#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m07 s LYS 8 N 1.97 3.44 0.11 0.00 -0.14 -1.26 -5.03 119.74 118.83 3m07 s LYS 8 Ca 0.27 -0.41 -0.05 0.00 -1.36 0.00 0.00 55.97 54.42 3m07 s LYS 8 Cb -0.16 -3.05 -0.15 0.00 -1.68 0.00 0.00 37.83 32.79 3m07 s LYS 8 CO 0.10 0.62 1.26 0.77 -0.76 0.00 0.00 175.35 177.34 3m07 h SER 9 N 3.24 0.53 -2.43 2.83 0.02 -1.98 -3.47 113.55 112.30 3m07 h SER 9 Ca -0.46 -0.46 -0.55 0.00 -0.84 0.00 0.00 61.79 59.49 3m07 h SER 9 Cb 1.17 -0.16 -0.07 0.00 0.14 0.00 0.00 62.40 63.47 3m07 h SER 9 CO 0.74 1.28 -0.59 0.26 -1.14 0.00 0.00 176.83 177.39 3m07 s TRP 10 N -3.11 2.97 0.00 3.45 0.52 -1.26 -4.78 118.94 116.73 3m07 s TRP 10 Ca -0.06 -0.12 0.00 0.00 0.02 0.00 0.00 56.10 55.94 3m07 s TRP 10 Cb 0.08 -1.37 0.00 0.00 -1.15 0.00 0.00 33.47 31.03 3m07 s TRP 10 CO 0.87 0.54 0.00 0.41 0.02 0.00 0.00 176.95 178.80 3m07 n GLY 11 N -0.74 -1.84 3.12 0.98 0.00 -1.21 -4.90 105.19 100.59 3m07 n GLY 11 Ca -0.08 -1.97 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 3m07 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m07 s ALA 12 N -1.93 2.47 0.02 4.61 0.00 -1.26 -0.85 121.76 124.82 3m07 s ALA 12 Ca 0.00 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.56 3m07 s ALA 12 Cb 0.00 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 3m07 s ALA 12 CO 0.00 -0.69 -0.09 -1.21 0.00 0.00 0.00 175.76 173.78 3m07 s GLU 13 N 1.24 0.62 -0.12 0.00 2.02 -0.40 -4.78 118.70 117.28 3m07 s GLU 13 Ca -0.00 -0.52 -0.29 0.00 0.02 0.00 0.00 54.97 54.18 3m07 s GLU 13 Cb -0.16 -0.54 -0.04 0.00 0.10 0.00 0.00 34.13 33.49 3m07 s GLU 13 CO -0.09 0.13 1.57 0.71 0.02 0.00 0.00 175.26 177.60 3m07 s TYR 14 N -0.70 2.18 -2.50 1.61 2.02 -1.26 -0.60 117.35 118.10 3m07 s TYR 14 Ca -0.02 0.45 0.22 0.00 -0.37 0.00 0.00 57.07 57.36 3m07 s TYR 14 Cb -0.06 -3.85 0.11 0.00 -0.40 0.00 0.00 41.96 37.76 3m07 s TYR 14 CO 0.00 -3.17 1.15 0.44 -1.57 0.00 0.00 175.55 172.40 3m07 n ILE 15 N 5.73 0.00 -3.86 2.71 -5.35 -0.35 -4.94 119.36 113.31 3m07 n ILE 15 Ca 0.17 -0.42 -0.08 0.00 -0.27 0.00 0.00 62.75 62.15 3m07 n ILE 15 Cb 0.44 1.39 -0.00 0.00 -1.74 0.00 0.00 39.64 39.72 3m07 n ILE 15 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3m07 s ALA 16 N -2.06 -0.83 0.52 -1.28 0.00 -1.20 -4.96 121.76 111.95 3m07 s ALA 16 Ca 0.23 -0.62 0.31 0.00 0.00 0.00 0.00 51.96 51.89 3m07 s ALA 16 Cb 0.18 0.80 1.76 0.00 0.00 0.00 0.00 23.12 25.86 3m07 s ALA 16 CO 0.38 -0.99 2.19 0.00 0.00 0.00 0.00 175.76 177.34 3m07 h ALA 17 N 2.02 1.33 0.00 0.00 0.00 -2.03 -3.22 119.26 117.37 3m07 h ALA 17 Ca -0.26 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3m07 h ALA 17 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3m07 h ALA 17 CO 0.33 0.06 -0.09 -0.40 0.00 0.00 0.00 179.25 179.15 3m07 n ASP 18 N -3.63 1.09 -3.85 0.00 5.75 -1.26 -5.05 116.55 109.61 3m07 n ASP 18 Ca -0.02 -1.90 -0.20 0.00 -0.01 0.00 0.00 54.79 52.66 3m07 n ASP 18 Cb 0.15 -0.12 -0.16 0.00 -1.03 0.00 0.00 41.12 39.96 3m07 n ASP 18 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3m07 s VAL 19 N -0.86 0.40 -0.17 2.12 1.01 -1.22 -0.09 120.40 121.60 3m07 s VAL 19 Ca 0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 3m07 s VAL 19 Cb 0.05 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 3m07 s VAL 19 CO 0.01 0.21 0.00 -0.69 0.00 0.00 0.00 175.10 174.63 3m07 s VAL 20 N 1.12 4.26 -0.21 2.92 1.01 -0.49 -1.21 120.40 127.80 3m07 s VAL 20 Ca -0.08 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 61.55 3m07 s VAL 20 Cb -0.14 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.31 3m07 s VAL 20 CO -0.01 0.48 0.25 -0.60 0.00 0.00 0.00 175.10 175.22 3m07 s ARG 21 N 0.37 4.15 -0.19 2.72 3.52 0.24 -0.89 118.95 128.86 3m07 s ARG 21 Ca -0.01 -0.05 -0.05 0.00 -0.13 0.00 0.00 55.73 55.48 3m07 s ARG 21 Cb -0.13 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 3m07 s ARG 21 CO 0.02 0.08 0.01 -0.06 -0.81 0.00 0.00 175.30 174.54 3m07 s PHE 22 N 0.97 3.07 0.24 5.12 0.08 0.10 -1.27 117.98 126.29 3m07 s PHE 22 Ca 0.13 -0.34 0.09 0.00 0.12 0.00 0.00 56.93 56.92 3m07 s PHE 22 Cb -0.14 -2.08 -0.05 0.00 -0.57 0.00 0.00 43.02 40.19 3m07 s PHE 22 CO 0.05 -0.15 -0.14 1.03 -0.10 0.00 0.00 175.22 175.90 3m07 s ARG 23 N 0.85 1.45 -0.24 0.44 0.52 -0.03 -1.23 118.95 120.71 3m07 s ARG 23 Ca 0.01 -1.67 -0.26 0.00 -0.52 0.00 0.00 55.73 53.30 3m07 s ARG 23 Cb -0.14 -1.28 0.08 0.00 0.52 0.00 0.00 34.95 34.13 3m07 s ARG 23 CO 0.02 0.19 0.78 -1.17 0.02 0.00 0.00 175.30 175.14 3m07 s LEU 24 N -3.38 -0.67 -0.22 2.53 2.96 -0.63 -3.31 118.68 115.95 3m07 s LEU 24 Ca 0.25 1.23 -0.07 0.00 -0.22 0.00 0.00 54.13 55.33 3m07 s LEU 24 Cb -0.01 2.35 -0.03 0.00 0.50 0.00 0.00 46.19 49.00 3m07 s LEU 24 CO 0.10 -0.27 0.05 0.86 -1.32 0.00 0.00 176.35 175.76 3m07 s TRP 25 N 0.13 3.10 -0.44 5.38 -0.00 -1.26 -0.53 118.94 125.32 3m07 s TRP 25 Ca -0.01 -0.33 0.06 0.00 -0.00 0.00 0.00 56.10 55.82 3m07 s TRP 25 Cb -0.04 -2.17 0.21 0.00 -0.00 0.00 0.00 33.47 31.47 3m07 s TRP 25 CO 0.01 -0.23 0.54 0.00 -0.00 0.00 0.00 176.95 177.27 3m07 n ALA 26 N 4.47 1.21 0.26 5.86 0.00 0.17 -4.61 120.51 127.87 3m07 n ALA 26 Ca -0.16 -2.54 0.13 0.00 0.00 0.00 0.00 53.44 50.87 3m07 n ALA 26 Cb 0.52 -1.00 0.67 0.00 0.00 0.00 0.00 19.45 19.64 3m07 n ALA 26 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3m07 h THR 27 N 3.76 0.52 -0.00 0.00 1.35 -1.64 -1.84 112.91 115.07 3m07 h THR 27 Ca 0.12 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 3m07 h THR 27 Cb 0.96 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 3m07 h THR 27 CO 0.32 0.14 -0.00 0.61 -0.25 0.00 0.00 175.52 176.33 3m07 n GLY 28 N -0.45 -0.97 3.34 5.82 0.00 0.01 -4.86 105.19 108.09 3m07 n GLY 28 Ca -0.01 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 3m07 n GLY 28 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m07 s GLN 29 N -2.03 1.91 -0.05 1.61 -1.52 -0.69 -4.97 119.66 113.92 3m07 s GLN 29 Ca 0.47 -1.05 -0.01 0.00 -1.95 0.00 0.00 55.36 52.82 3m07 s GLN 29 Cb 0.22 -2.01 -0.26 0.00 -0.22 0.00 0.00 33.01 30.74 3m07 s GLN 29 CO 0.37 0.53 0.64 0.37 -0.25 0.00 0.00 175.29 176.95 3m07 h GLN 30 N 5.01 0.20 -3.69 2.91 -0.00 -1.89 -3.48 115.11 114.17 3m07 h GLN 30 Ca -0.45 -0.34 -0.13 0.00 -0.00 0.00 0.00 58.65 57.72 3m07 h GLN 30 Cb 1.14 0.13 -0.19 0.00 0.00 0.00 0.00 27.48 28.55 3m07 h GLN 30 CO 0.45 1.00 -0.51 -1.59 0.00 0.00 0.00 178.83 178.18 3m07 s LYS 31 N -2.59 0.54 -0.00 1.69 0.00 -1.26 -5.00 119.74 113.11 3m07 s LYS 31 Ca -0.13 -0.61 0.02 0.00 0.00 0.00 0.00 55.97 55.25 3m07 s LYS 31 Cb 0.07 0.22 -0.00 0.00 0.00 0.00 0.00 37.83 38.11 3m07 s LYS 31 CO 0.82 -0.13 -0.06 0.08 0.00 0.00 0.00 175.35 176.06 3m07 s VAL 32 N -2.08 0.45 0.07 1.79 1.01 -1.26 -2.50 120.40 117.88 3m07 s VAL 32 Ca -0.09 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 61.68 3m07 s VAL 32 Cb -0.04 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 3m07 s VAL 32 CO -0.02 0.13 0.03 -0.04 0.00 0.00 0.00 175.10 175.20 3m07 s MET 33 N -0.11 2.72 -0.24 2.72 -1.94 0.14 -1.83 119.30 120.74 3m07 s MET 33 Ca 0.02 -0.75 -0.15 0.00 -1.71 0.00 0.00 55.69 53.11 3m07 s MET 33 Cb -0.02 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.14 3m07 s MET 33 CO -0.00 0.56 0.36 -1.17 -0.01 0.00 0.00 175.02 174.76 3m07 s LEU 34 N -2.25 4.08 -0.49 -0.03 2.96 0.63 -0.28 118.68 123.31 3m07 s LEU 34 Ca 0.26 0.34 -0.17 0.00 -0.22 0.00 0.00 54.13 54.34 3m07 s LEU 34 Cb -0.12 -2.42 0.07 0.00 0.50 0.00 0.00 46.19 44.22 3m07 s LEU 34 CO 0.19 -0.12 0.51 -0.60 -1.32 0.00 0.00 176.35 175.00 3m07 s ARG 35 N 1.72 3.04 -0.21 1.98 3.52 0.23 -1.06 118.95 128.17 3m07 s ARG 35 Ca 0.15 -1.15 -0.04 0.00 -0.13 0.00 0.00 55.73 54.56 3m07 s ARG 35 Cb -0.15 -4.12 -0.01 0.00 -1.56 0.00 0.00 34.95 29.10 3m07 s ARG 35 CO 0.09 -1.13 -0.03 -1.17 -0.81 0.00 0.00 175.30 172.24 3m07 s LEU 36 N 2.10 2.98 -1.55 -0.88 2.96 0.47 -1.91 118.68 122.85 3m07 s LEU 36 Ca 0.09 -0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 53.63 3m07 s LEU 36 Cb -0.22 -1.76 0.03 0.00 0.50 0.00 0.00 46.19 44.74 3m07 s LEU 36 CO 0.09 0.01 0.21 0.00 -1.32 0.00 0.00 176.35 175.34 3m07 n ALA 37 N 4.61 -1.90 -0.37 5.97 0.00 0.58 -1.03 120.51 128.37 3m07 n ALA 37 Ca -0.18 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 52.92 3m07 n ALA 37 Cb 0.51 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3m07 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m07 n GLY 38 N -2.22 2.23 3.48 0.00 0.00 -1.26 -5.02 105.19 102.39 3m07 n GLY 38 Ca -0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 3m07 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m07 s LYS 39 N -0.01 3.38 0.41 1.61 1.02 -0.20 -5.06 119.74 120.89 3m07 s LYS 39 Ca 0.00 -0.58 -0.18 0.00 0.02 0.00 0.00 55.97 55.23 3m07 s LYS 39 Cb 0.00 -2.75 -0.10 0.00 -0.52 0.00 0.00 37.83 34.46 3m07 s LYS 39 CO 0.00 0.33 0.88 -0.51 -0.92 0.00 0.00 175.35 175.12 3m07 s ASP 40 N 0.10 6.82 -0.19 2.83 -0.00 -1.26 -0.39 116.67 124.58 3m07 s ASP 40 Ca -0.03 1.51 -0.09 0.00 -0.00 0.00 0.00 52.55 53.94 3m07 s ASP 40 Cb -0.14 -2.47 0.07 0.00 -0.00 0.00 0.00 42.92 40.38 3m07 s ASP 40 CO 0.03 -0.34 0.43 -1.10 -0.00 0.00 0.00 175.17 174.19 3m07 s GLN 41 N -3.27 0.39 0.20 8.23 -0.21 -0.22 -4.95 119.66 119.82 3m07 s GLN 41 Ca 0.58 0.91 -0.30 0.00 0.02 0.00 0.00 55.36 56.57 3m07 s GLN 41 Cb -0.10 0.12 -0.08 0.00 1.00 0.00 0.00 33.01 33.95 3m07 s GLN 41 CO 0.18 -0.19 1.23 -2.00 -2.12 0.00 0.00 175.29 172.38 3m07 s GLU 42 N 1.85 4.47 0.24 2.91 2.12 -1.26 -0.27 118.70 128.76 3m07 s GLU 42 Ca -0.07 1.93 -0.10 0.00 0.36 0.00 0.00 54.97 57.09 3m07 s GLU 42 Cb -0.09 -3.22 -0.07 0.00 0.26 0.00 0.00 34.13 31.00 3m07 s GLU 42 CO -0.13 -0.12 0.57 -1.64 -0.54 0.00 0.00 175.26 173.40 3m07 s MET 43 N -0.33 3.83 -0.17 4.30 -1.94 -0.76 -4.86 119.30 119.36 3m07 s MET 43 Ca 0.53 0.32 -0.24 0.00 -1.71 0.00 0.00 55.69 54.60 3m07 s MET 43 Cb -0.34 -2.62 -0.02 0.00 2.01 0.00 0.00 34.83 33.86 3m07 s MET 43 CO 0.38 0.29 0.75 -1.14 -0.01 0.00 0.00 175.02 175.30 3m07 s GLN 44 N -2.85 4.28 -0.37 2.03 2.00 -0.19 -4.72 119.66 119.85 3m07 s GLN 44 Ca 0.48 0.87 -0.29 0.00 -2.00 0.00 0.00 55.36 54.43 3m07 s GLN 44 Cb -0.11 -3.56 0.01 0.00 0.80 0.00 0.00 33.01 30.15 3m07 s GLN 44 CO 0.21 -0.26 1.28 0.00 -0.50 0.00 0.00 175.29 176.01 3m07 s ALA 45 N 1.94 3.25 -0.41 1.58 0.00 -1.26 -1.36 121.76 125.50 3m07 s ALA 45 Ca 0.35 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.26 3m07 s ALA 45 Cb -0.16 -3.83 0.44 0.00 0.00 0.00 0.00 23.12 19.57 3m07 s ALA 45 CO 0.12 -2.00 1.35 0.27 0.00 0.00 0.00 175.76 175.50 3m07 n ASN 46 N 7.91 5.45 0.00 0.00 6.94 -0.51 -5.00 115.26 130.05 3m07 n ASN 46 Ca 0.14 -3.75 0.00 0.00 -0.02 0.00 0.00 54.58 50.95 3m07 n ASN 46 Cb 0.47 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 3m07 n ASN 46 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3m07 n GLY 47 N -0.69 -0.56 2.44 4.83 0.00 -1.26 -4.83 105.19 105.13 3m07 n GLY 47 Ca 0.46 -1.37 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 3m07 n GLY 47 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m07 n ASP 48 N -0.55 -5.30 0.00 1.61 8.00 -1.26 -2.32 116.55 116.73 3m07 n ASP 48 Ca 0.00 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3m07 n ASP 48 Cb 0.00 -4.40 0.00 0.00 -0.02 0.00 0.00 41.12 36.70 3m07 n ASP 48 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m07 n GLY 49 N -0.87 0.96 3.76 0.44 0.00 -1.26 -4.90 105.19 103.32 3m07 n GLY 49 Ca -0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 3m07 n GLY 49 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3m07 s TRP 50 N -2.91 3.85 -0.00 1.61 0.52 -0.98 -0.65 118.94 120.38 3m07 s TRP 50 Ca 0.00 1.85 0.06 0.00 0.02 0.00 0.00 56.10 58.03 3m07 s TRP 50 Cb 0.00 -2.97 -0.02 0.00 -1.15 0.00 0.00 33.47 29.33 3m07 s TRP 50 CO 0.00 0.30 -0.18 -0.06 0.02 0.00 0.00 176.95 177.03 3m07 s PHE 51 N -1.35 1.62 0.01 -1.98 0.08 0.31 -1.42 117.98 115.25 3m07 s PHE 51 Ca 0.45 -0.32 -0.04 0.00 0.12 0.00 0.00 56.93 57.14 3m07 s PHE 51 Cb -0.23 -1.03 -0.01 0.00 -0.57 0.00 0.00 43.02 41.18 3m07 s PHE 51 CO 0.29 -0.01 0.06 0.99 -0.10 0.00 0.00 175.22 176.46 3m07 s THR 52 N -0.50 0.10 -0.22 0.64 2.01 -0.46 -1.60 115.64 115.60 3m07 s THR 52 Ca 0.07 -0.84 -0.11 0.00 0.31 0.00 0.00 61.69 61.12 3m07 s THR 52 Cb -0.07 -0.42 0.08 0.00 0.01 0.00 0.00 72.50 72.09 3m07 s THR 52 CO -0.00 -0.46 0.53 -0.22 -0.69 0.00 0.00 174.62 173.77 3m07 s LEU 53 N -1.52 -0.58 -0.15 4.42 2.96 -0.37 -1.02 118.68 122.42 3m07 s LEU 53 Ca -0.14 1.18 -0.12 0.00 -0.22 0.00 0.00 54.13 54.84 3m07 s LEU 53 Cb -0.08 1.78 -0.05 0.00 0.50 0.00 0.00 46.19 48.35 3m07 s LEU 53 CO -0.00 -0.22 0.23 -1.81 -1.32 0.00 0.00 176.35 173.23 3m07 s ASP 54 N 1.86 6.38 -0.11 3.68 1.01 -1.26 -0.72 116.67 127.52 3m07 s ASP 54 Ca -0.08 0.45 0.00 0.00 0.71 0.00 0.00 52.55 53.63 3m07 s ASP 54 Cb -0.08 -2.14 0.02 0.00 1.01 0.00 0.00 42.92 41.73 3m07 s ASP 54 CO -0.16 0.19 -0.09 -0.69 0.21 0.00 0.00 175.17 174.63 3m07 s VAL 55 N 0.09 1.11 0.38 -1.27 1.01 -0.07 -4.99 120.40 116.66 3m07 s VAL 55 Ca 0.14 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 3m07 s VAL 55 Cb -0.12 -1.10 -0.10 0.00 0.00 0.00 0.00 36.38 35.05 3m07 s VAL 55 CO 0.03 0.38 0.95 0.00 0.00 0.00 0.00 175.10 176.46 3m07 s ALA 56 N 1.52 3.12 0.00 5.51 0.00 -1.26 -1.39 121.76 129.25 3m07 s ALA 56 Ca 0.02 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.45 3m07 s ALA 56 Cb -0.13 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3m07 s ALA 56 CO -0.07 0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.23 3m07 n GLY 57 N -0.03 1.86 3.68 0.00 0.00 0.88 -4.97 105.19 106.60 3m07 n GLY 57 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3m07 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m07 s VAL 58 N -2.80 2.79 0.31 1.61 1.01 -1.26 -4.98 120.40 117.08 3m07 s VAL 58 Ca 0.00 0.07 -0.07 0.00 0.00 0.00 0.00 61.98 61.98 3m07 s VAL 58 Cb 0.00 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 3m07 s VAL 58 CO 0.00 -0.00 0.61 0.42 0.00 0.00 0.00 175.10 176.13 3m07 s THR 59 N 3.51 4.94 0.44 3.92 -4.23 -1.26 -4.86 115.64 118.10 3m07 s THR 59 Ca 0.84 0.30 -0.26 0.00 -1.18 0.00 0.00 61.69 61.39 3m07 s THR 59 Cb -0.44 -3.71 -0.09 0.00 1.34 0.00 0.00 72.50 69.61 3m07 s THR 59 CO 0.38 -0.32 1.45 -2.65 -0.54 0.00 0.00 174.62 172.95 3m07 n PRO 60 N -0.86 2.36 -0.07 3.99 -0.02 -1.26 -2.23 135.00 136.91 3m07 n PRO 60 Ca -0.00 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3m07 n PRO 60 Cb 0.54 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3m07 n PRO 60 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m07 n GLY 61 N 0.54 0.94 3.70 -1.23 0.00 0.56 -4.98 105.19 104.72 3m07 n GLY 61 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3m07 n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m07 s THR 62 N -2.41 2.96 0.22 2.61 2.01 -0.95 -4.70 115.64 115.38 3m07 s THR 62 Ca 0.00 0.54 -0.20 0.00 0.31 0.00 0.00 61.69 62.34 3m07 s THR 62 Cb 0.00 -3.34 -0.08 0.00 0.01 0.00 0.00 72.50 69.08 3m07 s THR 62 CO 0.00 0.02 0.73 -1.83 -0.69 0.00 0.00 174.62 172.84 3m07 s GLU 63 N 2.03 4.27 0.15 4.92 -1.05 -1.26 -1.42 118.70 126.34 3m07 s GLU 63 Ca 0.71 0.88 -0.14 0.00 -0.15 0.00 0.00 54.97 56.28 3m07 s GLU 63 Cb -0.40 -2.90 0.02 0.00 -0.44 0.00 0.00 34.13 30.41 3m07 s GLU 63 CO 0.31 0.40 0.38 1.52 0.95 0.00 0.00 175.26 178.83 3m07 s TYR 64 N -1.50 -0.01 0.19 4.83 -0.85 -0.12 -0.31 117.35 119.58 3m07 s TYR 64 Ca 0.43 -0.34 -0.11 0.00 -0.52 0.00 0.00 57.07 56.53 3m07 s TYR 64 Cb -0.17 0.19 -0.00 0.00 0.38 0.00 0.00 41.96 42.35 3m07 s TYR 64 CO 0.21 -0.74 0.36 -0.80 -1.52 0.00 0.00 175.55 173.06 3m07 s ASN 65 N -2.86 -0.03 0.05 -0.18 -0.87 -0.80 -0.98 114.94 109.26 3m07 s ASN 65 Ca 0.08 -0.86 0.01 0.00 -1.57 0.00 0.00 52.86 50.53 3m07 s ASN 65 Cb 0.02 0.49 -0.04 0.00 -0.02 0.00 0.00 41.25 41.70 3m07 s ASN 65 CO -0.07 -0.97 0.09 -0.36 -2.57 0.00 0.00 177.10 173.22 3m07 s PHE 66 N -3.98 3.25 -0.11 2.20 0.08 -0.62 -0.60 117.98 118.20 3m07 s PHE 66 Ca 0.18 0.14 0.02 0.00 0.12 0.00 0.00 56.93 57.39 3m07 s PHE 66 Cb 0.02 -1.68 0.01 0.00 -0.57 0.00 0.00 43.02 40.81 3m07 s PHE 66 CO 0.02 0.54 -0.17 0.08 -0.10 0.00 0.00 175.22 175.60 3m07 s VAL 67 N -1.32 1.61 0.61 -0.44 1.01 0.62 -0.94 120.40 121.55 3m07 s VAL 67 Ca 0.27 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 3m07 s VAL 67 Cb -0.12 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 3m07 s VAL 67 CO 0.19 0.46 0.97 -0.76 0.00 0.00 0.00 175.10 175.97 3m07 s LEU 68 N 0.96 3.21 0.30 3.92 1.43 0.62 -0.68 118.68 128.43 3m07 s LEU 68 Ca -0.07 1.08 0.10 0.00 -1.03 0.00 0.00 54.13 54.21 3m07 s LEU 68 Cb -0.15 -3.98 0.92 0.00 0.03 0.00 0.00 46.19 43.01 3m07 s LEU 68 CO -0.02 -1.00 1.37 -1.20 0.23 0.00 0.00 176.35 175.73 3m07 n SER 69 N -2.70 0.10 0.17 2.29 7.64 -1.04 0.25 113.62 120.34 3m07 n SER 69 Ca 0.05 1.46 0.07 0.00 1.01 0.00 0.00 58.87 61.45 