120.17 1pjs n LEU 317 Ca 0.03 0.18 -0.18 0.00 -0.02 0.00 0.00 56.01 56.02 1pjs n LEU 317 Cb 0.15 -1.06 -0.10 0.00 -1.62 0.00 0.00 43.42 40.78 1pjs n LEU 317 CO 0.09 0.79 1.98 0.00 -1.22 0.00 0.00 177.39 179.03 1pjs n HIS 319 N 2.98 0.00 0.43 0.00 -0.00 -1.26 -4.89 115.22 112.49 1pjs n HIS 319 Ca 0.47 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.70 1pjs n HIS 319 Cb 0.58 0.06 0.04 0.00 -0.12 0.00 0.00 29.99 30.55 1pjs n HIS 319 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1pjs n ALA 320 N 0.00 2.51 -2.45 1.57 0.00 -0.36 -4.95 120.51 116.84 1pjs n ALA 320 Ca 0.00 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 1pjs n ALA 320 Cb 0.24 -0.35 0.01 0.00 0.00 0.00 0.00 19.45 19.35 1pjs n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pjs n GLY 321 N 0.60 0.10 3.49 0.00 0.00 -1.12 -4.97 105.19 103.29 1pjs n GLY 321 Ca 0.06 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 1pjs n GLY 321 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pjs s ILE 322 N -2.69 5.03 0.63 -0.61 -1.09 -1.19 -5.04 121.20 116.25 1pjs s ILE 322 Ca 0.09 -0.27 -0.18 0.00 -2.23 0.00 0.00 60.65 58.06 1pjs s ILE 322 Cb -0.04 -4.08 -0.03 0.00 -1.58 0.00 0.00 42.46 36.74 1pjs s ILE 322 CO 0.11 -0.47 1.18 -0.81 -1.23 0.00 0.00 174.94 173.72 1pjs n PRO 323 N 5.74 1.07 -3.88 2.79 -0.04 -1.26 -4.60 135.00 134.82 1pjs n PRO 323 Ca -0.06 0.42 -0.09 0.00 -0.04 0.00 0.00 63.50 63.72 1pjs n PRO 323 Cb 0.47 -2.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 1pjs n PRO 323 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1pjs s PHE 324 N -1.42 0.20 0.25 0.54 -0.12 -1.26 -2.04 117.98 114.12 1pjs s PHE 324 Ca 0.80 -0.55 -0.16 0.00 -0.05 0.00 0.00 56.93 56.96 1pjs s PHE 324 Cb -0.39 0.13 0.01 0.00 -0.63 0.00 0.00 43.02 42.14 1pjs s PHE 324 CO 0.43 -0.82 0.57 -1.54 -0.05 0.00 0.00 175.22 173.82 1pjs s SER 325 N -2.93 -0.18 -0.04 1.98 1.04 -0.61 -4.96 113.70 107.99 1pjs s SER 325 Ca 0.14 -0.75 0.02 0.00 0.48 0.00 0.00 55.95 55.84 1pjs s SER 325 Cb 0.01 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.78 1pjs s SER 325 CO -0.00 -1.21 -0.08 -0.69 0.98 0.00 0.00 173.24 172.24 1pjs s VAL 326 N -3.96 0.78 -0.36 5.02 1.01 -1.26 -1.44 120.40 120.19 1pjs s VAL 326 Ca 0.16 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1pjs s VAL 326 Cb -0.03 -0.73 0.09 0.00 0.00 0.00 0.00 36.38 35.72 1pjs s VAL 326 CO 0.07 0.26 0.09 -0.69 0.00 0.00 0.00 175.10 174.83 1pjs s VAL 327 N 0.56 2.74 1.01 2.92 1.01 0.68 -4.97 120.40 124.34 1pjs s VAL 327 Ca -0.09 -2.07 -0.11 0.00 0.00 0.00 0.00 61.98 59.71 1pjs s VAL 327 Cb -0.13 -2.88 0.18 0.00 0.00 0.00 0.00 36.38 33.56 1pjs s VAL 327 CO 0.01 -0.53 0.99 -0.81 0.00 0.00 0.00 175.10 174.77 1pjs n PRO 328 N 4.44 -1.08 -4.17 2.72 -0.04 -1.26 -0.76 135.00 134.84 1pjs n PRO 328 Ca -0.02 -0.26 -0.10 0.00 -0.04 0.00 0.00 63.50 63.07 1pjs n PRO 328 Cb 0.42 -2.24 -0.10 0.00 -0.04 0.00 0.00 33.50 31.54 1pjs n PRO 328 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1pjs s GLY 329 N -2.48 0.97 -0.12 0.55 0.00 -1.26 -4.30 107.32 100.69 1pjs s GLY 329 Ca 0.66 -1.46 -0.29 0.00 0.00 0.00 0.00 44.72 43.63 1pjs s GLY 329 CO 0.61 -1.41 1.80 -0.42 0.00 0.00 0.00 173.10 173.68 1pjs s ILE 330 N -3.89 3.41 0.57 0.90 -1.09 -1.26 -4.07 121.20 115.77 1pjs s ILE 330 Ca 0.21 0.47 -0.15 0.00 -2.23 0.00 0.00 60.65 58.95 1pjs s ILE 330 Cb 0.07 -3.37 -0.05 0.00 -1.58 0.00 0.00 42.46 37.53 1pjs s ILE 330 CO 0.00 -0.12 1.03 0.28 -1.23 0.00 0.00 174.94 174.90 1pjs s THR 331 N 5.18 4.19 0.41 2.92 -1.32 -1.26 -3.31 115.64 122.44 1pjs s THR 331 Ca 0.80 0.98 0.15 0.00 -1.21 0.00 0.00 61.69 62.42 1pjs s THR 331 Cb -0.32 -3.56 0.36 0.00 -1.51 0.00 0.00 72.50 67.47 1pjs s THR 331 CO 0.33 -0.66 1.87 0.00 -2.21 0.00 0.00 174.62 173.95 1pjs h ALA 332 N 0.46 2.11 -0.55 11.08 0.00 -1.93 -0.15 119.26 130.28 1pjs h ALA 332 Ca -0.46 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.47 1pjs h ALA 332 Cb 1.20 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1pjs h ALA 332 CO 0.59 -0.37 0.36 0.00 0.00 0.00 0.00 179.25 179.83 1pjs h ALA 333 N 1.62 0.70 -0.11 0.00 0.00 -1.99 -1.11 119.26 118.37 1pjs h ALA 333 Ca 0.44 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 1pjs h ALA 333 Cb 1.01 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1pjs h ALA 333 CO -0.17 0.12 -0.33 0.77 0.00 0.00 0.00 179.25 179.63 1pjs h SER 334 N 0.73 0.48 0.51 0.00 0.02 -1.45 -2.20 113.55 111.64 1pjs h SER 334 Ca 0.20 -0.60 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 1pjs h SER 334 Cb -0.07 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.34 1pjs h SER 334 CO -0.05 1.00 -0.26 1.23 -1.14 0.00 0.00 176.83 177.60 1pjs h GLY 335 N -0.02 -0.75 