3m07 n SER 69 Cb 0.56 -0.62 0.09 0.00 -1.01 0.00 0.00 64.21 63.23 3m07 n SER 69 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 3m07 h ASP 70 N 0.00 0.00 0.00 6.43 3.04 -1.92 -3.48 116.42 120.50 3m07 h ASP 70 Ca 0.63 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.42 3m07 h ASP 70 Cb 1.52 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.81 3m07 h ASP 70 CO -0.74 0.28 0.00 0.61 -2.04 0.00 0.00 179.24 177.35 3m07 n GLY 71 N 1.17 1.06 3.72 7.15 0.00 0.14 -5.10 105.19 113.33 3m07 n GLY 71 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3m07 n GLY 71 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3m07 s MET 72 N -0.01 4.25 -0.24 1.61 0.00 -1.26 -4.70 119.30 118.94 3m07 s MET 72 Ca 0.00 2.28 -0.10 0.00 0.00 0.00 0.00 55.69 57.87 3m07 s MET 72 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 34.83 31.60 3m07 s MET 72 CO 0.00 -0.56 0.14 0.08 0.00 0.00 0.00 175.02 174.68 3m07 s VAL 73 N 1.12 5.13 0.10 10.11 1.01 -1.26 -0.28 120.40 136.32 3m07 s VAL 73 Ca 0.68 0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.82 3m07 s VAL 73 Cb -0.42 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 3m07 s VAL 73 CO 0.31 0.34 -0.15 0.68 0.00 0.00 0.00 175.10 176.28 3m07 s VAL 74 N 1.17 1.32 0.91 2.92 -7.23 -0.12 -4.99 120.40 114.40 3m07 s VAL 74 Ca 0.07 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 58.61 3m07 s VAL 74 Cb -0.14 -1.35 0.14 0.00 0.56 0.00 0.00 36.38 35.59 3m07 s VAL 74 CO 0.05 -0.27 1.10 -2.16 -0.31 0.00 0.00 175.10 173.52 3m07 s PRO 75 N -2.14 1.07 -0.09 4.82 0.04 -1.26 -1.59 135.00 135.85 3m07 s PRO 75 Ca 0.04 1.21 -0.30 0.00 0.04 0.00 0.00 61.00 61.99 3m07 s PRO 75 Cb -0.08 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 3m07 s PRO 75 CO 0.03 -2.48 1.48 0.34 0.04 0.00 0.00 177.00 176.41 3m07 s ASP 76 N -2.97 6.79 0.56 6.66 -1.08 -1.26 -4.70 116.67 120.66 3m07 s ASP 76 Ca 0.65 2.03 0.26 0.00 -0.52 0.00 0.00 52.55 54.96 3m07 s ASP 76 Cb -0.21 -2.54 1.61 0.00 -1.46 0.00 0.00 42.92 40.32 3m07 s ASP 76 CO 0.58 -0.84 2.19 1.55 0.52 0.00 0.00 175.17 179.18 3m07 h PRO 77 N 8.82 0.00 -0.70 4.34 0.13 -1.95 -0.04 132.00 142.60 3m07 h PRO 77 Ca -0.35 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.52 3m07 h PRO 77 Cb 1.15 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.12 3m07 h PRO 77 CO 0.95 0.03 0.29 0.00 -0.23 0.00 0.00 178.00 179.04 3m07 n ALA 78 N -2.37 4.66 -1.53 -0.56 0.00 -1.26 -4.07 120.51 115.38 3m07 n ALA 78 Ca -0.03 -2.62 -0.49 0.00 0.00 0.00 0.00 53.44 50.30 3m07 n ALA 78 Cb 0.12 -1.17 -0.04 0.00 0.00 0.00 0.00 19.45 18.36 3m07 n ALA 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3m07 n SER 79 N -0.60 0.55 0.05 0.00 2.88 -0.03 -4.62 113.62 111.84 3m07 n SER 79 Ca 0.43 1.15 0.12 0.00 -1.33 0.00 0.00 58.87 59.24 3m07 n SER 79 Cb 1.36 -1.13 0.20 0.00 -0.75 0.00 0.00 64.21 63.89 3m07 n SER 79 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3m07 n ARG 80 N 1.36 0.25 -3.64 -1.46 3.00 -1.26 -2.75 116.66 112.16 3m07 n ARG 80 Ca 0.15 0.08 -0.05 0.00 -0.01 0.00 0.00 57.85 58.02 3m07 n ARG 80 Cb 0.24 -1.66 -0.07 0.00 0.00 0.00 0.00 32.46 30.97 3m07 n ARG 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3m07 s ALA 81 N -3.14 -2.12 -0.09 7.54 0.00 -1.26 -4.34 121.76 118.35 3m07 s ALA 81 Ca 0.07 1.75 -0.04 0.00 0.00 0.00 0.00 51.96 53.74 3m07 s ALA 81 Cb 0.14 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 3m07 s ALA 81 CO 0.71 -0.17 0.08 -0.65 0.00 0.00 0.00 175.76 175.73 3m07 s GLN 82 N -0.08 3.22 0.10 0.00 -1.52 -1.26 -1.08 119.66 119.03 3m07 s GLN 82 Ca 0.06 -0.29 -0.24 0.00 -1.95 0.00 0.00 55.36 52.94 3m07 s GLN 82 Cb -0.04 -2.99 -0.12 0.00 -0.22 0.00 0.00 33.01 29.64 3m07 s GLN 82 CO -0.11 0.73 1.71 -0.22 -0.25 0.00 0.00 175.29 177.15 3m07 h LYS 83 N 4.89 -0.14 0.00 2.91 3.64 -1.54 -3.45 116.57 122.89 3m07 h LYS 83 Ca -0.52 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3m07 h LYS 83 Cb 1.21 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 3m07 h LYS 83 CO 0.57 -0.09 0.00 0.25 -2.27 0.00 0.00 179.45 177.91 3m07 n THR 84 N -5.19 0.00 -2.97 1.00 -2.24 -1.26 -5.05 114.28 98.57 3m07 n THR 84 Ca -0.07 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.51 3m07 n THR 84 Cb 0.12 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.42 3m07 n THR 84 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3m07 s ASP 85 N 1.00 4.93 0.51 3.42 1.47 -1.26 -4.65 116.67 122.09 3m07 s ASP 85 Ca 0.00 -0.82 0.27 0.00 1.18 0.00 0.00 52.55 53.18 3m07 s ASP 85 Cb 0.00 0.35 1.38 0.00 -0.34 0.00 0.00 42.92 44.32 3m07 s ASP 85 CO 0.00 -1.48 2.04 1.62 0.68 0.00 0.00 175.17 178.03 3m07 h VAL 86 N 0.03 0.53 0.00 2.11 3.04 -1.92 -2.65 116.25 117.39 3m07 h VAL 86 Ca -0.30 -0.62 0.00 0.00 -1.01 0.00 0.00 66.70 64.78 3m07 h VAL 86 Cb 1.29 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 31.97 3m07 h VAL 86 CO 0.40 0.13 -0.81 0.59 -1.01 0.00 0.00 177.57 176.87 3m07 n ASN 87 N -3.57 0.67 -2.01 3.17 3.02 -1.26 -4.70 115.26 110.58 3m07 n ASN 87 Ca -0.01 -0.43 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 3m07 n ASN 87 Cb 0.27 0.63 0.00 0.00 -0.61 0.00 0.00 39.78 40.07 3m07 n ASN 87 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3m07 n GLY 88 N 1.46 -0.02 3.76 7.41 0.00 -1.00 -4.42 105.19 112.38 3m07 n GLY 88 Ca 0.04 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 3m07 n GLY 88 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m07 s PRO 89 N -1.07 3.50 0.56 1.61 0.02 -1.26 -4.32 135.00 134.03 3m07 s PRO 89 Ca 0.00 2.18 -0.04 0.00 0.02 0.00 0.00 61.00 63.16 3m07 s PRO 89 Cb 0.00 -2.45 0.01 0.00 0.02 0.00 0.00 34.50 32.08 3m07 s PRO 89 CO 0.00 -0.89 0.84 -1.12 -0.33 0.00 0.00 177.00 175.51 3m07 s SER 90 N -0.89 5.60 0.07 2.53 0.01 -0.16 -1.44 113.70 119.41 3m07 s SER 90 Ca 0.65 0.56 0.03 0.00 1.31 0.00 0.00 55.95 58.50 3m07 s SER 90 Cb -0.39 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 3m07 s SER 90 CO 0.47 -1.01 -0.08 -0.72 0.41 0.00 0.00 173.24 172.31 3m07 s TYR 91 N -2.89 0.84 -0.01 2.43 -0.85 -0.24 -0.95 117.35 115.68 3m07 s TYR 91 Ca 0.53 -0.62 -0.30 0.00 -0.52 0.00 0.00 57.07 56.16 3m07 s TYR 91 Cb -0.10 -0.48 -0.05 0.00 0.38 0.00 0.00 41.96 41.70 3m07 s TYR 91 CO 0.43 -0.07 1.35 0.08 -1.52 0.00 0.00 175.55 175.82 3m07 s VAL 92 N -2.07 3.84 -0.11 -3.49 1.01 -0.51 -4.33 120.40 114.74 3m07 s VAL 92 Ca -0.02 1.22 -0.04 0.00 0.00 0.00 0.00 61.98 63.14 3m07 s VAL 92 Cb -0.05 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3m07 s VAL 92 CO -0.01 0.00 0.05 -0.69 0.00 0.00 0.00 175.10 174.45 3m07 s VAL 93 N 2.31 4.71 -0.45 2.92 1.01 -1.26 -0.32 120.40 129.31 3m07 s VAL 93 Ca 0.62 -0.09 -0.20 0.00 0.00 0.00 0.00 61.98 62.30 3m07 s VAL 93 Cb -0.30 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.08 3m07 s VAL 93 CO 0.25 0.58 0.64 -0.62 0.00 0.00 0.00 175.10 175.96 3m07 s ASP 94 N -0.67 6.30 0.61 3.32 2.15 -1.26 -4.87 116.67 122.26 3m07 s ASP 94 Ca 0.11 -0.44 0.30 0.00 0.43 0.00 0.00 52.55 52.96 3m07 s ASP 94 Cb -0.12 -2.31 1.67 0.00 -0.30 0.00 0.00 42.92 41.85 3m07 s ASP 94 CO 0.02 -0.80 2.02 -0.65 -0.17 0.00 0.00 175.17 175.59 3m07 h PRO 95 N 8.91 0.00 -0.54 4.34 0.11 -2.00 -2.11 132.00 140.71 3m07 h PRO 95 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3m07 h PRO 95 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3m07 h PRO 95 CO 0.91 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.11 3m07 n GLY 96 N -1.36 2.11 0.26 -0.55 0.00 -1.26 -4.46 105.19 99.93 3m07 n GLY 96 Ca 0.02 -0.74 -0.02 0.00 0.00 0.00 0.00 46.02 45.28 3m07 n GLY 96 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3m07 h SER 97 N 4.23 0.52 -3.38 1.61 4.64 -1.80 -3.41 113.55 115.97 3m07 h SER 97 Ca 0.00 -0.14 -0.55 0.00 -0.47 0.00 0.00 61.79 60.63 3m07 h SER 97 Cb 0.97 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 62.88 3m07 h SER 97 CO 0.00 0.68 0.27 -0.47 -0.87 0.00 0.00 176.83 176.44 3m07 s TYR 98 N -4.74 3.60 -0.45 4.77 5.04 -1.26 -5.02 117.35 119.29 3m07 s TYR 98 Ca -0.07 1.48 -0.20 0.00 -2.44 0.00 0.00 57.07 55.84 3m07 s TYR 98 Cb 0.14 -2.99 0.03 0.00 0.35 0.00 0.00 41.96 39.49 3m07 s TYR 98 CO 0.78 0.00 0.61 0.99 -1.34 0.00 0.00 175.55 176.59 3m07 s THR 99 N 1.06 4.87 0.10 4.34 2.01 -1.26 -5.04 115.64 121.72 3m07 s THR 99 Ca 0.45 -0.10 -0.31 0.00 0.31 0.00 0.00 61.69 62.05 3m07 s THR 99 Cb -0.19 -4.20 -0.07 0.00 0.01 0.00 0.00 72.50 68.05 3m07 s THR 99 CO 0.22 -0.62 1.27 0.26 -0.69 0.00 0.00 174.62 175.06 3m07 s TRP 100 N 2.69 3.36 -0.22 4.92 0.52 -1.26 -4.93 118.94 124.01 3m07 s TRP 100 Ca 0.19 1.18 -0.03 0.00 0.02 0.00 0.00 56.10 57.47 3m07 s TRP 100 Cb -0.16 -3.52 -0.20 0.00 -1.15 0.00 0.00 33.47 28.44 3m07 s TRP 100 CO 0.17 -1.70 -0.04 0.54 0.02 0.00 0.00 176.95 175.94 3m07 n ARG 101 N 3.75 0.68 -2.36 4.98 1.74 -1.26 -4.60 116.66 119.59 3m07 n ARG 101 Ca 0.09 0.21 -0.40 0.00 -0.77 0.00 0.00 57.85 56.98 3m07 n ARG 101 Cb 0.45 -1.58 0.02 0.00 -1.02 0.00 0.00 32.46 30.32 3m07 n ARG 101 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3m07 n ASN 102 N -3.43 7.45 0.07 0.55 3.02 -1.26 -4.69 115.26 116.96 3m07 n ASN 102 Ca -0.42 -3.63 0.11 0.00 -0.03 0.00 0.00 54.58 50.61 3m07 n ASN 102 Cb 0.99 -1.18 0.44 0.00 -0.61 0.00 0.00 39.78 39.43 3m07 n ASN 102 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3m07 n THR 103 N 0.10 0.72 1.49 3.41 -2.24 -1.26 -2.48 114.28 114.02 3m07 n THR 103 Ca 0.50 0.11 0.14 0.00 -2.27 0.00 0.00 64.05 62.54 3m07 n THR 103 Cb 0.26 -0.91 0.67 0.00 -2.10 0.00 0.00 70.33 68.25 3m07 n THR 103 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m07 n GLY 104 N 0.44 -0.94 3.71 3.38 0.00 -1.26 -4.85 105.19 105.68 3m07 n GLY 104 Ca 0.04 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 3m07 n GLY 104 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3m07 s TRP 105 N -2.39 2.77 -0.07 1.61 -0.11 -1.04 -4.87 118.94 114.85 3m07 s TRP 105 Ca 0.32 0.32 0.17 0.00 1.22 0.00 0.00 56.10 58.13 3m07 s TRP 105 Cb 0.20 -4.11 0.33 0.00 -1.50 0.00 0.00 33.47 28.40 3m07 s TRP 105 CO 0.45 -4.26 1.15 1.63 -4.62 0.00 0.00 176.95 171.30 3m07 n LYS 106 N 4.36 0.54 0.00 5.86 4.76 -1.26 -5.03 118.16 127.39 3m07 n LYS 106 Ca 0.16 -2.21 0.00 0.00 -2.87 0.00 0.00 58.31 53.39 3m07 n LYS 106 Cb 0.36 -0.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.89 3m07 n LYS 106 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3m07 n GLY 107 N -0.21 -1.89 3.15 0.72 0.00 -1.26 -4.18 105.19 101.52 3m07 n GLY 107 Ca 0.09 -1.36 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 3m07 n GLY 107 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m07 s SER 108 N -4.00 0.28 0.46 1.61 0.01 -1.26 -4.98 113.70 105.81 3m07 s SER 108 Ca 0.00 -0.79 -0.24 0.00 1.31 0.00 0.00 55.95 56.23 3m07 s SER 108 Cb 0.00 0.28 -0.07 0.00 0.21 0.00 0.00 66.02 66.43 3m07 s SER 108 CO 0.00 -0.67 1.29 -0.13 0.41 0.00 0.00 173.24 174.14 3m07 s ARG 109 N -3.84 3.68 0.36 12.44 3.00 -1.26 -4.83 118.95 128.49 3m07 s ARG 109 Ca 0.05 2.10 0.04 0.00 0.00 0.00 0.00 55.73 57.92 3m07 s ARG 109 Cb 0.06 -2.53 0.66 0.00 0.00 0.00 0.00 34.95 33.14 3m07 s ARG 109 CO -0.10 -0.71 1.97 2.35 0.00 0.00 0.00 175.30 178.80 3m07 h TRP 110 N 2.18 0.65 0.00 -0.53 2.91 -2.00 -2.62 115.95 116.53 3m07 h TRP 110 Ca -0.50 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.51 3m07 h TRP 110 Cb 1.26 -0.21 0.00 0.00 -0.51 0.00 0.00 29.16 29.70 3m07 h TRP 110 CO 0.51 0.49 0.00 1.05 -1.03 0.00 0.00 178.44 179.46 3m07 h GLU 111 N 0.66 0.00 -0.01 2.65 9.09 -1.96 0.02 114.58 125.03 3m07 h GLU 111 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.58 3m07 h GLU 111 Cb 0.08 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.18 3m07 h GLU 111 CO -0.02 0.00 -0.11 1.04 0.05 0.00 0.00 179.01 179.97 3m07 n GLN 112 N -2.66 1.14 -2.01 1.06 6.02 -0.99 -4.82 117.38 115.13 3m07 n GLN 112 Ca -0.01 -0.59 -0.42 0.00 -0.01 0.00 0.00 57.00 55.97 3m07 n GLN 112 Cb 0.11 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 3m07 n GLN 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3m07 s ALA 113 N -2.26 3.69 -0.19 -1.58 0.00 -0.01 -4.83 121.76 116.57 3m07 s ALA 113 Ca 0.32 1.30 -0.02 0.00 0.00 0.00 0.00 51.96 53.57 3m07 s ALA 113 Cb 0.20 -3.58 0.06 0.00 0.00 0.00 0.00 23.12 19.80 3m07 s ALA 113 CO 0.43 -0.73 0.02 0.08 0.00 0.00 0.00 175.76 175.55 3m07 s VAL 114 N 0.74 0.71 0.00 0.00 1.01 -1.26 -4.36 120.40 117.24 3m07 s VAL 114 Ca 0.65 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 3m07 s VAL 114 Cb -0.42 -1.15 -0.06 0.00 0.00 0.00 0.00 36.38 34.75 3m07 s VAL 114 CO 0.35 -0.16 0.41 -0.69 0.00 0.00 0.00 175.10 175.01 3m07 s VAL 115 N 1.77 5.04 -0.23 2.92 1.01 -0.18 -1.52 120.40 129.22 3m07 s VAL 115 Ca -0.01 0.81 0.01 0.00 0.00 0.00 0.00 61.98 62.78 3m07 s VAL 115 Cb -0.17 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.56 3m07 s VAL 115 CO -0.08 0.56 -0.05 -0.47 0.00 0.00 0.00 175.10 175.06 3m07 s TYR 116 N -1.10 2.39 -0.24 5.22 5.04 0.21 -0.30 117.35 128.57 3m07 s TYR 116 Ca 0.24 -1.74 -0.25 0.00 -2.44 0.00 0.00 57.07 52.88 3m07 s TYR 116 Cb -0.16 -1.58 -0.01 0.00 0.35 0.00 0.00 41.96 40.56 3m07 s TYR 116 CO 0.14 -0.77 0.83 -2.00 -1.34 0.00 0.00 175.55 172.40 3m07 s GLU 117 N 1.40 4.19 0.15 4.97 2.12 0.53 -0.74 118.70 131.32 3m07 s GLU 117 Ca -0.06 0.94 0.09 0.00 0.36 0.00 0.00 54.97 56.30 3m07 s GLU 117 Cb -0.19 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.52 3m07 s GLU 117 CO -0.06 -0.51 -0.20 0.00 -0.54 0.00 0.00 175.26 173.95 3m07 s MET 118 N 2.80 1.26 -0.26 4.30 0.23 -0.16 -1.24 119.30 126.23 3m07 s MET 118 Ca 0.35 -1.35 -0.03 0.00 -1.03 0.00 0.00 55.69 53.62 3m07 s MET 118 Cb -0.15 -1.40 0.02 0.00 -1.53 0.00 0.00 34.83 31.76 3m07 s MET 118 CO 0.08 0.30 -0.02 -1.58 -2.03 0.00 0.00 175.02 171.77 3m07 s HIS 119 N -1.75 3.07 0.23 3.16 2.46 -1.26 -1.47 115.29 119.74 3m07 s HIS 119 Ca 0.14 -1.30 -0.07 0.00 0.47 0.00 0.00 55.06 54.30 3m07 s HIS 119 Cb -0.07 -2.12 0.28 0.00 -0.13 0.00 0.00 32.58 30.53 3m07 s HIS 119 CO 0.06 -0.66 1.87 1.15 -2.47 0.00 0.00 174.74 174.69 3m07 h THR 120 N 5.99 1.11 0.00 0.89 2.02 -1.91 -0.87 112.91 120.15 3m07 h THR 120 Ca -0.34 -0.35 -0.07 0.00 0.77 0.00 0.00 66.41 66.42 3m07 h THR 120 Cb 1.12 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 3m07 h THR 120 CO 0.59 0.19 -0.33 1.23 0.37 0.00 0.00 175.52 177.56 3m07 h GLY 121 N 1.03 0.00 0.00 2.16 0.00 -1.91 -3.24 103.07 101.11 3m07 h GLY 121 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3m07 h GLY 121 CO -0.13 0.00 -0.66 -1.30 0.00 0.00 0.00 176.54 174.45 3m07 n THR 122 N -4.00 0.00 0.08 4.70 -2.24 -1.01 -4.09 114.28 107.71 3m07 n THR 122 Ca -0.02 -0.21 0.03 0.00 -2.27 0.00 0.00 64.05 61.58 3m07 n THR 122 Cb 0.39 0.94 0.42 0.00 -2.10 0.00 0.00 70.33 69.98 3m07 n THR 122 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3m07 h PHE 123 N 0.00 0.35 -3.55 4.78 3.57 -1.19 -2.18 116.94 118.73 3m07 h PHE 123 Ca 0.00 -0.02 -0.30 0.00 3.53 0.00 0.00 57.97 61.19 3m07 h PHE 123 Cb 0.31 -0.11 -0.15 0.00 2.79 0.00 0.00 35.95 38.80 3m07 h PHE 123 CO 0.00 0.33 -0.70 0.95 -2.23 0.00 0.00 178.31 176.66 3m07 s THR 124 N -5.07 0.96 0.25 4.41 -4.23 -1.26 -4.66 115.64 106.03 3m07 s THR 124 Ca -0.07 -2.01 -0.05 0.00 -1.18 0.00 0.00 61.69 58.38 3m07 s THR 124 Cb 0.16 -1.90 0.22 0.00 1.34 0.00 0.00 72.50 72.33 3m07 s THR 124 CO 0.73 -0.70 1.84 -0.65 -0.54 0.00 0.00 174.62 175.30 3m07 h PRO 125 N 2.78 0.91 -0.02 3.99 0.11 -1.89 -2.34 132.00 135.55 3m07 h PRO 125 Ca -0.36 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.54 3m07 h PRO 125 Cb 1.19 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 3m07 h PRO 125 CO 0.64 0.61 -0.69 0.93 -0.21 0.00 0.00 178.00 179.27 3m07 h GLU 126 N 0.94 0.11 -0.92 1.05 5.08 -1.96 -3.48 114.58 115.42 3m07 h GLU 126 Ca 0.39 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.57 3m07 h GLU 126 Cb 0.23 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3m07 h GLU 126 CO -0.19 0.76 -0.12 0.41 -1.00 0.00 0.00 179.01 178.87 3m07 n GLY 127 N 0.46 0.29 3.44 -3.84 0.00 -0.88 -5.03 105.19 99.63 3m07 n GLY 127 Ca -0.02 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 3m07 n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m07 s THR 128 N -2.40 1.97 0.20 2.61 -4.23 -1.25 -4.00 115.64 108.54 3m07 s THR 128 Ca 0.03 -2.22 -0.11 0.00 -1.18 0.00 0.00 61.69 58.21 3m07 s THR 128 Cb -0.01 -2.36 0.14 0.00 1.34 0.00 0.00 72.50 71.60 3m07 s THR 128 CO 0.03 -0.37 1.86 -0.26 -0.54 0.00 0.00 174.62 175.34 3m07 h PHE 129 N 2.29 0.92 -0.64 3.99 0.04 -1.39 -2.46 116.94 119.68 3m07 h PHE 129 Ca -0.40 0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.35 3m07 h PHE 129 Cb 1.24 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 39.05 3m07 h PHE 129 CO 0.73 0.60 0.26 0.00 -0.60 0.00 0.00 178.31 179.31 3m07 h ARG 130 N 0.98 0.96 -0.26 1.51 2.47 -1.83 -2.47 114.38 115.74 3m07 h ARG 