1.21 -3.77 0.00 -1.08 -2.07 103.07 96.60 1pjs h GLY 335 Ca -0.01 0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.60 1pjs h GLY 335 CO 0.07 -0.27 0.43 0.00 0.00 0.00 0.00 176.54 176.77 1pjs h SER 337 N 1.05 -0.31 -0.55 0.00 0.87 -1.23 -0.58 113.55 112.80 1pjs h SER 337 Ca 0.27 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.78 1pjs h SER 337 Cb -0.01 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 1pjs h SER 337 CO -0.05 -0.17 0.01 0.00 -0.53 0.00 0.00 176.83 176.09 1pjs h ALA 338 N 0.65 0.92 -0.00 6.23 0.00 -1.11 -2.33 119.26 123.62 1pjs h ALA 338 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1pjs h ALA 338 Cb 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1pjs h ALA 338 CO -0.05 0.65 -0.21 0.66 0.00 0.00 0.00 179.25 180.30 1pjs n TYR 339 N -4.19 0.00 0.67 0.00 4.02 -0.47 -3.70 117.16 113.49 1pjs n TYR 339 Ca 0.03 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.99 1pjs n TYR 339 Cb 0.33 -0.33 -0.06 0.00 -0.02 0.00 0.00 39.34 39.27 1pjs n TYR 339 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1pjs n SER 340 N -1.36 0.91 -0.02 7.72 3.41 -0.24 -4.45 113.62 119.59 1pjs n SER 340 Ca 0.08 -0.95 -0.00 0.00 -0.26 0.00 0.00 58.87 57.74 1pjs n SER 340 Cb 0.32 0.86 -0.00 0.00 -0.26 0.00 0.00 64.21 65.13 1pjs n SER 340 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pjs n GLY 341 N 1.27 0.38 3.09 5.00 0.00 -1.13 -4.57 105.19 109.24 1pjs n GLY 341 Ca 0.04 -1.01 -0.36 0.00 0.00 0.00 0.00 46.02 44.69 1pjs n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pjs s ILE 342 N -2.01 3.40 0.38 -0.61 1.01 -0.89 -3.14 121.20 119.34 1pjs s ILE 342 Ca 0.00 -2.55 -0.27 0.00 0.00 0.00 0.00 60.65 57.83 1pjs s ILE 342 Cb 0.00 -3.28 -0.09 0.00 0.01 0.00 0.00 42.46 39.09 1pjs s ILE 342 CO 0.00 -0.78 1.32 -2.84 0.00 0.00 0.00 174.94 172.64 1pjs s PRO 343 N 0.51 4.10 0.48 2.79 0.02 -1.26 -4.57 135.00 137.07 1pjs s PRO 343 Ca 0.13 2.21 0.28 0.00 0.02 0.00 0.00 61.00 63.64 1pjs s PRO 343 Cb -0.22 -2.87 0.88 0.00 0.02 0.00 0.00 34.50 32.32 1pjs s PRO 343 CO -0.04 -0.40 1.80 -0.07 -0.33 0.00 0.00 177.00 177.96 1pjs h LEU 344 N 2.92 0.00 -7.55 -5.54 3.38 -1.95 -3.44 115.31 103.14 1pjs h LEU 344 Ca -0.49 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.23 1pjs h LEU 344 Cb 1.24 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.69 1pjs h LEU 344 CO 0.64 0.00 -0.65 0.28 0.09 0.00 0.00 178.44 178.80 1pjs s THR 345 N -3.44 -0.03 0.04 0.22 -1.32 -1.26 -4.74 115.64 105.11 1pjs s THR 345 Ca 0.04 0.11 -0.12 0.00 -1.21 0.00 0.00 61.69 60.51 1pjs s THR 345 Cb 0.07 -0.14 0.01 0.00 -1.51 0.00 0.00 72.50 70.93 1pjs s THR 345 CO 0.60 0.05 0.25 -2.28 -2.21 0.00 0.00 174.62 171.03 1pjs s HIS 346 N 0.66 -0.04 0.01 9.09 2.46 -1.26 -5.06 115.29 121.16 1pjs s HIS 346 Ca -0.05 -0.13 -0.01 0.00 0.47 0.00 0.00 55.06 55.34 1pjs s HIS 346 Cb -0.07 0.04 0.02 0.00 -0.13 0.00 0.00 32.58 32.44 1pjs s HIS 346 CO -0.03 -0.47 0.09 2.89 -2.47 0.00 0.00 174.74 174.76 1pjs n ARG 347 N 0.64 -0.01 -0.02 2.88 1.85 -1.26 -3.42 116.66 117.33 1pjs n ARG 347 Ca -0.19 0.09 -0.04 0.00 -1.00 0.00 0.00 57.85 56.71 1pjs n ARG 347 Cb 0.59 -0.13 -0.01 0.00 -1.05 0.00 0.00 32.46 31.85 1pjs n ARG 347 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1pjs n ASP 348 N -4.09 0.39 -0.10 2.89 10.43 -1.26 -4.80 116.55 120.01 1pjs n ASP 348 Ca 0.01 0.04 0.06 0.00 2.57 0.00 0.00 54.79 57.47 1pjs n ASP 348 Cb 0.03 -0.11 0.11 0.00 1.84 0.00 0.00 41.12 42.98 1pjs n ASP 348 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1pjs n TYR 349 N -3.15 0.23 -3.63 1.24 4.02 -1.22 -4.67 117.16 109.97 1pjs n TYR 349 Ca -0.07 0.36 -0.03 0.00 -0.01 0.00 0.00 57.90 58.15 1pjs n TYR 349 Cb 0.55 -0.75 -0.02 0.00 -0.02 0.00 0.00 39.34 39.10 1pjs n TYR 349 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1pjs s ALA 350 N -4.93 -2.16 -0.33 -0.72 0.00 -1.24 -4.45 121.76 107.94 1pjs s ALA 350 Ca -0.04 1.85 0.15 0.00 0.00 0.00 0.00 51.96 53.92 1pjs s ALA 350 Cb 0.09 -0.53 0.43 0.00 0.00 0.00 0.00 23.12 23.11 1pjs s ALA 350 CO 0.23 -0.50 1.42 1.04 0.00 0.00 0.00 175.76 177.95 1pjs n GLN 351 N 0.07 1.41 -3.52 0.00 6.02 -0.91 -4.03 117.38 116.42 1pjs n GLN 351 Ca 0.03 -1.82 -0.09 0.00 -0.01 0.00 0.00 57.00 55.11 1pjs n GLN 351 Cb 0.57 -0.10 -0.09 0.00 1.02 0.00 0.00 30.24 31.64 1pjs n GLN 351 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1pjs s SER 352 N -1.75 0.04 -0.10 1.08 0.15 -1.26 -5.07 113.70 106.80 1pjs s SER 352 Ca 0.15 0.60 -0.00 0.00 0.70 0.00 0.00 55.95 57.39 1pjs s SER 352 Cb 0.42 1.17 -0.03 0.00 -1.71 0.00 0.00 66.02 65.87 1pjs s SER 352 CO -0.10 -0.26 -0.07 -0.69 1.20 0.00 0.00 173.24 173.31 1pjs s VAL 353 N 2.56 3.65 -0.13 4.45 1.01 -1.26 -1.47 120.40 129.21 1pjs s VAL 353 Ca 0.05 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1pjs s VAL 353 Cb -0.14 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1pjs s VAL 353 CO -0.14 0.56 -0.18 -0.60 0.00 0.00 0.00 175.10 174.75 1pjs s ARG 354 N -0.37 2.53 -0.38 2.72 3.52 -0.23 -4.96 118.95 121.78 1pjs s ARG 354 Ca 0.05 -0.67 -0.14 0.00 -0.13 0.00 0.00 55.73 54.84 1pjs s ARG 354 Cb -0.12 -2.12 0.01 0.00 -1.56 0.00 0.00 34.95 31.16 1pjs s ARG 354 CO 0.02 -0.07 0.27 -0.51 -0.81 0.00 0.00 175.30 174.20 1pjs s LEU 355 N 0.99 4.88 0.05 -0.88 1.43 -1.26 -1.11 118.68 122.78 1pjs s LEU 355 Ca -0.05 -0.78 0.09 0.00 -1.03 0.00 0.00 54.13 52.36 1pjs s LEU 355 Cb -0.15 -2.13 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 1pjs s LEU 355 CO -0.03 -0.38 -0.26 -0.69 0.23 0.00 0.00 176.35 175.22 1pjs s VAL 356 N 1.67 2.19 0.40 -1.59 1.01 -0.44 -5.02 120.40 118.62 1pjs s VAL 356 Ca 0.05 -1.38 -0.22 0.00 0.00 0.00 0.00 61.98 60.42 1pjs s VAL 356 Cb -0.19 -1.86 -0.11 0.00 0.00 0.00 0.00 36.38 34.23 1pjs s VAL 356 CO 0.10 0.36 0.94 -0.89 0.00 0.00 0.00 175.10 175.60 1pjs s THR 357 N -0.82 4.36 0.00 3.92 2.01 -1.26 -0.59 115.64 123.26 1pjs s THR 357 Ca 0.12 1.55 0.00 0.00 0.31 0.00 0.00 61.69 63.67 1pjs s THR 357 Cb -0.10 -3.71 0.00 0.00 0.01 0.00 0.00 72.50 68.70 1pjs s THR 357 CO 0.02 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 1pjs n GLY 358 N -0.31 0.26 2.78 4.40 0.00 0.25 -4.79 105.19 107.78 1pjs n GLY 358 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1pjs n GLY 358 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1pjs s HIS 359 N 0.00 0.23 0.00 1.61 -3.43 0.26 -4.91 115.29 109.05 1pjs s HIS 359 Ca 0.00 0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.32 1pjs s HIS 359 Cb 0.00 -0.40 0.00 0.00 -1.43 0.00 0.00 32.58 30.75 1pjs s HIS 359 CO 0.00 -0.14 0.00 0.41 -2.00 0.00 0.00 174.74 173.01 1pjs n GLY 363 N 4.39 2.83 0.00 -1.38 0.00 -1.26 -5.05 105.19 104.72 1pjs n GLY 363 Ca -0.22 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1pjs n GLY 363 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pjs n GLY 364 N 0.00 0.39 3.93 -0.02 0.00 -1.26 -5.19 105.19 103.04 1pjs n GLY 364 Ca 0.00 0.50 -0.26 0.00 0.00 0.00 0.00 46.02 46.26 1pjs n GLY 364 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pjs s GLU 365 N 0.00 3.51 0.00 1.61 2.02 -1.26 -5.01 118.70 119.58 1pjs s GLU 365 Ca 0.00 -0.35 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1pjs s GLU 365 Cb 0.00 -2.79 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1pjs s GLU 365 CO 0.00 0.33 0.00 1.28 0.02 0.00 0.00 175.26 176.89 1pjs n LEU 366 N -0.99 0.00 -4.50 1.80 4.32 -1.26 -4.94 117.00 111.42 1pjs n LEU 366 Ca -0.05 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.81 1pjs n LEU 366 Cb 0.55 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.25 1pjs n LEU 366 CO 0.48 0.00 1.23 -0.90 -1.22 0.00 0.00 177.39 176.98 1pjs n ASP 367 N 0.00 0.87 0.22 -1.43 5.75 -1.26 -4.90 116.55 115.80 1pjs n ASP 367 Ca 0.00 -1.76 -0.15 0.00 -0.01 0.00 0.00 54.79 52.87 1pjs n ASP 367 Cb 0.00 -1.46 -0.08 0.00 -1.03 0.00 0.00 41.12 38.55 1pjs n ASP 367 CO 0.00 0.00 0.00 -0.50 -0.11 0.00 0.00 177.20 176.59 1pjs h TRP 368 N 11.75 -0.49 -0.12 2.11 -0.00 -1.92 -3.08 115.95 124.20 1pjs h TRP 368 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.89 58.88 1pjs h TRP 368 Cb 1.01 0.16 0.00 0.00 -0.00 0.00 0.00 29.16 30.34 1pjs h TRP 368 CO 1.17 -0.23 0.00 -0.85 -0.00 0.00 0.00 178.44 178.54 1pjs n GLU 369 N -5.26 1.33 0.02 0.49 0.28 -1.26 0.15 120.64 116.39 1pjs n GLU 369 Ca -0.11 -0.46 -0.14 0.00 -0.16 0.00 0.00 57.16 56.29 1pjs n GLU 369 Cb 0.26 -1.14 -0.14 0.00 1.43 0.00 0.00 31.44 31.85 1pjs n GLU 369 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 1pjs h ASN 370 N 0.74 0.23 0.08 -1.84 -0.73 -1.97 -3.35 115.58 108.73 1pjs h ASN 370 Ca 0.00 -0.38 -0.11 0.00 1.87 0.00 0.00 56.30 57.68 1pjs h ASN 370 Cb 0.22 -0.07 0.01 0.00 0.27 0.00 0.00 38.32 38.75 1pjs h ASN 370 CO 0.01 1.33 -0.49 -0.07 -0.37 0.00 0.00 177.43 177.84 1pjs h LEU 371 N 0.04 0.29 0.00 0.34 3.38 -0.99 -3.34 115.31 115.03 1pjs h LEU 371 Ca -0.27 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 56.75 1pjs h LEU 371 Cb 1.99 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.65 1pjs h LEU 371 CO 0.12 1.22 0.00 0.00 0.09 0.00 0.00 178.44 179.87 1pjs n ALA 372 N -2.64 2.21 -2.11 1.53 0.00 0.12 -4.84 120.51 114.78 1pjs n ALA 372 Ca -0.12 -0.10 -0.26 0.00 0.00 0.00 0.00 53.44 52.96 1pjs n ALA 372 Cb 0.68 -1.25 0.03 0.00 0.00 0.00 0.00 19.45 18.91 1pjs n ALA 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pjs s ALA 373 N -2.00 3.35 -0.18 0.00 0.00 -1.25 -4.07 121.76 117.59 