130 Ca 0.26 -0.17 -0.07 0.00 -1.26 0.00 0.00 59.98 58.74 3m07 h ARG 130 Cb -0.08 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.07 3m07 h ARG 130 CO -0.05 0.80 -0.14 0.00 0.56 0.00 0.00 179.97 181.14 3m07 h ALA 131 N 1.11 1.27 0.00 0.04 0.00 -1.91 -2.66 119.26 117.10 3m07 h ALA 131 Ca 0.22 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3m07 h ALA 131 Cb 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3m07 h ALA 131 CO -0.02 0.48 -0.27 0.00 0.00 0.00 0.00 179.25 179.45 3m07 h ALA 132 N 1.44 1.52 -0.75 0.00 0.00 -1.00 -2.77 119.26 117.71 3m07 h ALA 132 Ca 0.08 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 54.86 3m07 h ALA 132 Cb 0.50 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 3m07 h ALA 132 CO 0.03 0.33 0.49 0.82 0.00 0.00 0.00 179.25 180.93 3m07 h ILE 133 N 0.00 0.88 0.00 0.00 2.04 -1.11 -1.42 117.51 117.90 3m07 h ILE 133 Ca -0.00 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.66 3m07 h ILE 133 Cb 0.48 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3m07 h ILE 133 CO 0.03 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.29 3m07 h ALA 134 N 1.63 1.00 -0.00 1.87 0.00 -1.63 -2.28 119.26 119.85 3m07 h ALA 134 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3m07 h ALA 134 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3m07 h ALA 134 CO -0.13 0.00 -0.60 1.63 0.00 0.00 0.00 179.25 180.15 3m07 n LYS 135 N -2.84 0.28 -0.30 0.00 4.76 -0.54 -4.45 118.16 115.06 3m07 n LYS 135 Ca -0.00 -0.19 -0.05 0.00 -2.87 0.00 0.00 58.31 55.20 3m07 n LYS 135 Cb 0.21 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 31.98 3m07 n LYS 135 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3m07 h LEU 136 N 0.47 1.01 -0.90 -0.35 3.38 -1.37 -2.16 115.31 115.39 3m07 h LEU 136 Ca 0.00 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.90 3m07 h LEU 136 Cb 0.53 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 3m07 h LEU 136 CO 0.00 0.80 0.59 -0.65 0.09 0.00 0.00 178.44 179.28 3m07 h PRO 137 N 1.13 1.16 -0.38 1.13 0.11 -1.78 -0.14 132.00 133.23 3m07 h PRO 137 Ca 0.29 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.38 3m07 h PRO 137 Cb 0.01 -0.26 -0.04 0.00 0.11 0.00 0.00 31.00 30.81 3m07 h PRO 137 CO -0.05 0.77 0.12 -0.92 -0.21 0.00 0.00 178.00 177.71 3m07 h TYR 138 N 1.19 0.21 -0.58 0.65 3.20 -1.75 -0.89 116.97 119.00 3m07 h TYR 138 Ca 0.34 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.15 3m07 h TYR 138 Cb -0.09 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 3m07 h TYR 138 CO -0.01 0.07 0.05 -0.07 -1.64 0.00 0.00 178.16 176.57 3m07 h LEU 139 N 0.27 0.96 -0.58 2.82 3.38 -0.74 -1.46 115.31 119.97 3m07 h LEU 139 Ca 0.18 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 3m07 h LEU 139 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3m07 h LEU 139 CO -0.20 1.01 0.20 0.00 0.09 0.00 0.00 178.44 179.54 3m07 h ALA 140 N 0.99 0.76 0.00 1.53 0.00 -0.77 -2.34 119.26 119.42 3m07 h ALA 140 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3m07 h ALA 140 Cb 0.48 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3m07 h ALA 140 CO 0.02 0.40 0.00 1.49 0.00 0.00 0.00 179.25 181.16 3m07 h GLU 141 N 0.81 0.00 -0.47 0.00 4.22 -1.03 -2.46 114.58 115.64 3m07 h GLU 141 Ca 0.19 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.50 3m07 h GLU 141 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3m07 h GLU 141 CO -0.01 0.00 -0.21 1.25 -2.18 0.00 0.00 179.01 177.87 3m07 h LEU 142 N 0.00 0.98 0.00 1.64 5.85 -0.95 -3.48 115.31 119.35 3m07 h LEU 142 Ca 0.00 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.36 3m07 h LEU 142 Cb 0.77 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.53 3m07 h LEU 142 CO 0.00 1.14 0.00 0.61 -0.34 0.00 0.00 178.44 179.85 3m07 n GLY 143 N -0.16 1.27 3.77 3.75 0.00 -0.91 -4.40 105.19 108.51 3m07 n GLY 143 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3m07 n GLY 143 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m07 s VAL 144 N -2.00 2.14 0.00 1.61 1.01 -1.05 -4.85 120.40 117.26 3m07 s VAL 144 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.11 3m07 s VAL 144 Cb 0.00 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.30 3m07 s VAL 144 CO 0.00 0.02 0.00 0.35 0.00 0.00 0.00 175.10 175.47 3m07 n THR 145 N 0.05 0.00 -3.83 3.92 -2.24 -0.68 -4.56 114.28 106.94 3m07 n THR 145 Ca 0.04 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.31 3m07 n THR 145 Cb 0.41 0.80 -0.17 0.00 -2.10 0.00 0.00 70.33 69.27 3m07 n THR 145 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3m07 s VAL 146 N -1.26 0.32 -0.28 2.28 1.01 -0.57 -1.31 120.40 120.58 3m07 s VAL 146 Ca 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.98 3m07 s VAL 146 Cb 0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 3m07 s VAL 146 CO 0.00 0.23 0.21 -0.63 0.00 0.00 0.00 175.10 174.91 3m07 s ILE 147 N 1.74 5.29 -0.36 2.22 -1.09 0.20 -0.62 121.20 128.57 3m07 s ILE 147 Ca 0.01 0.19 -0.14 0.00 -2.23 0.00 0.00 60.65 58.48 3m07 s ILE 147 Cb -0.13 -3.56 -0.01 0.00 -1.58 0.00 0.00 42.46 37.19 3m07 s ILE 147 CO -0.04 0.23 0.30 -0.70 -1.23 0.00 0.00 174.94 173.49 3m07 s GLU 148 N 1.79 3.37 -0.21 2.79 2.12 0.08 -1.43 118.70 127.22 3m07 s GLU 148 Ca 0.08 -0.68 -0.19 0.00 0.36 0.00 0.00 54.97 54.54 3m07 s GLU 148 Cb -0.16 -3.86 -0.03 0.00 0.26 0.00 0.00 34.13 30.35 3m07 s GLU 148 CO 0.11 -0.56 0.56 0.08 -0.54 0.00 0.00 175.26 174.92 3m07 s VAL 149 N 1.82 5.06 0.93 3.70 1.01 -0.30 -0.98 120.40 131.64 3m07 s VAL 149 Ca 0.08 1.04 -0.10 0.00 0.00 0.00 0.00 61.98 63.00 3m07 s VAL 149 Cb -0.17 -3.88 0.15 0.00 0.00 0.00 0.00 36.38 32.47 3m07 s VAL 149 CO 0.11 0.14 1.14 -0.04 0.00 0.00 0.00 175.10 176.44 3m07 s MET 150 N 1.83 0.91 0.35 2.72 1.00 -0.54 -1.19 119.30 124.39 3m07 s MET 150 Ca 0.26 1.48 -0.28 0.00 0.00 0.00 0.00 55.69 57.15 3m07 s MET 150 Cb -0.16 -1.72 -0.12 0.00 0.00 0.00 0.00 34.83 32.84 3m07 s MET 150 CO 0.10 -2.68 1.41 -2.30 0.00 0.00 0.00 175.02 171.54 3m07 n PRO 151 N -4.26 2.42 0.00 2.03 -0.02 -1.25 -4.68 135.00 129.24 3m07 n PRO 151 Ca 0.11 0.85 0.06 0.00 -2.02 0.00 0.00 63.50 62.50 3m07 n PRO 151 Cb 0.52 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 3m07 n PRO 151 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3m07 n VAL 152 N 0.56 0.00 -1.65 -1.45 0.24 -1.26 -4.33 118.33 110.43 3m07 n VAL 152 Ca 0.04 -0.27 -0.50 0.00 -2.04 0.00 0.00 64.34 61.57 3m07 n VAL 152 Cb 0.37 1.06 -0.05 0.00 -1.47 0.00 0.00 33.84 33.75 3m07 n VAL 152 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m07 n ALA 153 N -0.85 0.36 -1.68 2.33 0.00 -1.26 -0.08 120.51 119.33 3m07 n ALA 153 Ca 0.04 0.44 -0.45 0.00 0.00 0.00 0.00 53.44 53.47 3m07 n ALA 153 Cb 0.23 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.38 3m07 n ALA 153 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3m07 n GLN 154 N 3.85 2.16 -4.43 0.00 -0.06 -0.22 -4.29 117.38 114.39 3m07 n GLN 154 Ca 0.19 0.77 -0.21 0.00 -2.00 0.00 0.00 57.00 55.76 3m07 n GLN 154 Cb 0.24 -2.47 -0.11 0.00 -4.06 0.00 0.00 30.24 23.84 3m07 n GLN 154 CO 0.00 0.00 0.00 -0.59 -0.20 0.00 0.00 177.06 176.27 3m07 s PHE 155 N 0.17 1.91 0.31 3.69 -0.12 -1.26 -0.94 117.98 121.75 3m07 s PHE 155 Ca 0.70 -0.92 -0.29 0.00 -0.05 0.00 0.00 56.93 56.37 3m07 s PHE 155 Cb -0.63 -1.21 -0.11 0.00 -0.63 0.00 0.00 43.02 40.44 3m07 s PHE 155 CO 0.47 0.04 1.43 0.20 -0.05 0.00 0.00 175.22 177.31 3m07 s GLY 156 N -3.46 2.67 0.00 1.99 0.00 -1.24 -4.56 107.32 102.72 3m07 s GLY 156 Ca 0.35 1.41 0.00 0.00 0.00 0.00 0.00 44.72 46.47 3m07 s GLY 156 CO 0.14 2.20 0.00 0.61 0.00 0.00 0.00 173.10 176.05 3m07 n GLY 157 N 1.30 -2.28 0.03 0.20 0.00 -1.24 -4.55 105.19 98.67 3m07 n GLY 157 Ca 0.03 -1.54 0.11 0.00 0.00 0.00 0.00 46.02 44.62 3m07 n GLY 157 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3m07 n GLU 158 N -0.95 0.47 -4.80 1.61 0.28 -1.26 -4.93 120.64 111.05 3m07 n GLU 158 Ca 0.00 -0.06 -0.25 0.00 -0.16 0.00 0.00 57.16 56.68 3m07 n GLU 158 Cb 0.00 -1.59 -0.16 0.00 1.43 0.00 0.00 31.44 31.12 3m07 n GLU 158 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 3m07 s ARG 159 N -3.34 1.63 0.00 3.44 0.52 -1.26 -4.86 118.95 115.08 3m07 s ARG 159 Ca -0.01 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.60 3m07 s ARG 159 Cb 0.14 -1.46 0.00 0.00 0.52 0.00 0.00 34.95 34.15 3m07 s ARG 159 CO 0.85 0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.85 3m07 n GLY 160 N 3.02 1.53 0.23 -3.53 0.00 -1.26 -3.05 105.19 102.13 3m07 n GLY 160 Ca -0.17 -0.67 -0.01 0.00 0.00 0.00 0.00 46.02 45.17 3m07 n GLY 160 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3m07 h TRP 161 N 0.00 0.39 0.00 1.61 4.06 -1.95 -3.47 115.95 116.58 3m07 h TRP 161 Ca 0.00 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.88 3m07 h TRP 161 Cb 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 29.16 28.06 3m07 h TRP 161 CO 0.00 0.56 0.00 0.41 -3.56 0.00 0.00 178.44 175.85 3m07 n GLY 162 N -0.54 1.48 0.16 1.49 0.00 -1.26 -4.07 105.19 102.45 3m07 n GLY 162 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 3m07 n GLY 162 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3m07 n TYR 163 N 0.00 0.01 -0.62 1.61 4.01 -1.26 -2.50 117.16 118.40 3m07 n TYR 163 Ca 0.00 -0.01 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 3m07 n TYR 163 Cb 0.00 0.00 0.36 0.00 -0.31 0.00 0.00 39.34 39.39 3m07 n TYR 163 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3m07 n ASP 164 N -0.59 4.77 -4.61 7.72 8.00 -1.26 -4.55 116.55 126.03 3m07 n ASP 164 Ca 0.21 -2.44 -0.42 0.00 0.71 0.00 0.00 54.79 52.84 3m07 n ASP 164 Cb 0.18 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 3m07 n ASP 164 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m07 n GLY 165 N 1.14 -0.17 0.00 0.44 0.00 -1.04 -3.48 105.19 102.08 3m07 n GLY 165 Ca 0.26 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.48 3m07 n GLY 165 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3m07 n VAL 166 N -0.26 0.00 -3.42 1.61 0.24 -0.12 -1.54 118.33 114.84 3m07 n VAL 166 Ca 0.09 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.95 3m07 n VAL 166 Cb 0.37 -0.35 -0.03 0.00 -1.47 0.00 0.00 33.84 32.36 3m07 n VAL 166 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3m07 s LEU 167 N -2.30 6.33 0.08 1.34 1.43 -1.02 -4.92 118.68 119.62 3m07 s LEU 167 Ca 0.00 -3.01 0.16 0.00 -1.03 0.00 0.00 54.13 50.26 3m07 s LEU 167 Cb 0.00 -2.13 0.70 0.00 0.03 0.00 0.00 46.19 44.79 3m07 s LEU 167 CO 0.00 -0.44 1.51 0.18 0.23 0.00 0.00 176.35 177.83 3m07 n LEU 168 N 3.47 0.20 -0.67 1.79 4.77 -1.26 -1.70 117.00 123.61 3m07 n LEU 168 Ca 0.16 0.55 0.09 0.00 -0.03 0.00 0.00 56.01 56.78 3m07 n LEU 168 Cb 0.43 -0.53 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3m07 n LEU 168 CO 0.36 -0.37 0.49 -1.22 -1.33 0.00 0.00 177.39 175.32 3m07 n TYR 169 N -1.73 0.00 -3.94 -1.77 4.01 -1.26 -4.82 117.16 107.66 3m07 n TYR 169 Ca 0.03 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.42 3m07 n TYR 169 Cb 0.17 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.06 3m07 n TYR 169 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3m07 s ALA 170 N -1.61 2.74 0.28 -0.72 0.00 -0.69 -4.48 121.76 117.29 3m07 s ALA 170 Ca 0.20 -1.24 -0.29 0.00 0.00 0.00 0.00 51.96 50.62 3m07 s ALA 170 Cb 0.15 -1.66 -0.10 0.00 0.00 0.00 0.00 23.12 21.51 3m07 s ALA 170 CO 0.27 -0.52 1.28 -1.25 0.00 0.00 0.00 175.76 175.54 3m07 s PRO 171 N 1.43 4.40 0.16 0.00 0.04 -1.26 -1.06 135.00 138.71 3m07 s PRO 171 Ca 0.04 2.12 -0.32 0.00 0.04 0.00 0.00 61.00 62.88 3m07 s PRO 171 Cb -0.15 -3.12 -0.12 0.00 0.04 0.00 0.00 34.50 31.15 3m07 s PRO 171 CO -0.04 -0.16 1.75 1.58 0.04 0.00 0.00 177.00 180.17 3m07 n HIS 172 N 1.43 2.60 0.29 0.56 -0.00 0.88 -4.73 115.22 116.25 3m07 n HIS 172 Ca 0.02 0.01 0.18 0.00 0.46 0.00 0.00 57.72 58.39 3m07 n HIS 172 Cb 0.42 -2.67 0.98 0.00 -0.12 0.00 0.00 29.99 28.61 3m07 n HIS 172 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 3m07 h SER 173 N 7.37 0.00 0.44 0.26 4.64 -1.83 -0.89 113.55 123.54 3m07 h SER 173 Ca -0.45 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.81 3m07 h SER 173 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 3m07 h SER 173 CO 0.94 0.00 -0.30 0.00 -0.87 0.00 0.00 176.83 176.60 3m07 h ALA 174 N 1.90 1.31 0.00 5.18 0.00 -1.88 -3.05 119.26 122.72 3m07 h ALA 174 Ca 0.02 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.44 3m07 h ALA 174 Cb 0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3m07 h ALA 174 CO -0.00 0.38 -1.33 1.88 0.00 0.00 0.00 179.25 180.18 3m07 h TYR 175 N 0.00 0.00 0.00 0.00 0.05 -1.41 -3.43 116.97 112.18 3m07 h TYR 175 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3m07 h TYR 175 Cb 0.61 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.35 3m07 h TYR 175 CO 0.00 0.82 0.00 0.41 -1.05 0.00 0.00 178.16 178.34 3m07 n GLY 176 N 1.43 -1.07 3.91 3.88 0.00 -1.11 -0.98 105.19 111.25 3m07 n GLY 176 Ca -0.09 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.03 3m07 n GLY 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m07 s THR 177 N -1.59 2.16 0.25 2.61 -4.23 -1.26 -4.15 115.64 109.43 3m07 s THR 177 Ca 0.00 -0.03 -0.03 0.00 -1.18 0.00 0.00 61.69 60.45 3m07 s THR 177 Cb 0.00 -3.03 0.23 0.00 1.34 0.00 0.00 72.50 71.03 3m07 s THR 177 CO 0.00 -0.04 1.74 -0.65 -0.54 0.00 0.00 174.62 175.13 3m07 h PRO 178 N -0.93 0.47 -0.01 3.99 0.11 -1.89 -1.65 132.00 132.10 3m07 h PRO 178 Ca -0.46 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3m07 h PRO 178 Cb 1.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3m07 h PRO 178 CO 0.65 0.31 -0.38 -0.44 -0.21 0.00 0.00 178.00 177.92 3m07 h ASP 179 N 0.48 0.01 -0.63 -2.05 3.32 -1.98 -0.62 116.42 114.95 3m07 h ASP 179 Ca 0.43 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.45 3m07 h ASP 179 Cb 0.65 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3m07 h ASP 179 CO -0.40 0.39 0.29 0.44 -1.72 0.00 0.00 179.24 178.24 3m07 h ASP 180 N 0.01 0.85 -0.33 6.45 3.32 -1.68 0.20 116.42 125.24 3m07 h ASP 180 Ca -0.00 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 56.79 3m07 h ASP 180 Cb 0.68 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 3m07 h ASP 180 CO 0.05 0.76 -0.22 0.15 -1.72 0.00 0.00 179.24 178.26 3m07 h PHE 181 N 0.88 0.85 -0.98 4.55 3.57 -0.76 -1.96 116.94 123.09 3m07 h PHE 181 Ca 0.22 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.51 3m07 h PHE 181 Cb 0.15 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.65 3m07 h PHE 181 CO 0.01 0.97 0.65 0.87 -2.23 0.00 0.00 178.31 178.57 3m07 h LYS 182 N 0.50 1.25 -0.93 1.11 1.57 -1.01 -1.30 116.57 117.75 3m07 h LYS 182 Ca 0.07 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3m07 h LYS 182 Cb 0.78 -0.28 -0.04 0.00 0.08 0.00 0.00 32.23 32.76 3m07 h LYS 182 CO 0.06 0.83 0.54 0.00 -0.57 0.00 0.00 179.45 180.31 3m07 h ALA 183 N 1.38 1.19 -0.28 3.86 0.00 -0.70 0.60 119.26 125.32 3m07 h ALA 183 Ca 0.37 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 3m07 h ALA 183 Cb -0.08 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.32 3m07 h ALA 183 CO -0.10 0.67 0.10 0.35 0.00 0.00 0.00 179.25 180.27 3m07 h PHE 184 N 1.30 0.44 -0.35 0.00 3.57 -0.72 -0.64 116.94 120.53 3m07 h PHE 184 Ca 0.33 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 3m07 h PHE 184 Cb -0.02 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 3m07 h PHE 184 CO 0.01 0.46 0.15 0.82 -2.23 0.00 0.00 178.31 177.51 3m07 h ILE 185 N 0.29 1.18 -0.33 1.41 2.04 -0.89 -0.28 117.51 120.93 3m07 h ILE 185 Ca 0.09 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 3m07 h ILE 185 Cb 0.21 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3m07 h ILE 185 CO -0.01 0.19 0.18 -0.78 0.00 0.00 0.00 178.15 177.74 3m07 h ASP 186 N 0.42 0.41 -0.51 1.72 3.58 -0.82 -1.14 116.42 120.09 3m07 h ASP 186 Ca 0.12 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 3m07 h ASP 186 Cb 0.16 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 3m07 h ASP 186 CO -0.01 0.38 0.28 0.00 -2.88 0.00 0.00 179.24 177.01 3m07 h ALA 187 N 1.05 0.65 -0.40 -0.78 0.00 -0.96 -1.96 119.26 116.86 3m07 h ALA 187 Ca 0.12 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.00 3m07 h ALA 187 Cb 0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 3m07 h ALA 187 CO -0.02 0.17 0.05 0.00 0.00 0.00 0.00 179.25 179.46 3m07 h ALA 188 N 1.12 0.42 -0.65 0.00 0.00 -0.73 -0.93 119.26 118.48 3m07 h ALA 188 Ca 0.18 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.26 3m07 h ALA 188 Cb 0.05 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3m07 h ALA 188 CO -0.03 -0.35 0.33 0.45 0.00 0.00 0.00 179.25 179.65 3m07 h HIS 189 N 0.17 0.59 -0.29 0.00 -0.00 -0.90 0.01 115.15 114.73 3m07 h HIS 189 Ca 0.20 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.58 3m07 h HIS 189 Cb 0.25 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 3m07 h