1pjs s ALA 373 Ca 0.23 -0.72 -0.29 0.00 0.00 0.00 0.00 51.96 51.18 1pjs s ALA 373 Cb 0.11 -2.56 0.13 0.00 0.00 0.00 0.00 23.12 20.80 1pjs s ALA 373 CO 0.18 -0.75 1.04 -2.00 0.00 0.00 0.00 175.76 174.23 1pjs s GLU 374 N -4.94 0.53 0.00 0.00 2.12 -1.26 -4.35 118.70 110.79 1pjs s GLU 374 Ca 0.53 0.18 0.00 0.00 0.36 0.00 0.00 54.97 56.04 1pjs s GLU 374 Cb -0.10 0.25 0.00 0.00 0.26 0.00 0.00 34.13 34.54 1pjs s GLU 374 CO 0.45 -0.16 0.00 1.17 -0.54 0.00 0.00 175.26 176.18 1pjs n LYS 375 N 0.87 0.00 -4.32 4.30 4.81 -1.26 -5.13 118.16 117.43 1pjs n LYS 375 Ca -0.10 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.06 1pjs n LYS 375 Cb 0.58 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.52 1pjs n LYS 375 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1pjs s GLN 376 N 0.00 1.82 -0.22 1.64 -2.07 -1.26 -2.15 119.66 117.42 1pjs s GLN 376 Ca 0.00 -1.26 -0.08 0.00 -1.82 0.00 0.00 55.36 52.21 1pjs s GLN 376 Cb 0.00 -2.09 -0.04 0.00 -1.09 0.00 0.00 33.01 29.80 1pjs s GLN 376 CO 0.00 0.46 0.08 0.99 -1.32 0.00 0.00 175.29 175.50 1pjs s THR 377 N -1.38 4.65 -0.18 3.63 2.01 -0.54 -4.77 115.64 119.06 1pjs s THR 377 Ca 0.20 -0.07 -0.09 0.00 0.31 0.00 0.00 61.69 62.04 1pjs s THR 377 Cb -0.10 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 1pjs s THR 377 CO 0.11 0.38 0.13 -0.76 -0.69 0.00 0.00 174.62 173.79 1pjs s LEU 378 N 1.11 4.23 -0.19 4.42 1.43 0.72 -1.07 118.68 129.34 1pjs s LEU 378 Ca 0.05 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1pjs s LEU 378 Cb -0.14 -2.08 0.04 0.00 0.03 0.00 0.00 46.19 44.04 1pjs s LEU 378 CO 0.04 0.23 -0.07 -0.69 0.23 0.00 0.00 176.35 176.08 1pjs s VAL 379 N 0.07 1.36 -0.20 -1.59 1.01 -0.26 -0.34 120.40 120.44 1pjs s VAL 379 Ca 0.09 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 1pjs s VAL 379 Cb -0.11 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 1pjs s VAL 379 CO -0.01 0.12 0.21 -0.36 0.00 0.00 0.00 175.10 175.06 1pjs s PHE 380 N 1.52 3.39 -0.14 5.22 0.40 0.67 -1.32 117.98 127.72 1pjs s PHE 380 Ca -0.01 0.39 -0.06 0.00 -0.60 0.00 0.00 56.93 56.65 1pjs s PHE 380 Cb -0.16 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.06 1pjs s PHE 380 CO -0.08 0.18 0.09 0.71 0.70 0.00 0.00 175.22 176.82 1pjs s TYR 381 N 0.69 3.39 -1.22 0.36 1.51 0.24 -2.16 117.35 120.15 1pjs s TYR 381 Ca 0.11 0.31 -0.00 0.00 -1.01 0.00 0.00 57.07 56.48 1pjs s TYR 381 Cb -0.13 -1.97 -0.00 0.00 -0.11 0.00 0.00 41.96 39.75 1pjs s TYR 381 CO 0.02 0.47 0.94 -1.33 -1.11 0.00 0.00 175.55 174.55 1pjs n MET 382 N 2.62 -6.29 -0.49 -0.62 2.81 -1.26 0.85 117.12 114.74 1pjs n MET 382 Ca -0.18 0.81 0.06 0.00 -1.81 0.00 0.00 57.70 56.57 1pjs n MET 382 Cb 0.54 -5.74 0.11 0.00 -0.71 0.00 0.00 33.22 27.41 1pjs n MET 382 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pjs n GLY 383 N -1.21 3.38 0.16 3.03 0.00 -1.26 -0.57 105.19 108.71 1pjs n GLY 383 Ca -0.29 -0.87 0.03 0.00 0.00 0.00 0.00 46.02 44.89 1pjs n GLY 383 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1pjs h LEU 384 N 0.37 0.00 -1.81 0.99 4.07 -1.93 -2.53 115.31 114.47 1pjs h LEU 384 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1pjs h LEU 384 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 1pjs h LEU 384 CO 0.01 0.49 0.00 0.59 -1.08 0.00 0.00 178.44 178.46 1pjs n ASN 385 N -3.41 2.66 -0.32 -0.43 5.03 -1.26 -3.53 115.26 114.00 1pjs n ASN 385 Ca 0.01 -2.08 0.01 0.00 0.87 0.00 0.00 54.58 53.39 1pjs n ASN 385 Cb 0.64 -0.35 0.02 0.00 -1.02 0.00 0.00 39.78 39.07 1pjs n ASN 385 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pjs n GLN 386 N 0.78 0.30 -0.05 3.52 6.02 -1.13 -4.90 117.38 121.92 1pjs n GLN 386 Ca 0.16 -1.13 -0.11 0.00 -0.01 0.00 0.00 57.00 55.91 1pjs n GLN 386 Cb 0.45 -0.65 -0.05 0.00 1.02 0.00 0.00 30.24 31.01 1pjs n GLN 386 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pjs h ALA 387 N 0.00 0.23 -0.37 -1.58 0.00 -1.50 -1.47 119.26 114.57 1pjs h ALA 387 Ca 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 1pjs h ALA 387 Cb 1.23 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1pjs h ALA 387 CO 0.00 -0.18 -0.38 0.00 0.00 0.00 0.00 179.25 178.69 1pjs h ALA 388 N 0.92 0.64 0.00 0.00 0.00 -1.87 -1.26 119.26 117.68 1pjs h ALA 388 Ca 0.06 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1pjs h ALA 388 Cb 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1pjs h ALA 388 CO -0.01 0.67 0.00 2.41 0.00 0.00 0.00 179.25 182.33 1pjs n THR 389 N -4.06 1.01 -0.08 0.00 -1.04 -1.17 -1.78 114.28 107.16 1pjs n THR 389 Ca -0.02 0.26 -0.12 0.00 -2.04 0.00 0.00 64.05 62.13 1pjs n THR 389 Cb 0.53 -1.03 -0.15 0.00 -1.82 0.00 0.00 70.33 67.87 1pjs n THR 389 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1pjs n ILE 390 N -1.57 1.50 0.20 12.58 5.41 -0.56 -3.51 119.36 133.41 1pjs n ILE 390 Ca 0.03 -0.77 -0.14 0.00 1.00 0.00 0.00 62.75 62.87 1pjs n ILE 390 Cb 0.17 -0.89 -0.08 0.00 -0.71 0.00 0.00 39.64 38.13 1pjs n ILE 390 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1pjs h GLN 391 N 0.01 -0.48 -0.78 0.38 4.15 -0.47 -2.44 115.11 115.47 1pjs h GLN 391 Ca -0.48 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 58.94 1pjs h GLN 391 Cb 2.11 0.11 -0.04 0.00 0.21 0.00 0.00 27.48 29.87 1pjs h GLN 391 CO 0.02 -0.21 0.35 0.93 -1.93 0.00 0.00 178.83 177.99 1pjs h GLU 392 N -0.68 1.14 -0.03 1.69 5.08 -1.55 -2.48 114.58 117.75 1pjs h GLU 392 Ca -0.05 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1pjs h GLU 392 Cb 0.48 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1pjs h GLU 392 CO 0.08 0.90 0.00 1.63 -1.00 0.00 0.00 179.01 180.62 1pjs n LYS 393 N -4.34 1.13 -0.07 2.33 5.02 -1.21 -2.49 118.16 118.53 1pjs n LYS 393 Ca 0.07 -0.19 -0.09 0.00 -2.02 0.00 0.00 58.31 56.08 1pjs n LYS 393 Cb 0.15 -1.30 -0.07 0.00 -0.02 0.00 0.00 35.03 33.80 1pjs n LYS 393 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1pjs n LEU 394 N -0.59 2.37 0.15 -0.35 7.94 -0.92 -4.18 117.00 121.42 1pjs n LEU 394 Ca 0.14 -0.06 0.02 0.00 -1.11 0.00 0.00 56.01 55.00 1pjs n LEU 394 Cb 0.11 -0.33 0.14 0.00 0.53 0.00 0.00 43.42 43.86 1pjs n LEU 394 CO 0.11 0.64 0.51 0.16 -1.11 0.00 0.00 177.39 177.70 1pjs h ILE 395 N 0.00 1.01 -0.39 1.96 3.07 -1.52 -1.65 117.51 119.99 1pjs h ILE 395 Ca -0.31 -2.10 -0.08 0.00 1.55 0.00 0.00 64.86 63.93 1pjs h ILE 395 Cb 1.52 2.27 -0.01 0.00 -0.27 0.00 0.00 36.82 40.33 1pjs h ILE 395 CO -0.03 0.51 -0.06 0.00 -1.05 0.00 0.00 178.15 177.51 1pjs h ALA 396 N 1.48 0.53 -0.16 0.16 0.00 -1.71 -2.96 119.26 116.60 1pjs h ALA 396 Ca -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1pjs h ALA 396 Cb 1.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1pjs h ALA 396 CO 0.07 0.37 0.03 1.19 0.00 0.00 0.00 179.25 180.91 1pjs n PHE 397 N -4.38 0.57 0.00 0.00 3.01 -1.20 -4.87 117.46 110.58 1pjs n PHE 397 Ca -0.01 -0.31 0.00 0.00 1.01 0.00 0.00 57.45 58.14 1pjs n PHE 397 Cb 0.33 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 1pjs n PHE 397 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pjs n GLY 398 N 0.14 1.89 3.69 1.37 0.00 -1.12 -4.86 105.19 106.31 1pjs n GLY 398 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1pjs n GLY 398 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1pjs n MET 399 N -0.14 2.18 -1.97 1.61 0.00 -0.62 -4.89 117.12 113.29 1pjs n MET 399 Ca 0.00 0.78 -0.41 0.00 0.00 0.00 0.00 57.70 58.07 1pjs n MET 399 Cb 0.00 -2.46 -0.02 0.00 0.00 0.00 0.00 33.22 30.75 1pjs n MET 399 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 1pjs s GLN 400 N -0.53 4.24 0.47 2.12 -0.21 -1.26 -4.32 119.66 120.17 1pjs s GLN 400 Ca 0.66 2.37 0.20 0.00 0.02 0.00 0.00 55.36 58.62 1pjs s GLN 400 Cb -0.61 -3.05 1.15 0.00 1.00 0.00 0.00 33.01 31.50 1pjs s GLN 400 CO 0.50 -0.38 1.99 0.00 -2.12 0.00 0.00 175.29 175.28 1pjs h ALA 401 N 3.81 1.44 -0.37 6.09 0.00 -1.95 -2.38 119.26 125.90 1pjs h ALA 401 Ca -0.49 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1pjs h ALA 401 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1pjs h ALA 401 CO 0.69 0.24 0.00 -0.40 0.00 0.00 0.00 179.25 179.78 1pjs n ASP 402 N -3.95 2.18 -4.66 0.00 3.85 -1.26 -3.36 116.55 109.35 1pjs n ASP 402 Ca -0.02 -2.05 -0.42 0.00 -0.71 0.00 0.00 54.79 51.59 1pjs n ASP 402 Cb 0.27 -0.29 -0.03 0.00 -1.35 0.00 0.00 41.12 39.73 1pjs n ASP 402 CO 0.00 0.00 0.00 -0.04 -1.01 0.00 0.00 177.20 176.15 1pjs s MET 403 N -1.53 4.20 0.42 0.11 -1.94 -0.90 -4.77 119.30 114.89 1pjs s MET 403 Ca 0.26 2.09 -0.26 0.00 -1.71 0.00 0.00 55.69 56.07 1pjs s MET 403 Cb 0.14 -3.89 -0.09 0.00 2.01 0.00 0.00 34.83 33.00 1pjs s MET 403 CO 0.16 -0.79 1.45 -1.25 -0.01 0.00 0.00 175.02 174.59 1pjs s PRO 404 N 3.72 3.85 0.07 2.03 0.04 -1.26 -0.59 135.00 142.86 1pjs s PRO 404 Ca 0.70 2.48 -0.03 0.00 0.04 0.00 0.00 61.00 64.19 1pjs s PRO 404 Cb -0.32 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.42 1pjs s PRO 404 CO 0.27 -0.71 0.04 0.08 0.04 0.00 0.00 177.00 176.72 1pjs s VAL 405 N -1.17 0.19 0.01 -0.36 1.01 -0.90 -1.43 120.40 117.75 1pjs s VAL 405 Ca 0.58 -1.65 -0.24 0.00 0.00 0.00 0.00 61.98 60.67 1pjs s VAL 405 Cb -0.45 -1.52 0.05 0.00 0.00 0.00 0.00 36.38 34.46 1pjs s VAL 405 CO 0.59 -0.86 0.54 0.00 0.00 0.00 0.00 175.10 175.37 1pjs s ALA 406 N -3.92 -1.38 -0.08 5.51 0.00 -0.59 -1.77 121.76 119.53 1pjs s ALA 406 Ca 0.08 0.77 0.04 0.00 0.00 0.00 0.00 51.96 52.84 1pjs s ALA 406 Cb 0.07 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.42 1pjs s ALA 406 