HIS 189 CO -0.22 0.23 0.13 0.78 -0.00 0.00 0.00 177.93 178.85 3m07 h GLY 190 N 0.58 0.42 0.07 2.45 0.00 -0.55 -0.38 103.07 105.66 3m07 h GLY 190 Ca 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3m07 h GLY 190 CO -0.24 0.18 0.00 -1.72 0.00 0.00 0.00 176.54 174.76 3m07 n TYR 191 N -4.43 0.08 -0.61 5.60 4.01 -0.44 -4.91 117.16 116.45 3m07 n TYR 191 Ca 0.01 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3m07 n TYR 191 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 3m07 n TYR 191 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3m07 n GLY 192 N 0.91 0.66 3.56 2.72 0.00 -0.15 -4.81 105.19 108.08 3m07 n GLY 192 Ca 0.15 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 3m07 n GLY 192 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m07 s LEU 193 N 0.00 3.51 0.56 0.99 1.43 -0.12 -4.89 118.68 120.16 3m07 s LEU 193 Ca 0.00 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 52.91 3m07 s LEU 193 Cb 0.00 -1.87 -0.06 0.00 0.03 0.00 0.00 46.19 44.29 3m07 s LEU 193 CO 0.00 0.17 1.02 -0.44 0.23 0.00 0.00 176.35 177.33 3m07 s SER 194 N 0.38 6.20 -0.08 2.29 0.01 -0.43 -3.21 113.70 118.86 3m07 s SER 194 Ca -0.01 1.69 0.02 0.00 1.31 0.00 0.00 55.95 58.96 3m07 s SER 194 Cb -0.13 -2.52 0.02 0.00 0.21 0.00 0.00 66.02 63.59 3m07 s SER 194 CO 0.02 -0.88 -0.12 -0.69 0.41 0.00 0.00 173.24 171.98 3m07 s VAL 195 N -2.54 1.16 0.12 3.43 1.01 -1.26 -0.63 120.40 121.68 3m07 s VAL 195 Ca 0.61 -0.47 0.10 0.00 0.00 0.00 0.00 61.98 62.23 3m07 s VAL 195 Cb -0.13 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3m07 s VAL 195 CO 0.34 0.37 -0.25 0.68 0.00 0.00 0.00 175.10 176.24 3m07 s VAL 196 N 0.88 2.06 -0.10 2.92 -7.23 -0.51 -0.67 120.40 117.75 3m07 s VAL 196 Ca -0.10 -1.67 0.01 0.00 -1.81 0.00 0.00 61.98 58.41 3m07 s VAL 196 Cb -0.15 -1.83 -0.02 0.00 0.56 0.00 0.00 36.38 34.94 3m07 s VAL 196 CO 0.01 0.04 -0.14 -0.22 -0.31 0.00 0.00 175.10 174.49 3m07 s LEU 197 N -1.98 2.71 -0.10 1.32 2.96 -1.06 -1.15 118.68 121.39 3m07 s LEU 197 Ca 0.11 -0.28 -0.30 0.00 -0.22 0.00 0.00 54.13 53.44 3m07 s LEU 197 Cb -0.10 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 3m07 s LEU 197 CO 0.05 0.23 1.20 -0.62 -1.32 0.00 0.00 176.35 175.90 3m07 s ASP 198 N -0.06 7.03 -0.06 3.68 -1.08 -0.33 -0.74 116.67 125.11 3m07 s ASP 198 Ca -0.03 1.74 0.04 0.00 -0.52 0.00 0.00 52.55 53.78 3m07 s ASP 198 Cb -0.14 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 3m07 s ASP 198 CO 0.04 -0.64 -0.16 -0.51 0.52 0.00 0.00 175.17 174.42 3m07 s ILE 199 N 2.65 1.41 -0.34 4.11 2.07 -0.04 -3.80 121.20 127.27 3m07 s ILE 199 Ca 0.54 -0.68 -0.09 0.00 -1.41 0.00 0.00 60.65 59.02 3m07 s ILE 199 Cb -0.23 -1.23 0.02 0.00 0.13 0.00 0.00 42.46 41.15 3m07 s ILE 199 CO 0.19 0.41 0.14 -0.69 -1.91 0.00 0.00 174.94 173.08 3m07 s VAL 200 N 0.27 4.23 -0.01 4.00 1.01 -1.26 -1.69 120.40 126.95 3m07 s VAL 200 Ca -0.09 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.06 3m07 s VAL 200 Cb -0.14 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.95 3m07 s VAL 200 CO 0.03 -0.10 0.85 0.18 0.00 0.00 0.00 175.10 176.06 3m07 n LEU 201 N 4.92 1.70 0.04 3.92 4.77 -1.26 -4.71 117.00 126.38 3m07 n LEU 201 Ca -0.13 -1.70 0.11 0.00 -0.03 0.00 0.00 56.01 54.27 3m07 n LEU 201 Cb 0.47 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 3m07 n LEU 201 CO 0.34 0.43 -0.28 -0.46 -1.33 0.00 0.00 177.39 176.08 3m07 n ASN 202 N -0.34 0.48 -3.63 -1.43 0.23 -1.26 -4.97 115.26 104.34 3m07 n ASN 202 Ca 0.00 0.07 -0.06 0.00 -0.53 0.00 0.00 54.58 54.07 3m07 n ASN 202 Cb 0.18 1.11 -0.02 0.00 -2.08 0.00 0.00 39.78 38.97 3m07 n ASN 202 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 3m07 s HIS 203 N -3.38 -0.24 0.00 -2.53 -3.43 -1.26 -4.62 115.29 99.83 3m07 s HIS 203 Ca -0.02 0.02 0.03 0.00 -0.80 0.00 0.00 55.06 54.28 3m07 s HIS 203 Cb 0.12 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 31.83 3m07 s HIS 203 CO 0.84 -0.69 -0.04 -0.06 -2.00 0.00 0.00 174.74 172.79 3m07 s PHE 204 N -3.22 2.96 1.21 0.38 0.08 -1.26 -4.95 117.98 113.18 3m07 s PHE 204 Ca 0.09 0.01 -0.18 0.00 0.12 0.00 0.00 56.93 56.97 3m07 s PHE 204 Cb -0.01 -1.63 0.29 0.00 -0.57 0.00 0.00 43.02 41.10 3m07 s PHE 204 CO -0.03 0.41 1.06 0.20 -0.10 0.00 0.00 175.22 176.75 3m07 s GLY 205 N -1.49 1.54 0.13 4.36 0.00 -0.59 -4.78 107.32 106.48 3m07 s GLY 205 Ca 0.18 -0.70 0.24 0.00 0.00 0.00 0.00 44.72 44.44 3m07 s GLY 205 CO 0.09 0.14 1.31 -0.56 0.00 0.00 0.00 173.10 174.08 3m07 h PRO 206 N -2.64 0.00 -5.08 2.90 0.13 -1.91 -3.42 132.00 121.99 3m07 h PRO 206 Ca -0.49 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.97 3m07 h PRO 206 Cb 1.32 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.11 3m07 h PRO 206 CO 0.40 0.00 -0.84 -2.00 -0.23 0.00 0.00 178.00 175.33 3m07 s GLU 207 N -3.18 3.06 0.00 0.86 2.56 -1.26 -4.67 118.70 116.07 3m07 s GLU 207 Ca 0.06 -0.80 0.00 0.00 0.00 0.00 0.00 54.97 54.23 3m07 s GLU 207 Cb 0.13 -2.62 0.00 0.00 2.00 0.00 0.00 34.13 33.64 3m07 s GLU 207 CO 0.72 -0.17 0.00 0.41 -0.56 0.00 0.00 175.26 175.66 3m07 n GLY 208 N 4.55 0.81 3.41 -1.50 0.00 -1.26 -3.73 105.19 107.46 3m07 n GLY 208 Ca -0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 3m07 n GLY 208 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3m07 s ASN 209 N -2.24 6.20 0.00 1.61 2.47 -1.26 -4.86 114.94 116.85 3m07 s ASN 209 Ca 0.00 -1.15 0.21 0.00 0.42 0.00 0.00 52.86 52.34 3m07 s ASN 209 Cb 0.00 -2.28 0.34 0.00 -1.45 0.00 0.00 41.25 37.87 3m07 s ASN 209 CO 0.00 -0.92 1.31 -1.22 -3.72 0.00 0.00 177.10 172.55 3m07 n TYR 210 N 6.05 0.37 -0.30 0.43 4.01 -1.26 -4.47 117.16 121.99 3m07 n TYR 210 Ca -0.08 -0.21 0.09 0.00 -0.16 0.00 0.00 57.90 57.54 3m07 n TYR 210 Cb 0.44 -0.00 0.31 0.00 -0.31 0.00 0.00 39.34 39.78 3m07 n TYR 210 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3m07 h LEU 211 N 4.08 0.78 -1.57 7.72 3.38 -1.94 -1.44 115.31 126.32 3m07 h LEU 211 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3m07 h LEU 211 Cb 0.91 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 3m07 h LEU 211 CO 0.00 0.43 0.28 -0.65 0.09 0.00 0.00 178.44 178.59 3m07 h PRO 212 N 0.85 0.57 -0.02 1.13 0.11 -1.79 0.11 132.00 132.95 3m07 h PRO 212 Ca 0.44 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.48 3m07 h PRO 212 Cb 0.53 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.51 3m07 h PRO 212 CO -0.21 0.38 -0.13 -0.07 -0.21 0.00 0.00 178.00 177.76 3m07 h LEU 213 N 0.59 0.15 -0.53 2.35 3.38 -1.66 -2.92 115.31 116.67 3m07 h LEU 213 Ca 0.16 -0.69 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 3m07 h LEU 213 Cb -0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3m07 h LEU 213 CO -0.03 0.81 0.33 -0.07 0.09 0.00 0.00 178.44 179.57 3m07 h LEU 214 N -0.50 0.62 -6.12 1.67 3.38 -0.97 -3.41 115.31 109.98 3m07 h LEU 214 Ca -0.01 -0.04 -0.30 0.00 0.09 0.00 0.00 57.88 57.61 3m07 h LEU 214 Cb 0.81 -0.16 -0.27 0.00 0.09 0.00 0.00 40.66 41.13 3m07 h LEU 214 CO 0.03 0.48 -0.64 0.00 0.09 0.00 0.00 178.44 178.40 3m07 s ALA 215 N -6.04 -0.86 0.49 1.53 0.00 0.34 -0.81 121.76 116.41 3m07 s ALA 215 Ca -0.13 -0.82 0.22 0.00 0.00 0.00 0.00 51.96 51.24 3m07 s ALA 215 Cb 0.12 -2.24 1.27 0.00 0.00 0.00 0.00 23.12 22.28 3m07 s ALA 215 CO 0.75 -2.16 1.94 -1.35 0.00 0.00 0.00 175.76 174.94 3m07 h PRO 216 N 6.65 0.17 0.00 0.00 0.11 -1.67 0.95 132.00 138.22 3m07 h PRO 216 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3m07 h PRO 216 Cb 1.07 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3m07 h PRO 216 CO 0.17 0.11 0.00 0.00 -0.21 0.00 0.00 178.00 178.07 3m07 n ALA 217 N -2.60 1.63 0.23 -0.75 0.00 -1.26 -2.19 120.51 115.56 3m07 n ALA 217 Ca 0.14 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.59 3m07 n ALA 217 Cb 0.65 -1.16 0.52 0.00 0.00 0.00 0.00 19.45 19.47 3m07 n ALA 217 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3m07 h PHE 218 N 0.00 0.00 -3.84 0.00 3.57 -1.12 -3.43 116.94 112.12 3m07 h PHE 218 Ca 0.00 0.00 -0.68 0.00 3.53 0.00 0.00 57.97 60.82 3m07 h PHE 218 Cb 0.09 0.00 -0.20 0.00 2.79 0.00 0.00 35.95 38.63 3m07 h PHE 218 CO 0.00 0.20 -0.79 -0.06 -2.23 0.00 0.00 178.31 175.43 3m07 s PHE 219 N -4.49 2.60 0.73 0.41 0.08 -0.93 -0.89 117.98 115.49 3m07 s PHE 219 Ca -0.04 -0.23 -0.13 0.00 0.12 0.00 0.00 56.93 56.65 3m07 s PHE 219 Cb 0.15 -1.45 0.04 0.00 -0.57 0.00 0.00 43.02 41.19 3m07 s PHE 219 CO 0.68 0.31 1.12 -1.01 -0.10 0.00 0.00 175.22 176.22 3m07 s HIS 220 N -1.01 2.47 0.04 0.36 3.76 -0.29 -4.76 115.29 115.86 3m07 s HIS 220 Ca 0.16 1.58 -0.16 0.00 -0.15 0.00 0.00 55.06 56.49 3m07 s HIS 220 Cb -0.11 -3.17 -0.30 0.00 1.11 0.00 0.00 32.58 30.12 3m07 s HIS 220 CO 0.07 -1.91 1.08 0.87 -0.85 0.00 0.00 174.74 174.00 3m07 h LYS 221 N -0.57 0.59 0.00 1.40 6.56 -1.94 -3.41 116.57 119.20 3m07 h LYS 221 Ca -0.45 -0.81 -0.15 0.00 -1.06 0.00 0.00 60.65 58.18 3m07 h LYS 221 Cb 1.25 0.27 -0.02 0.00 -0.57 0.00 0.00 32.23 33.15 3m07 h LYS 221 CO 0.52 1.37 -1.17 0.39 -2.06 0.00 0.00 179.45 178.50 3m07 n GLU 222 N -3.83 0.52 -1.68 3.15 1.02 -1.26 -4.99 120.64 113.57 3m07 n GLU 222 Ca -0.14 0.45 -0.45 0.00 -0.02 0.00 0.00 57.16 57.00 3m07 n GLU 222 Cb 0.97 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 30.72 3m07 n GLU 222 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3m07 n ARG 223 N -4.47 2.43 -4.32 3.49 1.74 -1.26 -4.95 116.66 109.31 3m07 n ARG 223 Ca -0.24 0.88 -0.20 0.00 -0.77 0.00 0.00 57.85 57.52 3m07 n ARG 223 Cb 0.54 -2.72 -0.16 0.00 -1.02 0.00 0.00 32.46 29.11 3m07 n ARG 223 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3m07 s MET 224 N 2.26 0.90 0.76 5.56 -1.94 -1.26 -0.66 119.30 124.92 3m07 s MET 224 Ca 0.83 -0.25 -0.05 0.00 -1.71 0.00 0.00 55.69 54.51 3m07 s MET 224 Cb -0.60 -0.85 0.12 0.00 2.01 0.00 0.00 34.83 35.52 3m07 s MET 224 CO 0.40 0.06 1.06 0.95 -0.01 0.00 0.00 175.02 177.48 3m07 s THR 225 N 0.35 2.17 -1.84 2.05 -4.23 0.12 -4.78 115.64 109.47 3m07 s THR 225 Ca -0.05 -0.40 0.16 0.00 -1.18 0.00 0.00 61.69 60.22 3m07 s THR 225 Cb -0.10 -2.77 0.41 0.00 1.34 0.00 0.00 72.50 71.39 3m07 s THR 225 CO 0.00 0.00 1.40 -2.65 -0.54 0.00 0.00 174.62 172.84 3m07 n PRO 226 N -3.03 0.43 0.00 3.99 -0.02 -1.26 -3.51 135.00 131.61 3m07 n PRO 226 Ca 0.13 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 3m07 n PRO 226 Cb 0.60 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 3m07 n PRO 226 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3m07 n TRP 227 N -1.08 0.00 0.00 6.00 8.01 -1.26 -5.12 117.44 124.00 3m07 n TRP 227 Ca 0.11 -0.04 0.00 0.00 -1.31 0.00 0.00 57.50 56.26 3m07 n TRP 227 Cb 0.07 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.37 3m07 n TRP 227 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3m07 n GLY 228 N -0.04 0.44 3.76 6.99 0.00 -1.23 -4.87 105.19 110.25 3m07 n GLY 228 Ca 0.00 -1.25 -0.39 0.00 0.00 0.00 0.00 46.02 44.39 3m07 n GLY 228 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3m07 s ASN 229 N 0.00 5.86 0.43 1.61 -0.87 -1.26 -0.70 114.94 120.01 3m07 s ASN 229 Ca 0.00 2.69 -0.25 0.00 -1.57 0.00 0.00 52.86 53.73 3m07 s ASN 229 Cb 0.00 -2.63 -0.08 0.00 -0.02 0.00 0.00 41.25 38.52 3m07 s ASN 229 CO 0.00 -1.16 1.25 -0.83 -2.57 0.00 0.00 177.10 173.79 3m07 s GLY 230 N -0.86 2.88 0.04 0.66 0.00 0.17 -4.62 107.32 105.58 3m07 s GLY 230 Ca 0.64 1.13 -0.21 0.00 0.00 0.00 0.00 44.72 46.27 3m07 s GLY 230 CO 0.48 1.67 0.61 -0.42 0.00 0.00 0.00 173.10 175.43 3m07 s ILE 231 N -1.35 4.80 -1.36 0.90 1.01 -1.26 -1.14 121.20 122.80 3m07 s ILE 231 Ca 0.60 1.30 -0.15 0.00 0.00 0.00 0.00 60.65 62.39 3m07 s ILE 231 Cb -0.35 -3.95 0.07 0.00 0.01 0.00 0.00 42.46 38.24 3m07 s ILE 231 CO 0.44 0.47 1.94 0.00 0.00 0.00 0.00 174.94 177.78 3m07 n ALA 232 N 2.32 4.56 0.28 9.38 0.00 -0.07 -4.70 120.51 132.29 3m07 n ALA 232 Ca -0.08 -3.93 0.14 0.00 0.00 0.00 0.00 53.44 49.58 3m07 n ALA 232 Cb 0.51 -3.49 0.66 0.00 0.00 0.00 0.00 19.45 17.13 3m07 n ALA 232 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3m07 h TYR 233 N 6.74 0.00 -0.00 0.00 0.05 -1.86 -1.87 116.97 120.03 3m07 h TYR 233 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.27 3m07 h TYR 233 Cb 0.75 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.49 3m07 h TYR 233 CO 1.41 0.00 -0.03 -0.40 -1.05 0.00 0.00 178.16 178.09 3m07 n ASP 234 N -2.49 0.04 -4.68 3.88 5.75 -1.26 -4.31 116.55 113.48 3m07 n ASP 234 Ca -0.00 0.29 -0.39 0.00 -0.01 0.00 0.00 54.79 54.68 3m07 n ASP 234 Cb 0.14 -0.40 -0.06 0.00 -1.03 0.00 0.00 41.12 39.77 3m07 n ASP 234 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3m07 s VAL 235 N -2.89 5.12 0.18 2.12 1.01 -0.70 -5.00 120.40 120.24 3m07 s VAL 235 Ca 0.18 0.98 -0.15 0.00 0.00 0.00 0.00 61.98 62.99 3m07 s VAL 235 Cb 0.19 -3.85 0.13 0.00 0.00 0.00 0.00 36.38 32.85 3m07 s VAL 235 CO 0.52 0.21 1.67 -0.78 0.00 0.00 0.00 175.10 176.72 3m07 h ASP 236 N 7.25 -0.34 -0.52 3.32 3.58 -1.88 -0.40 116.42 127.44 3m07 h ASP 236 Ca -0.36 0.13 -0.03 0.00 0.42 0.00 0.00 57.03 57.19 3m07 h ASP 236 Cb 1.16 0.25 -0.03 0.00 1.72 0.00 0.00 39.33 42.44 3m07 h ASP 236 CO 0.75 -0.12 0.21 0.00 -2.88 0.00 0.00 179.24 177.20 3m07 h ALA 237 N 1.45 1.32 -0.21 -0.78 0.00 -1.94 -0.94 119.26 118.15 3m07 h ALA 237 Ca 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3m07 h ALA 237 Cb 0.35 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3m07 h ALA 237 CO -0.44 0.50 -0.02 0.28 0.00 0.00 0.00 179.25 179.57 3m07 h VAL 238 N 0.81 1.27 -1.01 0.00 2.07 -1.60 -2.14 116.25 115.65 3m07 h VAL 238 Ca 0.19 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.80 3m07 h VAL 238 Cb 0.18 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 3m07 h VAL 238 CO -0.02 0.29 0.66 -0.09 0.02 0.00 0.00 177.57 178.44 3m07 h ARG 239 N 0.13 1.26 -0.32 1.57 2.43 -0.68 -0.82 114.38 117.95 3m07 h ARG 239 Ca 0.06 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3m07 h ARG 239 Cb 0.44 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3m07 h ARG 239 CO 0.01 0.83 0.17 0.00 -1.51 0.00 0.00 179.97 179.48 3m07 h ARG 240 N 1.30 0.44 -0.41 0.20 3.08 -1.04 0.15 114.38 118.09 3m07 h ARG 240 Ca 0.39 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.40 3m07 h ARG 240 Cb -0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 3m07 h ARG 240 CO -0.12 0.37 0.26 -0.92 -1.07 0.00 0.00 179.97 178.49 3m07 h TYR 241 N 0.39 0.49 -0.03 3.04 3.20 -0.68 -1.68 116.97 121.71 3m07 h TYR 241 Ca 0.11 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 3m07 h TYR 241 Cb 0.06 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.17 3m07 h TYR 241 CO -0.03 0.30 -0.09 0.82 -1.64 0.00 0.00 178.16 177.52 3m07 h ILE 242 N 0.53 1.48 -0.30 1.81 1.08 -0.98 -3.04 117.51 118.08 3m07 h ILE 242 Ca 0.16 -1.54 -0.17 0.00 -0.39 0.00 0.00 64.86 62.92 3m07 h ILE 242 Cb -0.03 2.43 -0.00 0.00 -3.07 0.00 0.00 36.82 36.14 3m07 h ILE 242 CO -0.05 0.41 -0.47 0.40 -0.69 0.00 0.00 178.15 177.75 3m07 h ILE 243 N -0.47 1.28 0.00 -0.67 2.04 -0.74 -3.12 117.51 115.83 3m07 h ILE 243 Ca -0.00 -1.66 -0.02 0.00 1.00 0.00 0.00 64.86 64.18 3m07 h ILE 243 Cb 0.72 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 3m07 h ILE 243 CO 0.02 0.54 -0.12 -0.33 0.00 0.00 0.00 178.15 178.26 3m07 h GLU 244 N 0.65 0.00 0.50 2.37 5.08 -1.41 -3.27 114.58 118.50 3m07 h GLU 244 Ca 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3m07 h GLU 244 Cb 1.