CO -0.09 -0.43 -0.20 -0.51 0.00 0.00 0.00 175.76 174.53 1pjs s LEU 407 N -1.65 1.94 -0.24 0.00 1.43 0.13 -0.71 118.68 119.58 1pjs s LEU 407 Ca -0.08 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 1pjs s LEU 407 Cb -0.01 -1.20 0.05 0.00 0.03 0.00 0.00 46.19 45.06 1pjs s LEU 407 CO 0.03 0.13 -0.12 -0.69 0.23 0.00 0.00 176.35 175.92 1pjs s VAL 408 N 0.38 2.27 -0.13 -1.59 1.01 -0.86 -1.31 120.40 120.17 1pjs s VAL 408 Ca -0.16 -1.40 -0.06 0.00 0.00 0.00 0.00 61.98 60.37 1pjs s VAL 408 Cb -0.17 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1pjs s VAL 408 CO 0.07 0.12 0.09 -0.70 0.00 0.00 0.00 175.10 174.67 1pjs s GLU 409 N 1.18 3.52 -1.52 2.72 2.12 0.70 -1.71 118.70 125.70 1pjs s GLU 409 Ca -0.05 -0.26 -0.10 0.00 0.36 0.00 0.00 54.97 54.93 1pjs s GLU 409 Cb -0.18 -3.12 0.08 0.00 0.26 0.00 0.00 34.13 31.17 1pjs s GLU 409 CO -0.07 0.60 0.79 0.09 -0.54 0.00 0.00 175.26 176.14 1pjs n ASN 410 N 2.51 -3.05 -4.55 -1.70 3.02 -0.29 -1.23 115.26 109.97 1pjs n ASN 410 Ca -0.18 -0.88 -0.45 0.00 -0.03 0.00 0.00 54.58 53.03 1pjs n ASN 410 Cb 0.54 -3.48 -0.02 0.00 -0.61 0.00 0.00 39.78 36.21 1pjs n ASN 410 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pjs n GLY 411 N -1.66 -0.57 3.50 7.41 0.00 -1.26 -1.86 105.19 110.75 1pjs n GLY 411 Ca -0.07 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1pjs n GLY 411 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pjs n THR 412 N 0.22 0.00 -3.25 2.61 -2.24 -1.26 -4.47 114.28 105.89 1pjs n THR 412 Ca 0.12 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.68 1pjs n THR 412 Cb 0.30 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1pjs n THR 412 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1pjs s SER 413 N -2.70 5.98 0.00 3.42 1.04 -0.78 -3.97 113.70 116.69 1pjs s SER 413 Ca 0.00 0.18 0.06 0.00 0.48 0.00 0.00 55.95 56.67 1pjs s SER 413 Cb 0.00 -1.56 0.32 0.00 0.10 0.00 0.00 66.02 64.88 1pjs s SER 413 CO 0.00 -0.52 1.00 1.33 0.98 0.00 0.00 173.24 176.03 1pjs n VAL 414 N -1.87 0.73 -0.85 5.02 0.24 -1.26 -1.37 118.33 118.98 1pjs n VAL 414 Ca -0.01 0.18 0.08 0.00 -2.04 0.00 0.00 64.34 62.55 1pjs n VAL 414 Cb 0.57 -1.08 0.12 0.00 -1.47 0.00 0.00 33.84 31.98 1pjs n VAL 414 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1pjs n LYS 415 N -1.23 1.72 -1.69 7.34 2.85 -1.26 -4.96 118.16 120.93 1pjs n LYS 415 Ca 0.03 -2.38 -0.54 0.00 -1.05 0.00 0.00 58.31 54.37 1pjs n LYS 415 Cb 0.04 -1.42 -0.06 0.00 -0.65 0.00 0.00 35.03 32.94 1pjs n LYS 415 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1pjs n GLN 416 N -1.19 1.41 -4.69 -1.58 7.27 -0.47 -4.64 117.38 113.49 1pjs n GLN 416 Ca 0.13 0.51 -0.33 0.00 0.07 0.00 0.00 57.00 57.38 1pjs n GLN 416 Cb 0.57 -2.23 -0.13 0.00 2.41 0.00 0.00 30.24 30.86 1pjs n GLN 416 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 1pjs s ARG 417 N 3.12 3.35 -0.11 3.69 3.52 -0.36 -2.15 118.95 130.02 1pjs s ARG 417 Ca 0.94 -0.64 0.03 0.00 -0.13 0.00 0.00 55.73 55.94 1pjs s ARG 417 Cb -0.96 -2.68 0.01 0.00 -1.56 0.00 0.00 34.95 29.76 1pjs s ARG 417 CO 0.59 0.28 -0.20 0.08 -0.81 0.00 0.00 175.30 175.24 1pjs s VAL 418 N 0.19 1.82 0.02 7.11 1.01 -1.26 -0.22 120.40 129.08 1pjs s VAL 418 Ca -0.06 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.09 1pjs s VAL 418 Cb -0.15 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 1pjs s VAL 418 CO 0.04 0.51 -0.11 -0.69 0.00 0.00 0.00 175.10 174.85 1pjs s VAL 419 N 0.62 0.87 0.33 2.92 1.01 -0.43 -4.95 120.40 120.75 1pjs s VAL 419 Ca -0.13 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 1pjs s VAL 419 Cb -0.17 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.43 1pjs s VAL 419 CO 0.04 0.02 0.51 -1.38 0.00 0.00 0.00 175.10 174.28 1pjs s HIS 420 N -0.69 0.79 0.00 5.22 -3.43 -1.26 0.22 115.29 116.14 1pjs s HIS 420 Ca 0.00 -1.11 0.00 0.00 -0.80 0.00 0.00 55.06 53.16 1pjs s HIS 420 Cb -0.07 0.09 0.00 0.00 -1.43 0.00 0.00 32.58 31.17 1pjs s HIS 420 CO 0.01 -1.15 0.00 0.41 -2.00 0.00 0.00 174.74 172.00 1pjs n GLY 421 N -0.51 -0.62 3.40 -1.38 0.00 -0.73 -4.99 105.19 100.36 1pjs n GLY 421 Ca -0.01 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1pjs n GLY 421 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pjs s VAL 422 N -1.47 2.18 0.38 1.61 -7.23 -1.26 -2.11 120.40 112.49 1pjs s VAL 422 Ca 0.00 -2.06 0.19 0.00 -1.81 0.00 0.00 61.98 58.30 1pjs s VAL 422 Cb 0.00 -2.06 0.38 0.00 0.56 0.00 0.00 36.38 35.27 1pjs s VAL 422 CO 0.00 -0.25 1.69 0.25 -0.31 0.00 0.00 175.10 176.48 1pjs h LEU 423 N 3.04 0.44 -0.01 1.32 6.46 -0.87 0.16 115.31 125.85 1pjs h LEU 423 Ca -0.44 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1pjs h LEU 423 Cb 1.22 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.24 1pjs h LEU 423 CO 0.51 -0.07 0.00 0.35 -0.62 0.00 0.00 178.44 178.61 1pjs n THR 424 N -4.84 0.00 -0.27 1.05 -2.24 -1.21 -1.69 114.28 105.08 1pjs n THR 424 Ca 0.31 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1pjs n THR 424 Cb 1.06 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 1pjs n THR 424 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pjs n GLN 425 N -0.49 -0.52 0.00 -0.78 6.02 0.56 -4.91 117.38 117.25 1pjs n GLN 425 Ca 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 57.00 56.56 1pjs n GLN 425 Cb 0.00 -0.87 0.00 0.00 1.02 0.00 0.00 30.24 30.39 1pjs n GLN 425 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1pjs n LEU 426 N -0.03 0.00 -0.09 1.08 0.00 -0.68 -0.51 117.00 116.78 1pjs n LEU 426 Ca 0.00 0.98 0.26 0.00 0.00 0.00 0.00 56.01 57.25 1pjs n LEU 426 Cb 0.08 -0.48 0.72 0.00 0.00 0.00 0.00 43.42 43.74 1pjs n LEU 426 CO 0.00 -0.48 1.24 1.23 0.00 0.00 0.00 177.39 179.37 1pjs h GLY 427 N 0.00 0.00 1.25 -3.96 0.00 -1.84 0.04 103.07 98.57 1pjs h GLY 427 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 1pjs h GLY 427 CO 0.00 0.00 -0.99 -2.09 0.00 0.00 0.00 176.54 173.46 1pjs h GLU 428 N 0.00 0.68 0.00 4.80 4.81 -1.68 -3.12 114.58 120.06 1pjs h GLU 428 Ca 0.35 -0.70 -0.01 0.00 -0.13 0.00 0.00 59.36 58.87 1pjs h GLU 428 Cb 1.57 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 31.15 1pjs h GLU 428 CO -0.00 1.29 -0.04 -0.07 -0.73 0.00 0.00 179.01 179.46 1pjs h LEU 429 N 0.40 0.00 -0.60 1.64 3.38 0.10 -3.17 115.31 117.05 1pjs h LEU 429 Ca -0.11 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 1pjs h LEU 429 Cb 1.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.37 1pjs h LEU 429 CO 0.19 0.04 -0.65 0.00 0.09 0.00 0.00 178.44 178.11 1pjs h ALA 430 N 1.96 0.84 -0.13 1.53 0.00 -1.08 -2.82 119.26 119.56 1pjs h ALA 430 Ca -0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 1pjs h ALA 430 Cb 0.88 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1pjs h ALA 430 CO 0.01 0.81 0.02 0.94 0.00 0.00 0.00 179.25 181.03 1pjs n GLN 431 N -3.65 1.70 0.00 0.00 7.27 -1.19 -2.19 117.38 119.34 1pjs n GLN 431 Ca -0.01 -0.63 0.00 0.00 0.07 0.00 0.00 57.00 56.43 1pjs n GLN 431 Cb 0.67 -1.59 0.00 0.00 2.41 0.00 0.00 30.24 31.73 1pjs n GLN 431 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 1pjs n GLN 432 N 0.13 1.12 -4.11 3.69 7.27 -1.06 -5.04 117.38 119.38 1pjs n GLN 432 Ca 0.07 -0.97 -0.09 0.00 0.07 0.00 0.00 57.00 56.08 1pjs n GLN 432 Cb 0.49 -0.94 -0.10 0.00 2.41 0.00 0.00 30.24 32.11 1pjs n GLN 432 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1pjs s VAL 433 N -0.50 0.14 0.27 1.69 1.01 -0.93 -5.07 120.40 117.01 1pjs s VAL 433 Ca 0.00 -1.81 0.03 0.00 0.00 0.00 0.00 61.98 60.20 1pjs s VAL 433 Cb 0.00 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.49 1pjs s VAL 433 CO 0.00 -0.63 0.04 -1.61 0.00 0.00 0.00 175.10 172.90 1pjs s GLU 434 N -3.99 1.48 0.43 2.72 2.02 -1.26 -4.99 118.70 115.10 1pjs s GLU 434 Ca 0.17 -1.79 -0.24 0.00 0.02 0.00 0.00 54.97 53.13 1pjs s GLU 434 Cb 0.07 -0.65 -0.08 0.00 0.10 0.00 0.00 34.13 33.57 1pjs s GLU 434 CO -0.03 -0.17 1.16 0.45 0.02 0.00 0.00 175.26 176.69 1pjs s SER 435 N -3.38 6.36 0.02 -0.19 0.15 -1.26 -4.04 113.70 111.36 1pjs s SER 435 Ca 0.34 2.31 -0.21 0.00 0.70 0.00 0.00 55.95 59.09 1pjs s SER 435 Cb 0.07 -2.61 -0.06 0.00 -1.71 0.00 0.00 66.02 61.72 1pjs s SER 435 CO 0.13 -0.78 0.60 -2.16 1.20 0.00 0.00 173.24 172.23 1pjs s PRO 436 N -2.51 4.31 0.07 5.44 0.05 -1.26 -4.94 135.00 136.16 1pjs s PRO 436 Ca 0.60 0.76 -0.11 0.00 0.05 0.00 0.00 61.00 62.31 1pjs s PRO 436 Cb -0.29 -3.32 0.01 0.00 0.05 0.00 0.00 34.50 30.95 1pjs s PRO 436 CO 0.36 0.42 0.24 0.00 0.05 0.00 0.00 177.00 178.07 1pjs s ALA 437 N -0.38 -0.44 0.21 8.56 0.00 -1.26 -1.14 121.76 127.31 1pjs s ALA 437 Ca 0.31 -0.33 0.11 0.00 0.00 0.00 0.00 51.96 52.05 1pjs s ALA 437 Cb -0.19 0.43 -0.05 0.00 0.00 0.00 0.00 23.12 23.31 1pjs s ALA 437 CO 0.18 -0.47 -0.22 -0.51 0.00 0.00 0.00 175.76 174.74 1pjs s LEU 438 N -2.50 2.48 -0.10 0.00 1.43 -0.69 -4.30 118.68 115.00 1pjs s LEU 438 Ca 0.00 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.20 1pjs s LEU 438 Cb 0.02 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 1pjs s LEU 438 CO -0.08 0.08 -0.12 -0.63 0.23 0.00 0.00 176.35 175.83 1pjs s ILE 439 N -1.95 3.18 -0.23 -0.59 1.01 -0.92 -2.03 121.20 119.67 1pjs s ILE 439 Ca 0.23 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1pjs s ILE 439 Cb -0.07 -2.31 0.05 0.00 0.01 0.00 0.00 42.46 40.15 1pjs s ILE 439 CO 0.11 0.55 -0.10 -0.63 0.00 0.00 0.00 174.94 174.87 1pjs s ILE 440 N -0.08 1.84 -0.22 2.92 1.01 0.11 -0.23 121.20 126.55 1pjs s ILE 440 Ca -0.02 -1.31 -0.07 