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 3m07 h GLU 244 CO 0.10 0.12 -0.33 0.00 -1.00 0.00 0.00 179.01 177.90 3m07 h ALA 245 N 1.88 -0.81 -0.82 3.43 0.00 -1.46 0.78 119.26 122.27 3m07 h ALA 245 Ca -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3m07 h ALA 245 Cb 0.59 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 3m07 h ALA 245 CO 0.02 -0.97 0.50 -1.00 0.00 0.00 0.00 179.25 177.79 3m07 h PRO 246 N -0.80 1.10 -0.75 0.00 0.13 -1.71 -1.42 132.00 128.56 3m07 h PRO 246 Ca -0.06 -0.09 -0.06 0.00 -0.87 0.00 0.00 66.00 64.92 3m07 h PRO 246 Cb 0.66 -0.23 -0.03 0.00 0.13 0.00 0.00 31.00 31.52 3m07 h PRO 246 CO 0.05 0.77 0.24 -0.07 -0.23 0.00 0.00 178.00 178.75 3m07 h LEU 247 N 1.12 1.08 -0.06 1.56 4.07 -1.59 -1.82 115.31 119.67 3m07 h LEU 247 Ca 0.29 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 58.05 3m07 h LEU 247 Cb -0.06 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.40 3m07 h LEU 247 CO -0.06 1.00 0.04 0.22 -1.08 0.00 0.00 178.44 178.56 3m07 h TYR 248 N 1.11 0.08 -0.48 1.13 3.20 -0.36 -0.88 116.97 120.76 3m07 h TYR 248 Ca 0.24 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.09 3m07 h TYR 248 Cb 0.30 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 3m07 h TYR 248 CO 0.03 0.05 0.22 -1.49 -1.64 0.00 0.00 178.16 175.32 3m07 h TRP 249 N 0.08 0.71 -0.44 -3.82 4.06 -1.10 0.13 115.95 115.56 3m07 h TRP 249 Ca 0.02 -0.04 -0.05 0.00 2.06 0.00 0.00 58.89 60.88 3m07 h TRP 249 Cb -0.01 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 27.92 3m07 h TRP 249 CO -0.08 0.57 0.09 -0.07 -3.56 0.00 0.00 178.44 175.40 3m07 h LEU 250 N 0.64 0.69 0.05 -4.49 3.38 -1.25 -2.23 115.31 112.09 3m07 h LEU 250 Ca 0.16 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 3m07 h LEU 250 Cb 0.14 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.72 3m07 h LEU 250 CO -0.02 0.76 -0.44 0.74 0.09 0.00 0.00 178.44 179.57 3m07 h THR 251 N 0.59 1.57 0.00 0.22 2.02 -0.91 -2.18 112.91 114.22 3m07 h THR 251 Ca 0.14 -2.25 -0.20 0.00 0.77 0.00 0.00 66.41 64.87 3m07 h THR 251 Cb 0.35 3.02 -0.01 0.00 -1.74 0.00 0.00 68.15 69.77 3m07 h THR 251 CO 0.01 0.62 -0.87 -0.08 0.37 0.00 0.00 175.52 175.57 3m07 h GLU 252 N -0.50 0.19 -0.26 6.66 4.57 -0.85 -3.31 114.58 121.08 3m07 h GLU 252 Ca -0.07 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 3m07 h GLU 252 Cb 1.26 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 3m07 h GLU 252 CO 0.08 0.94 0.00 0.66 -1.18 0.00 0.00 179.01 179.52 3m07 n TYR 253 N -3.66 0.33 -3.78 0.92 4.02 -0.84 -4.97 117.16 109.18 3m07 n TYR 253 Ca -0.03 -0.19 -0.28 0.00 -0.01 0.00 0.00 57.90 57.39 3m07 n TYR 253 Cb 0.80 -0.00 0.04 0.00 -0.02 0.00 0.00 39.34 40.17 3m07 n TYR 253 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 3m07 n HIS 254 N 1.27 -2.50 -1.66 -0.72 8.25 -0.86 -4.93 115.22 114.06 3m07 n HIS 254 Ca 0.16 0.93 -0.30 0.00 -0.26 0.00 0.00 57.72 58.25 3m07 n HIS 254 Cb 0.55 -4.35 0.06 0.00 1.12 0.00 0.00 29.99 27.37 3m07 n HIS 254 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3m07 s LEU 255 N -7.28 2.88 0.00 2.41 1.43 -0.94 -4.97 118.68 112.21 3m07 s LEU 255 Ca 0.63 1.37 0.23 0.00 -1.03 0.00 0.00 54.13 55.33 3m07 s LEU 255 Cb -0.30 -4.14 0.23 0.00 0.03 0.00 0.00 46.19 42.00 3m07 s LEU 255 CO 0.78 -1.57 1.26 0.47 0.23 0.00 0.00 176.35 177.52 3m07 n ASP 256 N -3.19 3.02 0.00 2.29 8.00 0.15 -4.90 116.55 121.93 3m07 n ASP 256 Ca 0.07 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.61 3m07 n ASP 256 Cb 0.55 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 3m07 n ASP 256 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m07 n GLY 257 N 1.33 -2.65 3.05 0.44 0.00 -1.24 -0.78 105.19 105.34 3m07 n GLY 257 Ca 0.14 -1.29 -0.11 0.00 0.00 0.00 0.00 46.02 44.77 3m07 n GLY 257 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m07 s LEU 258 N 0.00 1.75 -0.26 0.99 1.43 -0.82 -2.57 118.68 119.19 3m07 s LEU 258 Ca 0.00 -0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 52.86 3m07 s LEU 258 Cb 0.00 0.46 0.02 0.00 0.03 0.00 0.00 46.19 46.71 3m07 s LEU 258 CO 0.00 -0.29 -0.03 -0.60 0.23 0.00 0.00 176.35 175.66 3m07 s ARG 259 N -1.15 2.89 -0.38 1.70 3.00 0.08 -0.72 118.95 124.37 3m07 s ARG 259 Ca -0.12 -0.95 -0.22 0.00 -1.00 0.00 0.00 55.73 53.43 3m07 s ARG 259 Cb -0.07 -3.08 0.01 0.00 0.00 0.00 0.00 34.95 31.81 3m07 s ARG 259 CO 0.01 -0.41 0.72 -0.06 0.00 0.00 0.00 175.30 175.55 3m07 s PHE 260 N 1.36 3.10 0.29 5.12 0.08 0.48 -0.86 117.98 127.56 3m07 s PHE 260 Ca 0.01 0.38 -0.29 0.00 0.12 0.00 0.00 56.93 57.14 3m07 s PHE 260 Cb -0.17 -3.34 -0.10 0.00 -0.57 0.00 0.00 43.02 38.83 3m07 s PHE 260 CO -0.03 -0.74 1.44 0.34 -0.10 0.00 0.00 175.22 176.13 3m07 s ASP 261 N 1.88 6.59 -1.19 1.36 2.15 -0.68 -1.44 116.67 125.34 3m07 s ASP 261 Ca 0.28 2.77 -0.35 0.00 0.43 0.00 0.00 52.55 55.68 3m07 s ASP 261 Cb -0.14 -2.64 0.05 0.00 -0.30 0.00 0.00 42.92 39.90 3m07 s ASP 261 CO 0.17 -0.72 0.65 0.00 -0.17 0.00 0.00 175.17 175.10 3m07 n ALA 262 N 1.71 -2.57 0.29 3.66 0.00 -1.06 -4.63 120.51 117.91 3m07 n ALA 262 Ca 0.05 -0.59 0.18 0.00 0.00 0.00 0.00 53.44 53.08 3m07 n ALA 262 Cb 0.40 -2.47 0.79 0.00 0.00 0.00 0.00 19.45 18.17 3m07 n ALA 262 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 3m07 h ILE 263 N -2.53 0.00 0.00 0.00 3.07 -1.52 -1.11 117.51 115.42 3m07 h ILE 263 Ca -0.70 -0.40 0.00 0.00 1.55 0.00 0.00 64.86 65.32 3m07 h ILE 263 Cb 1.37 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 39.30 3m07 h ILE 263 CO 0.51 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 176.71 3m07 n ASP 264 N -3.05 0.62 -1.38 2.16 5.68 -1.26 -2.15 116.55 117.17 3m07 n ASP 264 Ca -0.00 0.70 0.03 0.00 -0.50 0.00 0.00 54.79 55.02 3m07 n ASP 264 Cb 0.25 -0.81 0.29 0.00 -1.14 0.00 0.00 41.12 39.71 3m07 n ASP 264 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3m07 n GLN 265 N -2.23 3.38 -3.63 0.11 1.13 -0.42 -4.77 117.38 110.94 3m07 n GLN 265 Ca 0.01 -3.01 -0.38 0.00 -1.94 0.00 0.00 57.00 51.68 3m07 n GLN 265 Cb 0.15 -2.01 -0.07 0.00 0.11 0.00 0.00 30.24 28.41 3m07 n GLN 265 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3m07 s ILE 266 N -2.91 4.21 -0.23 5.09 1.01 -0.91 -4.79 121.20 122.66 3m07 s ILE 266 Ca 0.48 -3.17 -0.19 0.00 0.00 0.00 0.00 60.65 57.77 3m07 s ILE 266 Cb 0.39 -3.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 3m07 s ILE 266 CO 0.10 -0.97 0.55 -0.70 0.00 0.00 0.00 174.94 173.92 3m07 s GLU 267 N -0.44 4.13 -0.05 2.79 2.12 -1.26 -5.00 118.70 120.98 3m07 s GLU 267 Ca 0.20 0.42 -0.02 0.00 0.36 0.00 0.00 54.97 55.93 3m07 s GLU 267 Cb -0.15 -3.61 0.04 0.00 0.26 0.00 0.00 34.13 30.66 3m07 s GLU 267 CO -0.07 -0.28 0.10 0.34 -0.54 0.00 0.00 175.26 174.81 3m07 s ASP 268 N 1.37 0.55 0.00 -1.70 2.15 -1.26 -4.76 116.67 113.01 3m07 s ASP 268 Ca 0.24 0.20 0.20 0.00 0.43 0.00 0.00 52.55 53.62 3m07 s ASP 268 Cb -0.16 0.07 0.53 0.00 -0.30 0.00 0.00 42.92 43.07 3m07 s ASP 268 CO 0.09 -0.20 1.44 -1.54 -0.17 0.00 0.00 175.17 174.79 3m07 n SER 269 N 4.87 2.85 -4.72 -0.34 3.41 -1.26 -4.85 113.62 113.57 3m07 n SER 269 Ca -0.13 -1.93 -0.36 0.00 -0.26 0.00 0.00 58.87 56.19 3m07 n SER 269 Cb 0.50 -0.26 0.08 0.00 -0.26 0.00 0.00 64.21 64.27 3m07 n SER 269 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3m07 s SER 270 N -1.32 4.35 0.32 4.04 0.01 -1.26 -4.89 113.70 114.95 3m07 s SER 270 Ca 0.37 2.53 0.04 0.00 1.31 0.00 0.00 55.95 60.20 3m07 s SER 270 Cb 0.20 -2.61 0.66 0.00 0.21 0.00 0.00 66.02 64.49 3m07 s SER 270 CO 0.28 -2.17 1.87 0.00 0.41 0.00 0.00 173.24 173.63 3m07 h ALA 271 N 0.14 1.65 -3.11 1.44 0.00 -2.03 -3.33 119.26 114.03 3m07 h ALA 271 Ca -0.49 0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.76 3m07 h ALA 271 Cb 1.32 -0.19 -0.29 0.00 0.00 0.00 0.00 17.79 18.64 3m07 h ALA 271 CO 0.51 0.13 -0.71 0.50 0.00 0.00 0.00 179.25 179.68 3m07 s ARG 272 N -5.82 3.08 0.32 0.00 3.52 -1.26 -5.09 118.95 113.70 3m07 s ARG 272 Ca -0.11 -0.83 -0.29 0.00 -0.13 0.00 0.00 55.73 54.37 3m07 s ARG 272 Cb 0.22 -3.09 -0.11 0.00 -1.56 0.00 0.00 34.95 30.41 3m07 s ARG 272 CO 0.80 -0.34 1.47 -1.58 -0.81 0.00 0.00 175.30 174.83 3m07 s HIS 273 N 1.42 2.81 0.35 5.12 5.65 -1.25 -4.83 115.29 124.55 3m07 s HIS 273 Ca 0.03 1.09 0.12 0.00 0.25 0.00 0.00 55.06 56.55 3m07 s HIS 273 Cb -0.16 -3.92 0.94 0.00 -1.18 0.00 0.00 32.58 28.26 3m07 s HIS 273 CO -0.02 -2.85 1.76 -0.24 -0.65 0.00 0.00 174.74 172.74 3m07 h VAL 274 N 3.21 0.57 -0.32 0.89 3.04 -1.91 -0.45 116.25 121.27 3m07 h VAL 274 Ca -0.48 -0.19 -0.14 0.00 -1.01 0.00 0.00 66.70 64.88 3m07 h VAL 274 Cb 1.23 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.47 3m07 h VAL 274 CO 0.71 0.10 -0.36 -0.07 -1.01 0.00 0.00 177.57 176.94 3m07 h LEU 275 N 0.54 0.77 -0.31 3.16 3.38 -1.95 -0.78 115.31 120.13 3m07 h LEU 275 Ca 0.61 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 3m07 h LEU 275 Cb 1.26 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 3m07 h LEU 275 CO -0.38 1.05 0.08 0.58 0.09 0.00 0.00 178.44 179.86 3m07 h VAL 276 N 0.61 1.21 -0.73 1.22 2.07 -1.50 -1.94 116.25 117.19 3m07 h VAL 276 Ca 0.06 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3m07 h VAL 276 Cb 0.89 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 3m07 h VAL 276 CO 0.08 0.23 0.43 -0.08 0.02 0.00 0.00 177.57 178.25 3m07 h GLU 277 N 0.34 1.00 0.08 1.57 4.81 -1.12 0.02 114.58 121.27 3m07 h GLU 277 Ca 0.10 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3m07 h GLU 277 Cb 0.27 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 3m07 h GLU 277 CO -0.00 0.72 -0.18 0.82 -0.73 0.00 0.00 179.01 179.64 3m07 h ILE 278 N 1.00 0.58 -0.49 2.32 2.04 -1.02 -0.76 117.51 121.18 3m07 h ILE 278 Ca 0.26 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.11 3m07 h ILE 278 Cb -0.01 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3m07 h ILE 278 CO -0.05 0.00 0.27 0.00 0.00 0.00 0.00 178.15 178.37 3m07 h ALA 279 N 0.51 0.63 -0.74 1.87 0.00 -1.10 -1.05 119.26 119.39 3m07 h ALA 279 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3m07 h ALA 279 Cb 0.37 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3m07 h ALA 279 CO -0.12 0.16 0.47 1.96 0.00 0.00 0.00 179.25 181.72 3m07 h GLN 280 N 0.65 0.98 -0.53 0.00 4.20 -0.84 -0.96 115.11 118.62 3m07 h GLN 280 Ca 0.17 -0.07 -0.11 0.00 0.06 0.00 0.00 58.65 58.71 3m07 h GLN 280 Cb 0.05 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 3m07 h GLN 280 CO -0.03 0.67 -0.09 0.00 -0.67 0.00 0.00 178.83 178.71 3m07 h ARG 281 N 1.00 0.97 -0.78 1.46 3.08 -0.88 -1.51 114.38 117.72 3m07 h ARG 281 Ca 0.27 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3m07 h ARG 281 Cb -0.08 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3m07 h ARG 281 CO -0.05 1.01 0.32 0.82 -1.07 0.00 0.00 179.97 181.00 3m07 h ILE 282 N 0.87 1.26 -0.00 2.04 2.04 -0.80 0.14 117.51 123.06 3m07 h ILE 282 Ca 0.14 -0.80 -0.11 0.00 1.00 0.00 0.00 64.86 65.10 3m07 h ILE 282 Cb 0.63 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 3m07 h ILE 282 CO 0.04 0.33 -0.51 0.03 0.00 0.00 0.00 178.15 178.04 3m07 h ARG 283 N 1.13 0.00 -0.03 2.37 -0.00 -0.91 -1.62 114.38 115.32 3m07 h ARG 283 Ca 0.26 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 59.72 3m07 h ARG 283 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.17 3m07 h ARG 283 CO -0.02 0.51 -0.07 0.93 0.00 0.00 0.00 179.97 181.31 3m07 h GLU 284 N 0.00 0.11 0.00 0.04 5.08 -0.95 -3.39 114.58 115.48 3m07 h GLU 284 Ca -0.00 -0.07 -0.21 0.00 -1.00 0.00 0.00 59.36 58.07 3m07 h GLU 284 Cb 0.90 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 3m07 h GLU 284 CO 0.07 0.66 -1.06 -0.44 -1.00 0.00 0.00 179.01 177.24 3m07 h ASP 285 N -0.43 0.00 -3.84 1.42 3.32 -0.64 -3.42 116.42 112.83 3m07 h ASP 285 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 3m07 h ASP 285 Cb 0.66 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 39.84 3m07 h ASP 285 CO 0.02 0.94 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.06 3m07 s ILE 286 N -2.72 2.19 0.00 0.35 1.01 -0.62 -4.95 121.20 116.46 3m07 s ILE 286 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 60.65 58.90 3m07 s ILE 286 Cb 0.09 -2.35 0.00 0.00 0.01 0.00 0.00 42.46 40.22 3m07 s ILE 286 CO 0.81 -0.12 0.33 0.35 0.00 0.00 0.00 174.94 176.31 3m07 n THR 287 N 4.40 0.00 1.35 2.92 -2.24 -1.26 -4.67 114.28 114.78 3m07 n THR 287 Ca -0.11 -0.35 0.13 0.00 -2.27 0.00 0.00 64.05 61.45 3m07 n THR 287 Cb 0.42 1.27 0.44 0.00 -2.10 0.00 0.00 70.33 70.37 3m07 n THR 287 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3m07 n ASP 288 N -0.05 1.23 -3.47 3.42 5.75 -1.26 -4.90 116.55 117.26 3m07 n ASP 288 Ca 0.00 -1.15 -0.15 0.00 -0.01 0.00 0.00 54.79 53.48 3m07 n ASP 288 Cb 0.07 0.07 -0.04 0.00 -1.03 0.00 0.00 41.12 40.19 3m07 n ASP 288 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3m07 s ARG 289 N -2.28 1.15 0.54 0.11 1.70 -1.26 -4.86 118.95 114.04 3m07 s ARG 289 Ca 0.30 -0.11 -0.21 0.00 -0.47 0.00 0.00 55.73 55.24 3m07 s ARG 289 Cb 0.20 0.53 -0.05 0.00 -0.57 0.00 0.00 34.95 35.06 3m07 s ARG 289 CO 0.44 -0.44 1.28 -2.14 -1.08 0.00 0.00 175.30 173.36 3m07 s PRO 290 N -2.48 3.23 -0.20 3.89 0.02 -1.26 -5.01 135.00 133.19 3m07 s PRO 290 Ca -0.05 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.00 3m07 s PRO 290 Cb -0.01 -2.20 0.05 0.00 0.02 0.00 0.00 34.50 32.36 3m07 s PRO 290 CO -0.02 -1.06 -0.06 0.42 -0.33 0.00 0.00 177.00 175.96 3m07 s ILE 291 N -1.43 1.34 -0.56 2.83 -1.09 -1.26 -4.81 121.20 116.22 3m07 s ILE 291 Ca 0.71 -0.94 -0.20 0.00 -2.23 0.00 0.00 60.65 57.99 3m07 s ILE 291 Cb -0.35 -1.56 0.07 0.00 -1.58 0.00 0.00 42.46 39.04 3m07 s ILE 291 CO 0.41 0.02 0.76 -1.00 -1.23 0.00 0.00 174.94 173.90 3m07 s HIS 292 N 1.51 2.92 -0.39 3.97 3.76 0.04 -4.88 115.29 122.22 3m07 s HIS 292 Ca -0.02 -0.57 -0.13 0.00 -0.15 0.00 0.00 55.06 54.18 3m07 s HIS 292 Cb -0.17 -3.89 0.02 0.00 1.11 0.00 0.00 32.58 29.65 3m07 s HIS 292 CO -0.07 -1.27 0.26 -0.51 -0.85 0.00 0.00 174.74 172.30 3m07 s LEU 293 N 3.12 4.89 0.18 0.89 1.43 -1.26 -1.95 118.68 125.98 3m07 s LEU 293 Ca 0.18 -0.85 0.08 0.00 -1.03 0.00 0.00 54.13 52.50 3m07 s LEU 293 Cb -0.19 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 3m07 s LEU 293 CO 0.11 -0.40 -0.02 0.42 0.23 0.00 0.00 176.35 176.69 3m07 s THR 294 N 1.65 3.56 0.05 5.49 -4.23 0.11 -0.08 115.64 122.19 3m07 s THR 294 Ca 0.04 -1.53 0.03 0.00 -1.18 0.00 0.00 61.69 59.06 3m07 s THR 294 Cb -0.19 -2.80 -0.02 0.00 1.34 0.00 0.00 72.50 70.83 3m07 s THR 294 CO 0.09 -0.13 -0.10 0.42 -0.54 0.00 0.00 174.62 174.35 3m07 s THR 295 N -1.78 0.76 -0.38 3.99 -4.23 -0.85 -0.39 115.64 112.76 3m07 s THR 295 Ca 0.27 -1.09 0.02 0.00 -1.18 0.00 0.00 61.69 59.71 3m07 s THR 295 Cb -0.09 -0.77 0.11 0.00 1.34 0.00 0.00 72.50 73.09 3m07 s THR 295 CO 0.18 -0.27 0.12 -0.70 -0.54 0.00 0.00 174.62 173.41 3m07 s GLU 296 N -1.50 1.68 -0.06 3.99 -6.30 -0.52 -0.55 118.70 115.44 3m07 s GLU 296 Ca -0.06 -1.93 0.05 0.00 -2.50 0.00 0.00 54.97 50.53 3m07 s GLU 296 Cb -0.09 -3.33 -0.01 0.00 0.00 0.00 0.00 34.13 30.70 3m07 s GLU 296 CO 0.01 -0.99 -0.21 0.34 0.02 0.00 0.00 175.26 174.42 3m07 s ASP 297 N 1.06 2.66 0.00 -1.70 -1.08 -1.26 -1.74 116.67 114.60 3m07 s ASP 297 Ca 0.11 -0.44 0.27 0.00 -0.52 0.00 0.00 52.55 51.96 3m07 s ASP 297 Cb -0.21 -0.79 0.79 0.00 -1.46 0.00 0.00 42.92 41.26 3m07 s ASP 297 CO -0.06 0.19 1.61 -1.54 0.52 0.00 0.00 175.17 175.89 3m07 n SER 298 N 3.10 0.41 0.12 -0.34 3.41 -1.26 -4.33 113.62 114.73 3m07 n SER 298 Ca -0.18 -0.14 0.13 0.00 -0.26 0.00 0.00 58.87 58.42 3m07 n SER 298 Cb 0.52 0.01 0.33 0.00 -0.26 0.00 0.00 64.21 64.81 3m07 n SER 298 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3m07 h ARG 299 N 0.16 0.00 -5.12 4.33 3.08 -1.98 -3.47 114.38 111.38 3m07 h ARG 299 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 59.98 59.64 3m07 h ARG 299 Cb 0.48 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.61 3m07 h ARG 299 CO 0.00 0.00 -0.64 0.09 -1.07 0.00 0.00 179.97 178.35 3m07 n ASN 300 N -2.40 -6.03 -4.92 7.04 4.13 -1.26 -2.69 115.26 109.12 3m07 n ASN 300 Ca 0.05 -0.41 -0.26 0.00 1.68 0.00 0.00 54.58 55.64 3m07 n ASN 300 Cb 0.45 -4.83 0.06 0.00 -1.54 0.00 0.00 39.78 33.93 3m07 n ASN 300 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3m07 s ILE 301 N -3.22 2.54 0.00 2.41 -4.36 -1.26 -1.75 121.20 115.56 3m07 s ILE 301 Ca 0.43 -0.19 0.00 0.00 -0.26 0.00 0.00 60.65 60.63 3m07 s ILE 301 Cb -0.19 -3.10 0.00 0.00 1.25 0.00 0.00 42.46 40.42 3m07 s ILE 301 CO 0.53 -0.10 0.15 2.30 0.24 0.00 0.00 174.94 178.06 3m07 n ILE 302 N -2.88 0.00 0.30 8.37 -5.35 -1.26 -4.88 119.36 113.66 3m07 n ILE 302 Ca 0.07 -0.27 0.18 0.00 -0.27 0.00 0.00 62.75 62.46 3m07 n ILE 302 Cb 0.60 1.25 0.95 0.00 -1.74 0.00 0.00 39.64 40.70 3m07 n ILE 302 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3m07 h SER 303 N 0.00 0.00 0.06 7.28 4.64 -1.99 -0.40 113.55 123.13 3m07 h SER 303 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m07 h SER 303 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3m07 h SER 303 CO 0.00 0.03 -0.06 0.18 -0.87 0.00 0.00 176.83 176.11 3m07 n LEU 304 N -3.31 1.29 -2.34 5.97 4.77 -1.26 -4.35 117.00 117.76 3m07 n LEU 304 Ca -0.02 -0.40 -0.19 0.00 -0.03 0.00 0.00 56.01 55.37 3m07 n LEU 304 Cb 0.16 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 3m07 n LEU 304 CO 0.25 0.22 0.12 1.41 -1.33 0.00 0.00 177.39 178.06 3m07 n HIS 305 N -0.10 2.48 -1.29 -1.77 8.25 -0.16 -1.51 115.22 121.12 3m07 n HIS 305 Ca 0.18 -2.47 -0.31 0.00 -0.26 0.00 0.00 57.72 54.85 3m07 n HIS 305 Cb 0.34 -0.26 0.10 0.00 1.12 0.00 0.00 29.99 31.29 3m07 n HIS 305 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3m07 s PRO 306 N -3.58 2.09 0.03 -0.41 0.04 -1.25 -4.97 135.00 126.96 3m07 s PRO 306 Ca 0.44 1.05 0.07 0.00 0.04 0.00 0.00 61.00 62.59 3m07 s PRO 306 Cb 0.40 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 33.03 3m07 s PRO 306 CO -0.03 -1.72 -0.19 1.03 0.04 0.00 0.00 177.00 176.13 3m07 s ARG 307 N -4.94 1.32 0.84 4.56 1.81 -1.26 -4.19 118.95 117.10 3m07 s ARG 307 Ca 0.61 -0.86 -0.07 0.00 -1.72 0.00 0.00 55.73 53.70 3m07 s ARG 307 Cb -0.17 -1.39 0.18 0.00 -0.45 0.00 0.00 34.95 33.12 3m07 s ARG 307 CO 0.56 0.36 1.15 0.16 -0.68 0.00 0.00 175.30 176.85 3m07 s ASP 308 N -1.04 3.65 0.44 0.23 3.84 -0.52 -4.93 116.67 118.33 3m07 s ASP 308 Ca 0.06 -0.25 0.18 0.00 -0.00 0.00 0.00 52.55 52.54 3m07 s ASP 308 Cb -0.08 0.11 1.13 0.00 -1.38 0.00 0.00 42.92 42.69 3m07 s ASP 308 CO 0.01 -2.35 1.90 0.06 -0.00 0.00 0.00 175.17 174.79 3m07 h GLN 309 N -1.06 0.34 -0.53 2.11 -0.00 -2.02 -1.64 115.11 112.30 3m07 h GLN 309 Ca -0.38 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.25 3m07 h GLN 309 Cb 1.24 -0.08 0.00 0.00 -0.00 0.00 0.00 27.48 28.65 3m07 h GLN 309 CO 0.35 0.22 0.00 -0.40 -0.00 0.00 0.00 178.83 179.00 3m07 n ASP 310 N -4.47 3.03 0.00 0.06 3.85 -1.26 -4.94 116.55 112.83 3m07 n ASP 310 Ca 0.16 -1.98 0.00 0.00 -0.71 0.00 0.00 54.79 52.26 3m07 n ASP 310 Cb 0.64 -0.35 0.00 0.00 -1.35 0.00 0.00 41.12 40.05 3m07 n ASP 310 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m07 n GLY 311 N 1.41 0.75 3.79 6.12 0.00 -0.62 -5.05 105.19 111.59 3m07 n GLY 311 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3m07 n GLY 311 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3m07 s ASN 312 N -2.48 6.57 -0.53 1.61 0.01 -1.26 -4.77 114.94 114.09 3m07 s ASN 312 Ca 0.00 1.95 -0.09 0.00 -0.71 0.00 0.00 52.86 54.01 3m07 s ASN 312 Cb 0.00 -2.57 0.13 0.00 0.41 0.00 0.00 41.25 39.23 3m07 s ASN 312 CO 0.00 -0.62 0.40 0.00 -1.51 0.00 0.00 177.10 175.37 3m07 s ALA 313 N -1.86 3.49 0.25 0.60 0.00 -1.26 -1.44 121.76 121.54 3m07 s ALA 313 Ca 0.63 -2.70 0.23 0.00 0.00 0.00 0.00 51.96 50.12 3m07 s ALA 313 Cb -0.18 -2.89 1.04 0.00 0.00 0.00 0.00 23.12 21.08 3m07 s ALA 313 CO 0.22 -1.97 1.89 -1.00 0.00 0.00 0.00 175.76 174.90 3m07 h PRO 314 N 8.24 0.00 0.00 0.00 0.13 -1.96 -3.44 132.00 134.97 3m07 h PRO 314 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3m07 h PRO 314 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3m07 h PRO 314 CO 0.84 0.23 0.00 1.28 -0.23 0.00 0.00 178.00 180.12 3m07 n LEU 315 N -3.55 0.00 -4.85 1.56 4.77 -1.26 -4.55 117.00 109.12 3m07 n LEU 315 Ca -0.01 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.65 3m07 n LEU 315 Cb 0.38 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3m07 n LEU 315 CO 0.33 0.00 0.53 -0.36 -1.33 0.00 0.00 177.39 176.56 3m07 s PHE 316 N 3.08 3.39 -0.15 -1.77 0.40 -0.57 -4.89 117.98 117.48 3m07 s PHE 316 Ca 0.00 1.33 -0.26 0.00 -0.60 0.00 0.00 56.93 57.39 3m07 s PHE 316 Cb 0.00 -2.64 -0.25 0.00 0.51 0.00 0.00 43.02 40.64 3m07 s PHE 316 CO 0.00 -0.08 0.65 1.15 0.70 0.00 0.00 175.22 177.65 3m07 h THR 317 N 1.60 1.56 -3.44 0.64 2.02 -0.79 -3.41 112.91 111.10 3m07 h THR 317 Ca -0.48 -2.33 -0.05 0.00 0.77 0.00 0.00 66.41 64.32 3m07 h THR 317 Cb 1.18 3.11 -0.12 0.00 -1.74 0.00 0.00 68.15 70.58 3m07 h THR 317 CO 0.63 0.56 -0.09 0.00 0.37 0.00 0.00 175.52 176.99 3m07 s ALA 318 N -2.27 -0.79 -0.06 6.16 0.00 -1.11 -4.48 121.76 119.20 3m07 s ALA 318 Ca -0.21 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 51.59 3m07 s ALA 318 Cb -0.01 0.75 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 3m07 s ALA 318 CO 0.68 -0.68 -0.23 -2.00 0.00 0.00 0.00 175.76 173.53 3m07 s GLU 319 N -3.84 2.54 0.05 0.00 2.56 -0.30 -2.02 118.70 117.69 3m07 s GLU 319 Ca 0.06 -0.87 -0.30 0.00 0.00 0.00 0.00 54.97 53.86 3m07 s GLU 319 Cb 0.01 -2.20 -0.08 0.00 2.00 0.00 0.00 34.13 33.86 3m07 s GLU 319 CO -0.08 0.42 1.79 -1.58 -0.56 0.00 0.00 175.26 175.25 3m07 s TRP 320 N -0.25 1.93 -1.02 5.30 0.52 0.28 -1.00 118.94 124.70 3m07 s TRP 320 Ca -0.01 -0.02 -0.04 0.00 0.02 0.00 0.00 56.10 56.05 3m07 s TRP 320 Cb -0.13 -4.09 0.28 0.00 -1.15 0.00 0.00 33.47 28.38 3m07 s TRP 320 CO 0.03 -4.62 1.23 -1.71 0.02 0.00 0.00 176.95 171.89 3m07 n ASN 321 N 6.48 5.65 0.29 2.95 5.15 0.44 -4.62 115.26 131.59 3m07 n ASN 321 Ca 0.18 -3.28 0.16 0.00 -0.60 0.00 0.00 54.58 51.04 3m07 n ASN 321 Cb 0.40 -1.21 0.88 0.00 -0.53 0.00 0.00 39.78 39.32 3m07 n ASN 321 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 3m07 h ASP 322 N 5.70 0.00 -0.96 1.20 5.19 -1.91 -1.72 116.42 123.92 3m07 h ASP 322 Ca 0.19 0.00 0.18 0.00 -0.62 0.00 0.00 57.03 56.78 3m07 h ASP 322 Cb 0.71 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.14 3m07 h ASP 322 CO 1.14 0.05 0.61 0.44 -3.12 0.00 0.00 179.24 178.36 3m07 h ASP 323 N 0.00 0.66 0.70 6.45 5.19 -1.92 0.58 116.42 128.07 3m07 h ASP 323 Ca -0.00 0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.44 3m07 h ASP 323 Cb 0.24 -0.06 0.01 0.00 0.18 0.00 0.00 39.33 39.69 3m07 h ASP 323 CO 0.01 0.27 -0.33 0.15 -3.12 0.00 0.00 179.24 176.22 3m07 h PHE 324 N 0.66 -0.87 -0.57 4.55 3.57 -1.61 -0.60 116.94 122.07 3m07 h PHE 324 Ca 0.52 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 62.08 3m07 h PHE 324 Cb 0.92 0.29 -0.07 0.00 2.79 0.00 0.00 35.95 39.88 3m07 h PHE 324 CO -0.00 -0.52 0.20 1.25 -2.23 0.00 0.00 178.31 177.00 3m07 h HIS 325 N -0.99 0.35 -0.51 0.41 2.76 -1.49 -0.33 115.15 115.35 3m07 h HIS 325 Ca -0.10 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 57.99 3m07 h HIS 325 Cb 0.73 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.61 3m07 h HIS 325 CO -0.02 0.08 -0.15 -0.91 -1.30 0.00 0.00 177.93 175.64 3m07 h ASN 326 N 0.37 1.00 -0.33 3.26 2.35 -0.79 0.12 115.58 121.56 3m07 h ASN 326 Ca 0.29 -0.34 -0.03 0.00 -0.55 0.00 0.00 56.30 55.66 3m07 h ASN 326 Cb 0.35 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 3m07 h ASN 326 CO -0.30 1.13 0.09 0.00 -1.65 0.00 0.00 177.43 176.70 3m07 h ALA 327 N 0.95 0.44 -0.68 -0.83 0.00 -0.90 -2.46 119.26 115.78 3m07 h ALA 327 Ca 0.13 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.92 3m07 h ALA 327 Cb 0.71 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3m07 h ALA 327 CO 0.05 0.10 0.39 0.28 0.00 0.00 0.00 179.25 180.07 3m07 h VAL 328 N 0.38 1.01 -0.06 0.00 2.07 -0.66 -0.80 116.25 118.18 3m07 h VAL 328 Ca 0.10 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 3m07 h VAL 328 Cb 0.29 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3m07 h VAL 328 CO 0.00 0.13 0.04 -0.74 0.02 0.00 0.00 177.57 177.02 3m07 h HIS 329 N 0.74 0.09 -0.31 1.57 6.17 -0.62 0.13 115.15 122.92 3m07 h HIS 329 Ca 0.29 -0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.36 3m07 h HIS 329 Cb 0.14 -0.03 -0.01 0.00 2.52 0.00 0.00 27.41 30.02 3m07 h HIS 329 CO -0.07 0.11 0.13 0.28 0.71 0.00 0.00 177.93 179.10 3m07 h VAL 330 N 0.04 1.17 -0.77 5.26 2.07 -1.27 0.04 116.25 122.79 3m07 h VAL 330 Ca 0.02 -0.50 0.12 0.00 0.82 0.00 0.00 66.70 67.16 3m07 h VAL 330 Cb 0.05 0.93 -0.08 0.00 -1.52 0.00 0.00 31.29 30.67 3m07 h VAL 330 CO -0.00 0.18 0.37 0.15 0.02 0.00 0.00 177.57 178.29 3m07 h PHE 331 N 0.35 0.66 0.00 1.57 3.57 -0.89 -0.84 116.94 121.36 3m07 h PHE 331 Ca 0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.64 3m07 h PHE 331 Cb 0.15 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.71 3m07 h PHE 331 CO -0.01 0.18 -1.67 0.00 -2.23 0.00 0.00 178.31 174.58 3m07 n ALA 332 N -2.44 2.72 0.01 2.41 0.00 0.43 -4.55 120.51 119.09 3m07 n ALA 332 Ca 0.14 -0.43 0.01 0.00 0.00 0.00 0.00 53.44 53.16 3m07 n ALA 332 Cb 0.36 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.93 3m07 n ALA 332 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3m07 n THR 333 N -2.40 0.00 -0.78 0.00 -2.24 -0.01 -4.69 114.28 104.16 3m07 n THR 333 Ca -0.03 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 3m07 n THR 333 Cb 0.56 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 3m07 n THR 333 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m07 n GLY 334 N 2.22 1.00 3.75 3.38 0.00 -0.32 -5.02 105.19 110.20 3m07 n GLY 334 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3m07 n GLY 334 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m07 s GLU 335 N -0.18 4.47 -0.01 1.61 2.02 -1.26 -4.92 118.70 120.43 3m07 s GLU 335 Ca 0.00 1.99 0.01 0.00 0.02 0.00 0.00 54.97 56.99 3m07 s GLU 335 Cb 0.00 -3.17 0.02 0.00 0.10 0.00 0.00 34.13 31.07 3m07 s GLU 335 CO 0.00 -0.08 0.74 0.25 0.02 0.00 0.00 175.26 176.19 3m07 n THR 336 N 1.80 0.21 -2.35 3.63 -2.24 -1.26 -4.37 114.28 109.70 3m07 n THR 336 Ca 0.02 -0.23 -0.33 0.00 -2.27 0.00 0.00 64.05 61.24 3m07 n THR 336 Cb 0.43 0.72 -0.02 0.00 -2.10 0.00 0.00 70.33 69.37 3m07 n THR 336 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m07 s GLN 337 N -0.27 3.67 5.87 -0.78 0.00 -1.26 -1.97 119.66 124.91 3m07 s GLN 337 Ca 0.02 1.22 0.00 0.00 -0.00 0.00 0.00 55.36 56.59 3m07 s GLN 337 Cb 0.02 -2.08 0.00 0.00 0.00 0.00 0.00 33.01 30.94 3m07 s GLN 337 CO 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 175.29 174.77 3m07 n ALA 338 N -1.46 0.00 0.32 2.60 0.00 -1.26 -1.75 120.51 118.97 3m07 n ALA 338 Ca 0.08 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.73 3m07 n ALA 338 Cb 0.53 0.00 1.10 0.00 0.00 0.00 0.00 19.45 21.08 3m07 n ALA 338 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 3m07 h TYR 339 N 0.00 0.00 0.00 0.00 -0.00 -2.01 0.01 116.97 114.97 3m07 h TYR 339 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3m07 h TYR 339 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 3m07 h TYR 339 CO 0.00 0.01 0.00 1.88 -0.00 0.00 0.00 178.16 180.05 3m07 h TYR 340 N 0.00 0.00 0.00 0.10 0.05 -1.58 -3.07 116.97 112.47 3m07 h TYR 340 Ca -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 3m07 h TYR 340 Cb 0.04 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.78 3m07 h TYR 340 CO 0.00 0.00 -0.06 -0.97 -1.05 0.00 0.00 178.16 176.08 3m07 h ASN 341 N 0.00 0.00 0.24 3.88 -0.73 -0.32 -0.63 115.58 118.01 3m07 h ASN 341 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 3m07 h ASN 341 Cb 0.45 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.04 3m07 h ASN 341 CO 0.00 0.06 0.00 0.47 -0.37 0.00 0.00 177.43 177.59 3m07 n ASP 342 N -3.67 0.21 -0.15 1.15 9.92 -1.16 -2.10 116.55 120.75 3m07 n ASP 342 Ca -0.02 0.58 0.01 0.00 -0.53 0.00 0.00 54.79 54.83 3m07 n ASP 342 Cb 0.17 -0.61 0.03 0.00 -0.64 0.00 0.00 41.12 40.07 3m07 n ASP 342 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3m07 n PHE 343 N -1.76 0.09 0.01 1.24 3.72 -0.25 -4.77 117.46 115.75 3m07 n PHE 343 Ca 0.01 -0.38 -0.04 0.00 -0.05 0.00 0.00 57.45 56.99 3m07 n PHE 343 Cb 0.09 -0.03 0.19 0.00 -0.94 0.00 0.00 39.48 38.78 3m07 n PHE 343 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m07 h ALA 344 N 0.52 1.06 -1.89 4.37 0.00 -1.38 -3.15 119.26 118.79 3m07 h ALA 344 Ca 0.00 -0.36 -0.63 0.00 0.00 0.00 0.00 54.91 53.92 3m07 h ALA 344 Cb 0.45 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.99 3m07 h ALA 344 CO 0.00 0.57 0.42 0.34 0.00 0.00 0.00 179.25 180.59 3m07 s ASP 345 N -6.82 6.31 -0.94 0.00 3.68 -1.26 -4.33 116.67 113.31 3m07 s ASP 345 Ca -0.07 -0.49 -0.04 0.00 2.13 0.00 0.00 52.55 54.08 3m07 s ASP 345 Cb 0.13 -2.40 -0.05 0.00 -1.45 0.00 0.00 42.92 39.16 3m07 s ASP 345 CO 0.79 -1.13 0.83 0.00 0.13 0.00 0.00 175.17 175.80 3m07 n ALA 346 N 7.10 -2.42 0.04 3.66 0.00 -1.26 -4.84 120.51 122.79 3m07 n ALA 346 Ca -0.00 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.67 3m07 n ALA 346 Cb 0.47 -4.62 0.60 0.00 0.00 0.00 0.00 19.45 15.90 3m07 n ALA 346 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3m07 h PRO 347 N -0.69 0.16 -0.79 0.00 0.13 -1.74 -0.62 132.00 128.46 3m07 h PRO 347 Ca -0.45 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.70 3m07 h PRO 347 Cb 1.23 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 3m07 h PRO 347 CO 0.39 0.11 0.52 1.05 -0.23 0.00 0.00 178.00 179.84 3m07 h GLU 348 N 0.17 0.98 -0.43 0.86 9.09 -1.89 -0.19 114.58 123.17 3m07 h GLU 348 Ca 0.19 -0.06 -0.09 0.00 0.05 0.00 0.00 59.36 59.45 3m07 h GLU 348 Cb 0.53 -0.22 -0.01 0.00 -1.65 0.00 0.00 28.75 27.39 3m07 h GLU 348 CO -0.03 0.65 -0.07 0.87 0.05 0.00 0.00 179.01 180.48 3m07 h LYS 349 N 1.01 0.81 -0.50 1.06 1.57 -1.45 -1.16 116.57 117.90 3m07 h LYS 349 Ca 0.30 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3m07 h LYS 349 Cb -0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3m07 h LYS 349 CO -0.08 0.91 0.20 0.45 -0.57 0.00 0.00 179.45 180.36 3m07 h HIS 350 N 0.64 0.77 0.01 -1.35 3.86 -1.29 -1.38 115.15 116.42 3m07 h HIS 350 Ca 0.11 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.26 3m07 h HIS 350 Cb 0.59 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3m07 h HIS 350 CO 0.05 0.65 -0.01 1.25 0.86 0.00 0.00 177.93 180.73 3m07 h LEU 351 N 0.67 -0.01 -0.74 2.43 5.85 -0.99 -0.51 115.31 122.01 3m07 h LEU 351 Ca 0.17 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3m07 h LEU 351 Cb 0.21 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 3m07 h LEU 351 CO -0.01 0.03 0.41 0.00 -0.34 0.00 0.00 178.44 178.53 3m07 h ALA 352 N 0.93 0.95 -0.62 1.25 0.00 -1.15 -0.74 119.26 119.88 3m07 h ALA 352 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3m07 h ALA 352 Cb 0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3m07 h ALA 352 CO 0.00 0.46 0.27 -0.09 0.00 0.00 0.00 179.25 179.90 3m07 h ARG 353 N 1.02 0.91 -0.18 0.00 2.43 -1.10 -1.06 114.38 116.40 3m07 h ARG 353 Ca 0.26 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3m07 h ARG 353 Cb 0.03 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 3m07 h ARG 353 CO -0.04 0.75 0.10 0.00 -1.51 0.00 0.00 179.97 179.27 3m07 h ALA 354 N 1.11 0.23 -0.38 2.80 0.00 -0.72 0.14 119.26 122.45 3m07 h ALA 354 Ca 0.21 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3m07 h ALA 354 Cb 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3m07 h ALA 354 CO -0.02 -0.24 0.18 -0.07 0.00 0.00 0.00 179.25 179.10 3m07 h LEU 355 N 0.19 0.26 -0.21 0.00 3.38 -0.98 -0.79 115.31 117.17 3m07 h LEU 355 Ca 0.06 0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.85 3m07 h LEU 355 Cb 0.06 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3m07 h LEU 355 CO -0.01 0.19 -0.67 0.00 0.09 0.00 0.00 178.44 178.05 3m07 h ALA 356 N 1.20 0.36 0.00 1.53 0.00 -0.97 -3.41 119.26 117.97 3m07 h ALA 356 Ca 0.16 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3m07 h ALA 356 Cb 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3m07 h ALA 356 CO -0.12 0.66 -0.23 0.39 0.00 0.00 0.00 179.25 179.95 3m07 n GLU 357 N -3.99 5.47 0.00 0.00 1.02 0.48 -3.24 120.64 120.38 3m07 n GLU 357 Ca -0.06 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 3m07 n GLU 357 Cb 0.69 -0.65 0.00 0.00 -0.02 0.00 0.00 31.44 31.46 3m07 n GLU 357 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m07 n GLY 358 N 1.25 1.56 3.82 0.62 0.00 -0.31 -3.77 105.19 108.37 3m07 n GLY 358 Ca 0.00 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 3m07 n GLY 358 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3m07 s PHE 359 N 0.00 3.75 0.15 1.61 0.08 -1.26 -4.36 117.98 117.94 3m07 s PHE 359 Ca 0.00 1.20 -0.04 0.00 0.12 0.00 0.00 56.93 58.21 3m07 s PHE 359 Cb 0.00 -2.45 -0.03 0.00 -0.57 0.00 0.00 43.02 39.97 3m07 s PHE 359 CO 0.00 0.55 1.36 0.00 -0.10 0.00 0.00 175.22 177.03 3m07 h ALA 360 N 4.29 0.46 -2.88 5.36 0.00 -1.85 -3.39 119.26 121.25 3m07 h ALA 360 Ca -0.50 -0.65 -0.69 0.00 0.00 0.00 0.00 54.91 53.08 3m07 h ALA 360 Cb 1.21 -0.04 -0.24 0.00 0.00 0.00 0.00 17.79 18.72 3m07 h ALA 360 CO 0.64 0.77 -0.55 0.71 0.00 0.00 0.00 179.25 180.82 3m07 s TYR 361 N -3.50 3.21 -0.25 0.00 2.02 -1.26 -4.95 117.35 112.63 3m07 s TYR 361 Ca -0.06 -0.85 0.13 0.00 -0.37 0.00 0.00 57.07 55.91 3m07 s TYR 361 Cb 0.09 -2.37 0.46 0.00 -0.40 0.00 0.00 41.96 39.74 3m07 s TYR 361 CO 0.86 -0.57 1.17 1.04 -1.57 0.00 0.00 175.55 176.48 3m07 n GLN 362 N 4.96 2.59 0.00 -0.62 6.02 -1.21 -4.27 117.38 124.85 3m07 n GLN 362 Ca -0.13 -3.72 0.00 0.00 -0.01 0.00 0.00 57.00 53.14 3m07 n GLN 362 Cb 0.47 -1.86 0.00 0.00 1.02 0.00 0.00 30.24 29.88 3m07 n GLN 362 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m07 n GLY 363 N -0.66 1.13 3.78 1.08 0.00 0.76 -3.57 105.19 107.70 3m07 n GLY 363 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 3m07 n GLY 363 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m07 s GLU 364 N 0.00 2.87 0.15 1.61 8.01 -1.23 -4.03 118.70 126.08 3m07 s GLU 364 Ca 0.00 1.36 -0.31 0.00 0.01 0.00 0.00 54.97 56.03 3m07 s GLU 364 Cb 0.00 -1.96 -0.09 0.00 -4.31 0.00 0.00 34.13 27.77 3m07 s GLU 364 CO 0.00 -1.19 1.42 0.42 0.01 0.00 0.00 175.26 175.92 3m07 s ILE 365 N -2.36 3.09 -0.20 -1.63 -1.09 -1.26 -0.80 121.20 116.95 3m07 s ILE 365 Ca 0.66 0.81 -0.28 0.00 -2.23 0.00 0.00 60.65 59.62 3m07 s ILE 365 Cb -0.20 -3.52 -0.00 0.00 -1.58 0.00 0.00 42.46 37.16 3m07 s ILE 365 CO 0.41 0.08 0.96 -0.55 -1.23 0.00 0.00 174.94 174.60 3m07 s SER 366 N 0.95 7.05 0.32 3.58 0.15 -0.38 -4.89 113.70 120.49 3m07 s SER 366 Ca 0.64 1.31 0.05 0.00 0.70 0.00 0.00 55.95 58.66 3m07 s SER 366 Cb -0.39 -2.51 0.70 0.00 -1.71 0.00 0.00 66.02 62.11 3m07 s SER 366 CO 0.32 -0.55 1.84 -0.65 1.20 0.00 0.00 173.24 175.40 3m07 h PRO 367 N 7.40 0.81 -0.04 5.44 0.11 -1.91 0.18 132.00 143.99 3m07 h PRO 367 Ca -0.24 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 3m07 h PRO 367 Cb 1.10 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 3m07 h PRO 367 CO 0.91 0.53 -0.39 1.96 -0.21 0.00 0.00 178.00 180.80 3m07 h GLN 368 N 0.83 0.08 0.00 1.05 