0.00 0.00 0.00 0.00 60.65 59.25 1pjs s ILE 440 Cb -0.14 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 1pjs s ILE 440 CO 0.04 0.04 0.05 -0.69 0.00 0.00 0.00 174.94 174.37 1pjs s VAL 441 N 1.27 4.27 0.00 2.92 1.01 0.53 -1.55 120.40 128.86 1pjs s VAL 441 Ca -0.05 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1pjs s VAL 441 Cb -0.18 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1pjs s VAL 441 CO -0.07 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1pjs n GLY 442 N 4.48 3.26 0.29 4.51 0.00 -0.51 -0.20 105.19 117.01 1pjs n GLY 442 Ca -0.17 -0.84 0.19 0.00 0.00 0.00 0.00 46.02 45.20 1pjs n GLY 442 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1pjs h ARG 443 N 0.00 0.00 0.00 1.61 -0.00 -1.87 -2.46 114.38 111.66 1pjs h ARG 443 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 1pjs h ARG 443 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 29.97 1pjs h ARG 443 CO 0.00 0.00 -0.04 -0.39 0.00 0.00 0.00 179.97 179.54 1pjs h VAL 444 N 0.00 0.21 -0.10 2.04 -1.51 -1.89 -2.86 116.25 112.14 1pjs h VAL 444 Ca 0.00 -0.31 0.03 0.00 -1.23 0.00 0.00 66.70 65.19 1pjs h VAL 444 Cb 0.20 1.25 -0.00 0.00 -2.13 0.00 0.00 31.29 30.61 1pjs h VAL 444 CO 0.00 0.04 0.13 0.58 -1.23 0.00 0.00 177.57 177.09 1pjs h VAL 445 N 0.00 0.40 0.00 7.19 2.07 -1.75 -1.31 116.25 122.86 1pjs h VAL 445 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1pjs h VAL 445 Cb 0.24 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1pjs h VAL 445 CO 0.01 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.55 1pjs h ALA 446 N 1.83 0.98 0.00 1.67 0.00 -1.75 -3.16 119.26 118.84 1pjs h ALA 446 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pjs h ALA 446 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1pjs h ALA 446 CO -0.00 0.06 0.00 -0.07 0.00 0.00 0.00 179.25 179.24 1pjs h LEU 447 N 0.00 0.00 -2.91 0.00 3.38 -1.44 -3.03 115.31 111.31 1pjs h LEU 447 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pjs h LEU 447 Cb 0.84 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 1pjs h LEU 447 CO 0.01 0.00 0.03 -0.09 0.09 0.00 0.00 178.44 178.48 1pjs h ARG 448 N 0.00 0.00 0.00 1.13 2.43 -1.51 -0.68 114.38 115.76 1pjs h ARG 448 Ca 0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1pjs h ARG 448 Cb 0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1pjs h ARG 448 CO 0.00 0.00 -0.23 -0.44 -1.51 0.00 0.00 179.97 177.79 1pjs h ASP 449 N 0.00 0.00 0.00 -3.80 3.32 -1.81 -1.55 116.42 112.58 1pjs h ASP 449 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 1pjs h ASP 449 Cb 0.06 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1pjs h ASP 449 CO -0.00 0.23 -2.21 0.29 -1.72 0.00 0.00 179.24 175.83 1pjs n LYS 450 N -3.27 0.70 0.00 3.56 5.02 -0.37 -4.67 118.16 119.12 1pjs n LYS 450 Ca 0.01 -0.09 0.06 0.00 -2.02 0.00 0.00 58.31 56.27 1pjs n LYS 450 Cb 0.50 -1.51 -0.06 0.00 -0.02 0.00 0.00 35.03 33.94 1pjs n LYS 450 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pjs n LEU 451 N -2.53 0.76 -4.67 -0.35 4.77 -0.54 -5.00 117.00 109.44 1pjs n LEU 451 Ca -0.20 -0.55 -0.46 0.00 -0.03 0.00 0.00 56.01 54.77 1pjs n LEU 451 Cb 0.90 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.96 1pjs n LEU 451 CO 0.44 0.18 1.10 -3.20 -1.33 0.00 0.00 177.39 174.57 1pjs n ASN 452 N -1.11 2.87 0.00 -1.43 5.15 -0.59 -4.53 115.26 115.63 1pjs n ASN 452 Ca 0.03 1.11 0.00 0.00 -0.60 0.00 0.00 54.58 55.12 1pjs n ASN 452 Cb 0.22 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.05 1pjs n ASN 452 CO 0.00 0.00 0.00 -2.67 1.40 0.00 0.00 177.26 175.99 1pjs n TRP 453 N 2.66 0.00 -3.67 1.20 4.27 -1.26 -5.02 117.44 115.62 1pjs n TRP 453 Ca 0.14 0.00 -0.34 0.00 -3.89 0.00 0.00 57.50 53.42 1pjs n TRP 453 Cb 0.30 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.19 1pjs n TRP 453 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1pjs s PHE 454 N 0.00 3.56 0.52 -2.67 2.19 -1.26 -5.07 117.98 115.24 1pjs s PHE 454 Ca 0.00 0.65 -0.22 0.00 0.33 0.00 0.00 56.93 57.69 1pjs s PHE 454 Cb 0.00 -2.06 -0.06 0.00 -1.31 0.00 0.00 43.02 39.60 1pjs s PHE 454 CO 0.00 0.54 1.28 0.45 1.83 0.00 0.00 175.22 179.32 1pjs s SER 455 N -1.89 5.56 0.13 6.13 0.15 -1.26 -5.03 113.70 117.48 1pjs s SER 455 Ca 0.33 2.58 0.07 0.00 0.70 0.00 0.00 55.95 59.62 1pjs s SER 455 Cb -0.13 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.52 1pjs s SER 455 CO 0.19 -1.36 -0.03 0.21 1.20 0.00 0.00 173.24 173.45 1pjs s ASN 456 N -1.14 4.73 0.00 5.45 3.84 -1.26 -4.80 114.94 121.75 1pjs s ASN 456 Ca 0.69 -0.33 0.00 0.00 0.21 0.00 0.00 52.86 53.43 1pjs s ASN 456 Cb -0.36 -1.01 0.00 0.00 -0.55 0.00 0.00 41.25 39.33 1pjs s ASN 456 CO 0.42 0.14 0.08 1.41 -2.79 0.00 0.00 177.10 176.36