1.08 -1.92 -3.31 115.11 112.92 3m07 h GLN 368 Ca 0.50 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.65 3m07 h GLN 368 Cb 0.67 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.09 3m07 h GLN 368 CO -0.26 0.47 -1.67 0.25 -0.95 0.00 0.00 178.83 176.66 3m07 n THR 369 N -4.06 0.06 -1.10 -0.54 -2.24 -0.90 -4.99 114.28 100.51 3m07 n THR 369 Ca -0.02 -0.34 -0.03 0.00 -2.27 0.00 0.00 64.05 61.39 3m07 n THR 369 Cb 0.44 0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.77 3m07 n THR 369 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m07 n GLY 370 N 1.73 0.59 3.30 3.38 0.00 0.58 -5.01 105.19 109.76 3m07 n GLY 370 Ca -0.04 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 3m07 n GLY 370 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m07 s GLU 371 N -1.59 1.18 0.35 1.61 0.41 -1.25 -4.90 118.70 114.51 3m07 s GLU 371 Ca 0.00 -1.31 -0.27 0.00 -0.41 0.00 0.00 54.97 52.98 3m07 s GLU 371 Cb 0.00 -1.23 -0.12 0.00 -1.78 0.00 0.00 34.13 31.00 3m07 s GLU 371 CO 0.00 0.26 1.19 -2.30 -0.49 0.00 0.00 175.26 173.92 3m07 n PRO 372 N 0.53 1.84 -3.89 0.39 -0.02 -1.26 -1.24 135.00 131.34 3m07 n PRO 372 Ca -0.15 0.65 -0.27 0.00 -2.02 0.00 0.00 63.50 61.71 3m07 n PRO 372 Cb 0.56 -2.20 -0.17 0.00 -0.02 0.00 0.00 33.50 31.68 3m07 n PRO 372 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3m07 s ARG 373 N -1.88 1.42 0.00 -0.52 3.52 0.02 -4.82 118.95 116.70 3m07 s ARG 373 Ca 0.58 -0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.92 3m07 s ARG 373 Cb -0.59 -1.60 0.00 0.00 -1.56 0.00 0.00 34.95 31.20 3m07 s ARG 373 CO 0.60 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 175.20 3m07 n GLY 374 N 4.95 0.49 3.16 8.12 0.00 -1.09 -0.17 105.19 120.65 3m07 n GLY 374 Ca -0.12 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.83 3m07 n GLY 374 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3m07 s VAL 375 N -1.50 0.35 0.11 1.61 -7.23 -0.72 -2.57 120.40 110.45 3m07 s VAL 375 Ca 0.00 -1.90 -0.35 0.00 -1.81 0.00 0.00 61.98 57.92 3m07 s VAL 375 Cb 0.00 -1.88 -0.15 0.00 0.56 0.00 0.00 36.38 34.92 3m07 s VAL 375 CO 0.00 -0.66 1.55 1.17 -0.31 0.00 0.00 175.10 176.84 3m07 n LYS 376 N -0.07 1.85 0.00 4.82 4.81 -1.23 -4.45 118.16 123.88 3m07 n LYS 376 Ca -0.09 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 3m07 n LYS 376 Cb 0.62 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 33.27 3m07 n LYS 376 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3m07 n SER 377 N 3.51 1.08 0.22 3.14 3.41 -1.26 -4.74 113.62 118.98 3m07 n SER 377 Ca 0.18 -1.11 0.15 0.00 -0.26 0.00 0.00 58.87 57.84 3m07 n SER 377 Cb 0.26 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 64.85 3m07 n SER 377 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3m07 h THR 378 N 0.04 0.00 -0.00 6.66 1.35 -1.90 -2.09 112.91 116.96 3m07 h THR 378 Ca 0.00 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 3m07 h THR 378 Cb 0.07 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 3m07 h THR 378 CO 0.00 0.00 -0.12 0.61 -0.25 0.00 0.00 175.52 175.76 3m07 n GLY 379 N -0.07 -1.24 3.81 5.82 0.00 -1.26 -1.11 105.19 111.13 3m07 n GLY 379 Ca 0.01 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 3m07 n GLY 379 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m07 s GLN 380 N -2.76 4.36 0.64 1.61 -1.52 -0.79 -4.42 119.66 116.78 3m07 s GLN 380 Ca 0.21 1.13 -0.16 0.00 -1.95 0.00 0.00 55.36 54.59 3m07 s GLN 380 Cb 0.19 -2.55 -0.01 0.00 -0.22 0.00 0.00 33.01 30.43 3m07 s GLN 380 CO 0.53 0.17 1.12 -1.25 -0.25 0.00 0.00 175.29 175.61 3m07 s PRO 381 N -2.54 2.85 0.53 2.91 0.04 -1.19 -1.34 135.00 136.25 3m07 s PRO 381 Ca 0.54 1.46 0.19 0.00 0.04 0.00 0.00 61.00 63.23 3m07 s PRO 381 Cb -0.14 -1.95 1.34 0.00 0.04 0.00 0.00 34.50 33.78 3m07 s PRO 381 CO 0.19 -1.22 2.12 -1.00 0.04 0.00 0.00 177.00 177.13 3m07 h PRO 382 N 0.23 0.00 0.00 0.56 0.13 -1.79 -1.29 132.00 129.84 3m07 h PRO 382 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3m07 h PRO 382 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3m07 h PRO 382 CO 0.54 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.64 3m07 n VAL 383 N -4.45 0.27 1.76 1.56 0.24 -1.26 -2.69 118.33 113.75 3m07 n VAL 383 Ca -0.00 0.07 0.10 0.00 -2.04 0.00 0.00 64.34 62.46 3m07 n VAL 383 Cb 0.21 -0.71 0.50 0.00 -1.47 0.00 0.00 33.84 32.37 3m07 n VAL 383 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m07 n ALA 384 N -1.23 2.58 -3.09 2.33 0.00 -0.49 -4.69 120.51 115.93 3m07 n ALA 384 Ca 0.11 -0.24 -0.30 0.00 0.00 0.00 0.00 53.44 53.01 3m07 n ALA 384 Cb 0.16 -1.24 -0.17 0.00 0.00 0.00 0.00 19.45 18.20 3m07 n ALA 384 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3m07 s PHE 385 N -1.94 2.30 -0.29 0.00 0.08 -1.10 -1.15 117.98 115.88 3m07 s PHE 385 Ca 0.29 -0.84 -0.09 0.00 0.12 0.00 0.00 56.93 56.41 3m07 s PHE 385 Cb 0.14 -1.54 -0.02 0.00 -0.57 0.00 0.00 43.02 41.04 3m07 s PHE 385 CO 0.23 -0.32 0.14 0.08 -0.10 0.00 0.00 175.22 175.25 3m07 s VAL 386 N 0.21 4.60 0.25 -0.44 1.01 -0.17 -1.45 120.40 124.42 3m07 s VAL 386 Ca -0.13 -0.31 0.08 0.00 0.00 0.00 0.00 61.98 61.62 3m07 s VAL 386 Cb -0.16 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 3m07 s VAL 386 CO 0.06 0.14 0.13 -1.81 0.00 0.00 0.00 175.10 173.62 3m07 s ASP 387 N 1.63 5.22 -0.09 3.32 1.11 -0.13 -0.42 116.67 127.31 3m07 s ASP 387 Ca 0.05 -0.36 -0.30 0.00 0.18 0.00 0.00 52.55 52.12 3m07 s ASP 387 Cb -0.17 -1.24 0.09 0.00 1.07 0.00 0.00 42.92 42.68 3m07 s ASP 387 CO 0.06 -0.02 0.81 0.72 1.18 0.00 0.00 175.17 177.93 3m07 s PHE 388 N -2.15 -0.53 -0.70 4.23 -0.12 -1.26 -0.83 117.98 116.62 3m07 s PHE 388 Ca 0.32 0.90 0.21 0.00 -0.05 0.00 0.00 56.93 58.31 3m07 s PHE 388 Cb -0.08 0.43 -0.23 0.00 -0.63 0.00 0.00 43.02 42.51 3m07 s PHE 388 CO 0.23 -0.50 0.80 0.44 -0.05 0.00 0.00 175.22 176.13 3m07 n ILE 389 N 0.79 0.01 -3.79 -4.49 -5.35 -1.26 -3.51 119.36 101.77 3m07 n ILE 389 Ca -0.15 -0.16 -0.13 0.00 -0.27 0.00 0.00 62.75 62.04 3m07 n ILE 389 Cb 0.58 0.65 -0.10 0.00 -1.74 0.00 0.00 39.64 39.03 3m07 n ILE 389 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3m07 s GLN 390 N -3.16 0.51 0.38 6.28 -1.52 -1.26 -4.88 119.66 116.01 3m07 s GLN 390 Ca 0.03 -0.02 -0.15 0.00 -1.95 0.00 0.00 55.36 53.27 3m07 s GLN 390 Cb 0.15 0.23 0.05 0.00 -0.22 0.00 0.00 33.01 33.22 3m07 s GLN 390 CO 0.87 -0.12 0.76 0.54 -0.25 0.00 0.00 175.29 177.10 3m07 s ASN 391 N -0.81 0.07 0.45 5.90 2.20 -1.26 -3.86 114.94 117.63 3m07 s ASN 391 Ca -0.09 -1.16 0.14 0.00 -0.94 0.00 0.00 52.86 50.81 3m07 s ASN 391 Cb -0.05 0.83 1.07 0.00 -2.00 0.00 0.00 41.25 41.11 3m07 s ASN 391 CO 0.02 -1.65 2.04 1.12 -2.94 0.00 0.00 177.10 175.69 3m07 h HIS 392 N 2.01 0.33 0.11 1.54 2.07 -1.98 -2.24 115.15 116.99 3m07 h HIS 392 Ca -0.31 0.01 -0.15 0.00 -2.85 0.00 0.00 60.37 57.07 3m07 h HIS 392 Cb 1.25 -0.11 0.02 0.00 2.57 0.00 0.00 27.41 31.14 3m07 h HIS 392 CO 1.35 0.18 -0.64 0.22 -3.07 0.00 0.00 177.93 175.98 3m07 h ASP 393 N 0.33 0.37 1.06 3.10 -0.00 -1.96 0.13 116.42 119.45 3m07 h ASP 393 Ca 0.18 -0.97 -0.01 0.00 -0.00 0.00 0.00 57.03 56.24 3m07 h ASP 393 Cb 0.32 -0.12 -0.00 0.00 -0.00 0.00 0.00 39.33 39.52 3m07 h ASP 393 CO -0.04 1.31 -0.06 1.56 -0.00 0.00 0.00 179.24 182.00 3m07 h GLN 394 N -0.51 0.00 0.00 0.28 1.08 -1.91 -0.45 115.11 113.61 3m07 h GLN 394 Ca -0.11 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 3m07 h GLN 394 Cb 1.50 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.92 3m07 h GLN 394 CO 0.12 0.06 -0.98 0.28 -0.95 0.00 0.00 178.83 177.36 3m07 n VAL 395 N -3.18 1.47 0.30 -0.54 0.31 -0.86 -4.67 118.33 111.16 3m07 n VAL 395 Ca 0.01 0.08 0.15 0.00 -0.01 0.00 0.00 64.34 64.56 3m07 n VAL 395 Cb 0.36 -2.24 0.46 0.00 -0.91 0.00 0.00 33.84 31.51 3m07 n VAL 395 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3m07 h GLY 396 N -1.00 0.00 1.47 2.92 0.00 -0.73 -3.04 103.07 102.69 3m07 h GLY 396 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3m07 h GLY 396 CO -0.10 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.60 3m07 n ASN 397 N -2.94 0.00 -4.83 0.19 0.23 -0.18 -4.17 115.26 103.57 3m07 n ASN 397 Ca 0.02 -0.13 -0.34 0.00 -0.53 0.00 0.00 54.58 53.61 3m07 n ASN 397 Cb 0.39 -0.24 -0.06 0.00 -2.08 0.00 0.00 39.78 37.79 3m07 n ASN 397 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 3m07 s ARG 398 N -2.47 4.14 0.24 -3.83 0.52 -1.15 -4.98 118.95 111.42 3m07 s ARG 398 Ca 0.22 0.83 -0.04 0.00 -0.52 0.00 0.00 55.73 56.21 3m07 s ARG 398 Cb 0.14 -2.54 0.43 0.00 0.52 0.00 0.00 34.95 33.50 3m07 s ARG 398 CO 0.31 0.20 1.77 0.00 0.02 0.00 0.00 175.30 177.59 3m07 h ALA 399 N 2.57 1.11 -0.41 2.13 0.00 -1.89 -2.47 119.26 120.30 3m07 h ALA 399 Ca -0.48 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3m07 h ALA 399 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3m07 h ALA 399 CO 0.65 -0.08 0.00 1.04 0.00 0.00 0.00 179.25 180.85 3m07 n GLN 400 N -4.89 3.44 -3.28 0.00 1.13 -1.26 -4.40 117.38 108.13 3m07 n GLN 400 Ca 0.14 -2.79 -0.24 0.00 -1.94 0.00 0.00 57.00 52.17 3m07 n GLN 400 Cb 0.36 -1.84 0.03 0.00 0.11 0.00 0.00 30.24 28.90 3m07 n GLN 400 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3m07 n GLY 401 N 0.17 -0.52 3.70 1.08 0.00 -0.93 -4.76 105.19 103.94 3m07 n GLY 401 Ca 0.22 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 3m07 n GLY 401 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3m07 s ASP 402 N -2.87 7.00 0.54 1.61 1.01 -1.24 -1.72 116.67 121.00 3m07 s ASP 402 Ca 0.41 2.04 -0.18 0.00 0.71 0.00 0.00 52.55 55.53 3m07 s ASP 402 Cb -0.19 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.10 3m07 s ASP 402 CO 0.50 -0.56 1.04 -0.13 0.21 0.00 0.00 175.17 176.24 3m07 s ARG 403 N 1.48 3.60 0.35 8.23 0.52 -1.26 -4.63 118.95 127.24 3m07 s ARG 403 Ca 0.60 1.23 0.06 0.00 -0.52 0.00 0.00 55.73 57.09 3m07 s ARG 403 Cb -0.30 -2.07 0.72 0.00 0.52 0.00 0.00 34.95 33.81 3m07 s ARG 403 CO 0.28 -0.58 1.93 1.25 0.02 0.00 0.00 175.30 178.19 3m07 h LEU 404 N 0.96 0.71 -1.70 2.53 5.85 -1.94 -1.38 115.31 120.33 3m07 h LEU 404 Ca -0.48 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.30 3m07 h LEU 404 Cb 1.21 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 3m07 h LEU 404 CO 0.59 0.44 0.28 -0.29 -0.34 0.00 0.00 178.44 179.11 3m07 h ILE 405 N 0.80 0.99 0.00 4.05 2.10 -1.90 0.15 117.51 123.70 3m07 h ILE 405 Ca 0.36 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 66.17 3m07 h ILE 405 Cb 0.36 0.58 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 3m07 h ILE 405 CO -0.14 0.07 0.00 0.71 -1.08 0.00 0.00 178.15 177.71 3m07 h THR 406 N 0.38 0.00 0.00 2.19 1.35 -1.59 -1.19 112.91 114.04 3m07 h THR 406 Ca 0.18 -0.75 -0.38 0.00 -0.55 0.00 0.00 66.41 64.91 3m07 h THR 406 Cb 0.23 1.74 -0.07 0.00 -1.73 0.00 0.00 68.15 68.32 3m07 h THR 406 CO -0.04 0.00 -2.41 0.18 -0.25 0.00 0.00 175.52 173.00 3m07 n LEU 407 N -2.88 1.25 -0.01 3.87 4.77 -0.16 -4.59 117.00 119.25 3m07 n LEU 407 Ca 0.03 -0.05 0.09 0.00 -0.03 0.00 0.00 56.01 56.06 3m07 n LEU 407 Cb 0.45 -0.09 -0.13 0.00 -2.33 0.00 0.00 43.42 41.31 3m07 n LEU 407 CO 0.31 0.68 -0.59 0.00 -1.33 0.00 0.00 177.39 176.46 3m07 n ALA 408 N -2.96 2.94 0.00 -1.18 0.00 0.35 -4.83 120.51 114.83 3m07 n ALA 408 Ca -0.38 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.62 3m07 n ALA 408 Cb 1.09 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.92 3m07 n ALA 408 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m07 n GLY 409 N 1.48 -1.22 0.18 0.00 0.00 -0.45 -4.38 105.19 100.79 3m07 n GLY 409 Ca -0.02 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 3m07 n GLY 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m07 h ALA 410 N 0.00 0.49 -0.25 4.61 0.00 -1.94 -1.63 119.26 120.54 3m07 h ALA 410 Ca 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3m07 h ALA 410 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3m07 h ALA 410 CO 0.00 -0.00 0.06 0.93 0.00 0.00 0.00 179.25 180.24 3m07 h GLU 411 N 0.50 0.39 -0.75 0.00 3.07 -1.96 -0.75 114.58 115.09 3m07 h GLU 411 Ca 0.14 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 58.86 3m07 h GLU 411 Cb 0.02 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 27.84 3m07 h GLU 411 CO -0.02 0.49 0.31 -0.09 -1.40 0.00 0.00 179.01 178.30 3m07 h ARG 412 N 0.22 1.11 -0.50 2.33 2.43 -1.75 -2.85 114.38 115.36 3m07 h ARG 412 Ca 0.08 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.00 3m07 h ARG 412 Cb 0.28 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3m07 h ARG 412 CO 0.00 0.90 0.11 1.15 -1.51 0.00 0.00 179.97 180.62 3m07 h THR 413 N 1.07 1.22 -0.51 0.20 2.02 -0.98 -1.97 112.91 113.95 3m07 h THR 413 Ca 0.25 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.63 3m07 h THR 413 Cb 0.19 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 3m07 h THR 413 CO -0.02 0.29 0.33 0.11 0.37 0.00 0.00 175.52 176.60 3m07 h LYS 414 N 0.74 0.69 -0.06 6.66 1.57 -0.92 0.22 116.57 125.47 3m07 h LYS 414 Ca 0.16 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.75 3m07 h LYS 414 Cb 0.30 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3m07 h LYS 414 CO 0.00 0.48 -0.60 -0.39 -0.57 0.00 0.00 179.45 178.37 3m07 h VAL 415 N 0.69 1.39 -0.49 0.50 -1.51 -1.28 -1.93 116.25 113.62 3m07 h VAL 415 Ca 0.19 -1.98 -0.12 0.00 -1.23 0.00 0.00 66.70 63.56 3m07 h VAL 415 Cb -0.05 2.01 -0.01 0.00 -2.13 0.00 0.00 31.29 31.11 3m07 h VAL 415 CO -0.04 0.58 -0.16 -0.07 -1.23 0.00 0.00 177.57 176.65 3m07 h LEU 416 N 0.15 1.00 -0.61 4.19 3.38 -1.15 -1.07 115.31 121.20 3m07 h LEU 416 Ca -0.01 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 3m07 h LEU 416 Cb 1.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 3m07 h LEU 416 CO 0.09 1.15 0.28 0.25 0.09 0.00 0.00 178.44 180.30 3m07 h LEU 417 N 0.84 0.80 -0.79 1.67 5.85 -0.82 -1.13 115.31 121.74 3m07 h LEU 417 Ca 0.12 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 3m07 h LEU 417 Cb 0.73 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 3m07 h LEU 417 CO 0.06 0.71 0.11 0.00 -0.34 0.00 0.00 178.44 178.98 3m07 h ALA 418 N 1.12 1.00 -0.02 1.25 0.00 -1.29 -1.10 119.26 120.22 3m07 h ALA 418 Ca 0.21 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3m07 h ALA 418 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3m07 h ALA 418 CO -0.02 0.64 -0.09 1.15 0.00 0.00 0.00 179.25 180.93 3m07 h THR 419 N 0.97 0.77 -0.42 0.00 2.02 -0.88 -1.64 112.91 113.73 3m07 h THR 419 Ca 0.20 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.42 3m07 h THR 419 Cb 0.41 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.55 3m07 h THR 419 CO 0.01 0.00 0.18 0.25 0.37 0.00 0.00 175.52 176.32 3m07 h LEU 420 N -0.14 0.22 -0.43 2.58 5.85 -0.88 -2.49 115.31 120.02 3m07 h LEU 420 Ca 0.04 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3m07 h LEU 420 Cb 0.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 3m07 h LEU 420 CO -0.11 0.16 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.08 3m07 h LEU 421 N 0.36 0.00 -1.78 2.25 3.38 -1.02 -3.11 115.31 115.40 3m07 h LEU 421 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3m07 h LEU 421 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3m07 h LEU 421 CO -0.17 0.01 0.00 0.18 0.09 0.00 0.00 178.44 178.55 3m07 n LEU 422 N -3.10 2.59 -4.91 1.67 4.77 -0.64 -4.68 117.00 112.71 3m07 n LEU 422 Ca 0.03 -1.06 -0.28 0.00 -0.03 0.00 0.00 56.01 54.67 3m07 n LEU 422 Cb 0.47 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 3m07 n LEU 422 CO 0.32 0.47 0.23 -0.44 -1.33 0.00 0.00 177.39 176.64 3m07 s SER 423 N -1.50 6.41 0.42 -1.43 0.01 -0.94 -4.98 113.70 111.67 3m07 s SER 423 Ca 0.23 0.71 0.29 0.00 1.31 0.00 0.00 55.95 58.49 3m07 s SER 423 Cb 0.16 -2.14 1.28 0.00 0.21 0.00 0.00 66.02 65.53 3m07 s SER 423 CO 0.23 -0.26 1.87 1.55 0.41 0.00 0.00 173.24 177.05 3m07 h PRO 424 N 1.36 0.00 -7.27 12.44 0.13 -1.91 -3.44 132.00 133.30 3m07 h PRO 424 Ca -0.48 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.14 3m07 h PRO 424 Cb 1.20 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.45 3m07 h PRO 424 CO 0.65 0.00 0.34 -1.01 -0.23 0.00 0.00 178.00 177.75 3m07 s HIS 425 N -3.55 2.59 -0.08 1.56 3.76 -1.26 -4.36 115.29 113.95 3m07 s HIS 425 Ca 0.02 1.56 -0.30 0.00 -0.15 0.00 0.00 55.06 56.18 3m07 s HIS 425 Cb 0.09 -3.10 -0.03 0.00 1.11 0.00 0.00 32.58 30.65 3m07 s HIS 425 CO 0.44 -1.77 1.30 0.42 -0.85 0.00 0.00 174.74 174.28 3m07 s ILE 426 N -2.67 4.09 0.16 0.60 -1.09 -0.53 -4.85 121.20 116.91 3m07 s ILE 426 Ca 0.64 1.40 -0.18 0.00 -2.23 0.00 0.00 60.65 60.27 3m07 s ILE 426 Cb -0.19 -3.90 -0.07 0.00 -1.58 0.00 0.00 42.46 36.72 3m07 s ILE 426 CO 0.50 -0.05 0.63 -2.16 -1.23 0.00 0.00 174.94 172.64 3m07 s PRO 427 N 2.76 4.17 -0.09 2.79 0.04 -1.26 -0.95 135.00 142.45 3m07 s PRO 427 Ca 0.59 0.73 0.04 0.00 0.04 0.00 0.00 61.00 62.40 3m07 s PRO 427 Cb -0.26 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.27 3m07 s PRO 427 CO 0.21 0.49 -0.23 -1.17 0.04 0.00 0.00 177.00 176.34 3m07 s LEU 428 N -1.71 2.06 -0.03 -3.56 0.20 -0.01 -1.01 118.68 114.62 3m07 s LEU 428 Ca 0.37 -0.54 -0.00 0.00 0.69 0.00 0.00 54.13 54.66 3m07 s LEU 428 Cb -0.17 -1.36 -0.04 0.00 -0.43 0.00 0.00 46.19 44.19 3m07 s LEU 428 CO 0.20 0.16 0.02 -0.76 -0.29 0.00 0.00 176.35 175.68 3m07 s LEU 429 N 0.32 3.65 -0.06 -0.68 1.43 0.59 -4.39 118.68 119.54 3m07 s LEU 429 Ca -0.17 0.09 -0.18 0.00 -1.03 0.00 0.00 54.13 52.83 3m07 s LEU 429 Cb -0.17 -2.02 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 3m07 s LEU 429 CO 0.08 0.31 0.50 0.12 0.23 0.00 0.00 176.35 177.60 3m07 s PHE 430 N -1.05 3.60 0.07 0.29 5.36 -1.25 -0.34 117.98 124.65 3m07 s PHE 430 Ca 0.18 1.00 -0.37 0.00 -0.96 0.00 0.00 56.93 56.78 3m07 s PHE 430 Cb -0.12 -2.53 -0.18 0.00 -0.34 0.00 0.00 43.02 39.86 3m07 s PHE 430 CO 0.09 0.30 1.17 0.00 -1.46 0.00 0.00 175.22 175.32 3m07 n MET 431 N 3.09 0.62 0.00 10.12 0.00 -0.37 -1.53 117.12 129.05 3m07 n MET 431 Ca -0.08 0.22 0.00 0.00 0.00 0.00 0.00 57.70 57.84 3m07 n MET 431 Cb 0.52 -1.76 0.00 0.00 0.00 0.00 0.00 33.22 31.97 3m07 n MET 431 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3m07 n GLY 432 N 2.01 2.71 0.35 3.17 0.00 -1.26 -4.92 105.19 107.25 3m07 n GLY 432 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3m07 n GLY 432 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m07 h GLU 433 N 0.59 0.52 0.00 1.61 5.08 -1.60 -1.03 114.58 119.76 3m07 h GLU 433 Ca 0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3m07 h GLU 433 Cb 0.00 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 3m07 h GLU 433 CO 0.00 0.34 -0.04 1.05 -1.00 0.00 0.00 179.01 179.36 3m07 h GLU 434 N 0.53 0.00 -0.12 2.33 9.09 -1.92 -2.07 114.58 122.44 3m07 h GLU 434 Ca 0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.69 3m07 h GLU 434 Cb 0.42 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 3m07 h GLU 434 CO -0.09 0.04 0.00 2.48 0.05 0.00 0.00 179.01 181.50 3m07 n TYR 435 N -3.92 0.27 -2.33 2.06 0.18 -1.01 -2.53 117.16 109.89 3m07 n TYR 435 Ca -0.03 -0.72 -0.07 0.00 1.88 0.00 0.00 57.90 58.96 3m07 n TYR 435 Cb 0.13 -0.13 0.00 0.00 -0.38 0.00 0.00 39.34 38.97 3m07 n TYR 435 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3m07 n GLY 436 N -0.59 0.22 3.64 -7.48 0.00 -0.78 -4.40 105.19 95.80 3m07 n GLY 436 Ca 0.11 -0.55 -0.46 0.00 0.00 0.00 0.00 46.02 45.12 3m07 n GLY 436 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3m07 n GLU 437 N -1.69 1.74 0.00 1.61 4.07 -0.42 -4.90 120.64 121.04 3m07 n GLU 437 Ca -0.05 0.62 0.02 0.00 -0.06 0.00 0.00 57.16 57.69 3m07 n GLU 437 Cb 0.55 -2.20 -0.02 0.00 -0.06 0.00 0.00 31.44 29.71 3m07 n GLU 437 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3m07 n SER 438 N 1.96 0.47 -4.75 4.31 3.41 -1.26 -4.83 113.62 112.92 3m07 n SER 438 Ca 0.12 -0.73 -0.39 0.00 -0.26 0.00 0.00 58.87 57.61 3m07 n SER 438 Cb 0.30 0.79 0.03 0.00 -0.26 0.00 0.00 64.21 65.07 3m07 n SER 438 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3m07 n ARG 439 N -0.81 1.89 -1.11 4.33 1.74 -1.26 -4.74 116.66 116.70 3m07 n ARG 439 Ca 0.01 0.69 -0.30 0.00 -0.77 0.00 0.00 57.85 57.48 3m07 n ARG 439 Cb 0.08 -2.59 0.14 0.00 -1.02 0.00 0.00 32.46 29.07 3m07 n ARG 439 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3m07 s PRO 440 N -2.73 1.26 -0.37 5.56 0.04 -1.26 -4.69 135.00 132.81 3m07 s PRO 440 Ca 0.68 0.97 0.01 0.00 0.04 0.00 0.00 61.00 62.70 3m07 s PRO 440 Cb -0.43 -1.80 0.10 0.00 0.04 0.00 0.00 34.50 32.42 3m07 s PRO 440 CO 0.52 -2.28 0.11 0.12 0.04 0.00 0.00 177.00 175.50 3m07 s PHE 441 N -2.86 3.67 0.39 0.56 5.36 -0.70 -4.19 117.98 120.21 3m07 s PHE 441 Ca 0.64 -2.72 -0.03 0.00 -0.96 0.00 0.00 56.93 53.86 3m07 s PHE 441 Cb -0.19 -3.00 -0.04 0.00 -0.34 0.00 0.00 43.02 39.45 3m07 s PHE 441 CO 0.57 -0.95 0.65 -0.51 -1.46 0.00 0.00 175.22 173.52 3m07 s LEU 442 N 1.01 3.87 -0.27 6.12 1.43 -1.26 -3.38 118.68 126.20 3m07 s LEU 442 Ca 0.09 0.69 -0.29 0.00 -1.03 0.00 0.00 54.13 53.59 3m07 s LEU 442 Cb -0.21 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.43 3m07 s LEU 442 CO -0.06 -0.39 1.26 0.12 0.23 0.00 0.00 176.35 177.51 3m07 s PHE 443 N -2.45 2.78 0.07 0.29 5.36 -1.26 -4.95 117.98 117.82 3m07 s PHE 443 Ca 0.44 0.95 0.06 0.00 -0.96 0.00 0.00 56.93 57.41 3m07 s PHE 443 Cb -0.10 -3.78 -0.03 0.00 -0.34 0.00 0.00 43.02 38.77 3m07 s PHE 443 CO 0.38 -1.58 -0.15 -0.59 -1.46 0.00 0.00 175.22 171.82 3m07 s PHE 444 N 4.08 1.31 0.28 10.12 -0.12 -1.26 -4.30 117.98 128.10 3m07 s PHE 444 Ca 0.54 -0.44 0.04 0.00 -0.05 0.00 0.00 56.93 57.03 3m07 s PHE 444 Cb -0.17 -0.74 -0.01 0.00 -0.63 0.00 0.00 43.02 41.46 3m07 s PHE 444 CO 0.20 0.08 0.29 0.25 -0.05 0.00 0.00 175.22 175.99 3m07 n THR 445 N 1.35 0.00 -2.94 -4.49 -2.24 -0.12 -3.83 114.28 102.01 3m07 n THR 445 Ca -0.20 -1.86 -0.14 0.00 -2.27 0.00 0.00 64.05 59.57 3m07 n THR 445 Cb 0.54 0.98 0.01 0.00 -2.10 0.00 0.00 70.33 69.77 3m07 n THR 445 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3m07 n ASP 446 N -1.85 -1.36 -4.87 3.42 2.03 -1.17 -4.06 116.55 108.70 3m07 n ASP 446 Ca 0.05 -3.16 -0.23 0.00 0.52 0.00 0.00 54.79 51.97 3m07 n ASP 446 Cb 0.50 0.77 -0.03 0.00 -0.72 0.00 0.00 41.12 41.64 3m07 n ASP 446 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3m07 s PHE 447 N -0.39 2.40 0.19 -0.67 0.08 -1.26 -3.62 117.98 114.71 3m07 s PHE 447 Ca 0.32 -0.59 -0.00 0.00 0.12 0.00 0.00 56.93 56.78 3m07 s PHE 447 Cb 0.24 -2.09 -0.04 0.00 -0.57 0.00 0.00 43.02 40.56 3m07 s PHE 447 CO -0.15 -0.20 0.09 -1.01 -0.10 0.00 0.00 175.22 173.85 3m07 s HIS 448 N -2.57 1.17 0.00 0.36 3.76 -1.26 -4.59 115.29 112.16 3m07 s HIS 448 Ca 0.45 -1.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.09 3m07 s HIS 448 Cb -0.02 -0.63 0.00 0.00 1.11 0.00 0.00 32.58 33.04 3m07 s HIS 448 CO 0.26 -0.50 0.00 0.41 -0.85 0.00 0.00 174.74 174.06 3m07 n GLY 449 N -0.26 2.52 0.34 -2.22 0.00 -1.26 -2.08 105.19 102.23 3m07 n GLY 449 Ca -0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 3m07 n GLY 449 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3m07 h ASP 450 N 9.02 0.91 -0.45 1.61 3.32 -1.99 -2.59 116.42 126.24 3m07 h ASP 450 Ca 0.00 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3m07 h ASP 450 Cb 0.00 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 3m07 h ASP 450 CO 0.00 0.71 0.27 0.25 -1.72 0.00 0.00 179.24 178.75 3m07 h LEU 451 N 1.04 0.55 -0.39 1.55 5.85 -1.94 0.20 115.31 122.17 3m07 h LEU 451 Ca 0.27 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.98 3m07 h LEU 451 Cb -0.02 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 3m07 h LEU 451 CO -0.05 0.45 0.08 0.00 -0.34 0.00 0.00 178.44 178.59 3m07 h ALA 452 N 1.12 0.42 -0.50 1.25 0.00 -1.05 -0.01 119.26 120.50 3m07 h ALA 452 Ca 0.16 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 3m07 h ALA 452 Cb 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3m07 h ALA 452 CO -0.03 -0.32 0.20 -0.09 0.00 0.00 0.00 179.25 179.02 3m07 h ARG 453 N 0.21 0.75 -0.79 0.00 2.43 -1.15 -1.16 114.38 114.67 3m07 h ARG 453 Ca 0.19 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 3m07 h ARG 453 Cb 0.22 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 3m07 h ARG 453 CO -0.24 0.66 0.31 0.00 -1.51 0.00 0.00 179.97 179.19 3m07 h ALA 454 N 1.05 1.03 -0.34 2.80 0.00 -0.10 -0.93 119.26 122.77 3m07 h ALA 454 Ca 0.17 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3m07 h ALA 454 Cb 0.19 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3m07 h ALA 454 CO -0.01 0.66 -0.20 0.28 0.00 0.00 0.00 179.25 179.98 3m07 h VAL 455 N 1.15 1.29 0.58 0.00 2.07 -0.87 0.11 116.25 120.58 3m07 h VAL 455 Ca 0.26 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 3m07 h VAL 455 Cb 0.22 1.42 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3m07 h VAL 455 CO -0.02 0.43 -0.28 -0.09 0.02 0.00 0.00 177.57 177.63 3m07 h ARG 456 N 0.50 -0.75 -0.02 1.57 2.43 -1.01 -1.55 114.38 115.56 3m07 h ARG 456 Ca 0.07 0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 3m07 h ARG 456 Cb 0.74 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 3m07 h ARG 456 CO 0.06 -0.47 -0.41 0.93 -1.51 0.00 0.00 179.97 178.56 3m07 h GLU 457 N -0.84 0.04 -0.40 0.20 5.08 -1.19 -0.44 114.58 117.04 3m07 h GLU 457 Ca -0.08 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3m07 h GLU 457 Cb 0.62 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 3m07 h GLU 457 CO 0.13 0.45 0.04 0.78 -1.00 0.00 0.00 179.01 179.41 3m07 h GLY 458 N 1.25 0.65 0.69 -3.84 0.00 -0.71 -0.68 103.07 100.43 3m07 h GLY 458 Ca 0.00 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.87 3m07 h GLY 458 CO 0.06 0.36 -0.25 -0.09 0.00 0.00 0.00 176.54 176.61 3m07 h ARG 459 N 0.59 0.33 -0.82 4.80 9.65 -0.34 -3.14 114.38 125.45 3m07 h ARG 459 Ca 0.13 -0.24 0.02 0.00 -1.10 0.00 0.00 59.98 58.79 3m07 h ARG 459 Cb 0.31 0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.89 3m07 h ARG 459 CO 0.01 0.85 0.54 0.00 2.80 0.00 0.00 179.97 184.17 3m07 h ALA 460 N 0.48 1.46 0.00 2.80 0.00 -0.86 -2.15 119.26 120.99 3m07 h ALA 460 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3m07 h ALA 460 Cb 0.87 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3m07 h ALA 460 CO 0.05 0.48 -0.15 0.87 0.00 0.00 0.00 179.25 180.50 3m07 h LYS 461 N 1.06 0.00 0.00 0.00 1.57 -1.15 -1.10 116.57 116.96 3m07 h LYS 461 Ca 0.32 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.09 3m07 h LYS 461 Cb -0.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3m07 h LYS 461 CO -0.08 0.15 -0.02 0.93 -0.57 0.00 0.00 179.45 179.86 3m07 h GLU 462 N 0.00 0.00 0.00 3.15 5.08 -1.33 -2.99 114.58 118.48 3m07 h GLU 462 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3m07 h GLU 462 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3m07 h GLU 462 CO 0.02 0.02 -0.02 1.19 -1.00 0.00 0.00 179.01 179.22 3m07 n PHE 463 N -3.19 0.00 -0.04 4.33 3.72 -0.46 -4.74 117.46 117.09 3m07 n PHE 463 Ca -0.02 -0.92 0.02 0.00 -0.05 0.00 0.00 57.45 56.49 3m07 n PHE 463 Cb 0.18 -0.14 0.37 0.00 -0.94 0.00 0.00 39.48 38.95 3m07 n PHE 463 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m07 h ALA 464 N 0.00 1.59 0.00 4.37 0.00 -1.28 -0.94 119.26 123.00 3m07 h ALA 464 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3m07 h ALA 464 Cb 0.97 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3m07 h ALA 464 CO 0.00 0.35 0.00 -0.40 0.00 0.00 0.00 179.25 179.20 3m07 n ASP 465 N -4.42 0.00 -1.69 0.00 3.85 -1.26 -2.32 116.55 110.70 3m07 n ASP 465 Ca 0.04 0.03 0.07 0.00 -0.71 0.00 0.00 54.79 54.22 3m07 n ASP 465 Cb 0.09 -0.30 0.38 0.00 -1.35 0.00 0.00 41.12 39.94 3m07 n ASP 465 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 3m07 n HIS 466 N -1.30 1.85 -0.40 2.11 8.25 -0.36 -5.03 115.22 120.33 3m07 n HIS 466 Ca 0.10 -0.76 -0.16 0.00 -0.26 0.00 0.00 57.72 56.64 3m07 n HIS 466 Cb 0.18 -0.47 -0.02 0.00 1.12 0.00 0.00 29.99 30.79 3m07 n HIS 466 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m07 n ALA 467 N 0.38 -0.31 0.00 -1.41 0.00 -0.98 -2.49 120.51 115.70 3m07 n ALA 467 Ca 0.27 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3m07 n ALA 467 Cb 1.14 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 20.14 3m07 n ALA 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m07 n GLY 468 N 0.95 1.10 3.75 0.00 0.00 -1.26 -5.12 105.19 104.61 3m07 n GLY 468 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3m07 n GLY 468 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m07 s GLU 469 N 0.00 2.75 -0.39 1.61 2.56 -1.04 -5.01 118.70 119.18 3m07 s GLU 469 Ca 0.00 1.72 0.02 0.00 0.00 0.00 0.00 54.97 56.71 3m07 s GLU 469 Cb 0.00 -1.91 0.15 0.00 2.00 0.00 0.00 34.13 34.37 3m07 s GLU 469 CO 0.00 -1.35 0.26 1.21 -0.56 0.00 0.00 175.26 174.82 3m07 s ASN 470 N -1.89 2.61 0.11 -1.70 3.84 -1.26 -5.11 114.94 111.54 3m07 s ASN 470 Ca 0.75 -2.55 -0.31 0.00 0.21 0.00 0.00 52.86 50.96 3m07 s ASN 470 Cb -0.28 -0.51 -0.08 0.00 -0.55 0.00 0.00 41.25 39.84 3m07 s ASN 470 CO 0.37 -0.26 1.36 -0.69 -2.79 0.00 0.00 177.10 175.09 3m07 s VAL 471 N 0.62 3.41 0.34 -5.21 1.01 -1.26 -4.96 120.40 114.35 3m07 s VAL 471 Ca 0.23 1.02 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 3m07 s VAL 471 Cb -0.14 -3.65 -0.11 0.00 0.00 0.00 0.00 36.38 32.48 3m07 s VAL 471 CO -0.06 0.08 1.40 -2.84 0.00 0.00 0.00 175.10 173.68 3m07 s PRO 472 N 1.07 4.25 0.03 2.72 0.02 -1.26 -4.89 135.00 136.93 3m07 s PRO 472 Ca 0.63 2.37 -0.30 0.00 0.02 0.00 0.00 61.00 63.73 3m07 s PRO 472 Cb -0.36 -3.03 -0.08 0.00 0.02 0.00 0.00 34.50 31.05 3m07 s PRO 472 CO 0.30 -0.35 1.93 0.34 -0.33 0.00 0.00 177.00 178.89 3m07 s ASP 473 N -0.25 6.47 0.48 2.53 2.15 -1.26 -4.85 116.67 121.94 3m07 s ASP 473 Ca 0.52 2.62 0.13 0.00 0.43 0.00 0.00 52.55 56.25 3m07 s ASP 473 Cb -0.43 -2.53 1.14 0.00 -0.30 0.00 0.00 42.92 40.80 3m07 s ASP 473 CO 0.56 -1.04 2.12 -0.65 -0.17 0.00 0.00 175.17 175.99 3m07 h PRO 474 N 10.43 0.18 0.00 4.34 0.11 -1.91 -2.07 132.00 143.09 3m07 h PRO 474 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3m07 h PRO 474 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3m07 h PRO 474 CO 0.94 0.12 0.00 0.09 -0.21 0.00 0.00 178.00 178.94 3m07 n ASN 475 N -4.52 0.51 -4.72 -2.05 3.02 -1.26 -0.94 115.26 105.31 3m07 n ASN 475 Ca -0.01 0.57 -0.42 0.00 -0.03 0.00 0.00 54.58 54.70 3m07 n ASN 475 Cb 0.09 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.53 3m07 n ASN 475 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m07 s ALA 476 N -3.12 3.45 0.47 5.41 0.00 -0.78 -4.76 121.76 122.44 3m07 s ALA 476 Ca 0.09 0.94 0.21 0.00 0.00 0.00 0.00 51.96 53.20 3m07 s ALA 476 Cb 0.13 -3.46 1.21 0.00 0.00 0.00 0.00 23.12 21.00 3m07 s ALA 476 CO 0.50 -0.47 1.94 -1.35 0.00 0.00 0.00 175.76 176.37 3m07 h PRO 477 N 6.49 0.23 -0.85 0.00 0.11 -1.89 -1.76 132.00 134.33 3m07 h PRO 477 Ca -0.42 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.73 3m07 h PRO 477 Cb 1.21 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3m07 h PRO 477 CO 0.81 0.15 0.56 0.93 -0.21 0.00 0.00 178.00 180.24 3m07 h GLU 478 N 0.23 0.96 -1.00 1.05 3.07 -1.93 -0.30 114.58 116.66 3m07 h GLU 478 Ca 0.35 -0.06 0.02 0.00 -0.50 0.00 0.00 59.36 59.16 3m07 h GLU 478 Cb 1.02 -0.22 -0.05 0.00 -0.84 0.00 0.00 28.75 28.66 3m07 h GLU 478 CO -0.07 0.63 0.66 1.15 -1.40 0.00 0.00 179.01 179.98 3m07 h THR 479 N 0.99 1.24 -0.06 1.13 2.02 -1.58 0.14 112.91 116.78 3m07 h THR 479 Ca 0.36 -0.46 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 3m07 h THR 479 Cb 0.15 -0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.34 3m07 h THR 479 CO -0.12 0.25 -0.11 0.15 0.37 0.00 0.00 175.52 176.06 3m07 h PHE 480 N 1.34 0.23 -1.00 3.16 3.57 -1.47 -3.26 116.94 119.51 3m07 h PHE 480 Ca 0.37 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.84 3m07 h PHE 480 Cb -0.13 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 38.51 3m07 h PHE 480 CO -0.00 0.69 0.65 1.96 -2.23 0.00 0.00 178.31 179.38 3m07 h GLN 481 N -0.30 1.21 0.00 1.11 4.20 -0.64 -1.38 115.11 119.32 3m07 h GLN 481 Ca 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3m07 h GLN 481 Cb 0.67 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.18 3m07 h GLN 481 CO 0.02 0.80 0.00 0.00 -0.67 0.00 0.00 178.83 178.99 3m07 h ARG 482 N 1.25 0.00 -0.01 1.46 3.08 -0.82 -2.84 114.38 116.51 3m07 h ARG 482 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3m07 h ARG 482 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3m07 h ARG 482 CO -0.13 0.00 -0.49 0.43 -1.07 0.00 0.00 179.97 178.71 3m07 n SER 483 N -3.04 1.10 -4.75 7.04 7.64 -0.53 -4.27 113.62 116.81 3m07 n SER 483 Ca -0.01 -0.88 -0.41 0.00 1.01 0.00 0.00 58.87 58.58 3m07 n SER 483 Cb 0.21 0.38 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 3m07 n SER 483 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3m07 s LYS 484 N -2.71 4.17 0.46 1.43 -0.14 -1.07 -4.83 119.74 117.05 3m07 s LYS 484 Ca 0.17 2.48 -0.25 0.00 -1.36 0.00 0.00 55.97 57.01 3m07 s LYS 484 Cb 0.18 -3.04 -0.08 0.00 -1.68 0.00 0.00 37.83 33.21 3m07 s LYS 484 CO 0.64 -0.53 1.44 1.28 -0.76 0.00 0.00 175.35 177.41 3m07 n LEU 485 N 1.93 5.21 -4.36 3.17 4.77 -0.82 -4.93 117.00 121.98 3m07 n LEU 485 Ca 0.06 1.11 -0.46 0.00 -0.03 0.00 0.00 56.01 56.69 3m07 n LEU 485 Cb 0.39 -1.61 -0.03 0.00 -2.33 0.00 0.00 43.42 39.84 3m07 n LEU 485 CO 0.62 -0.16 0.50 0.21 -1.33 0.00 0.00 177.39 177.23 3m07 s ASN 486 N -0.50 6.60 0.44 -1.43 2.47 -1.26 -4.86 114.94 116.39 3m07 s ASN 486 Ca 0.62 -2.30 0.30 0.00 0.42 0.00 0.00 52.86 51.90 3m07 s ASN 486 Cb -0.44 -2.26 1.28 0.00 -1.45 0.00 0.00 41.25 38.38 3m07 s ASN 486 CO 0.57 -0.77 1.89 -0.50 -3.72 0.00 0.00 177.10 174.57 3m07 h TRP 487 N 8.30 0.00 -0.51 0.43 4.06 -1.96 -2.16 115.95 124.10 3m07 h TRP 487 Ca 0.02 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 3m07 h TRP 487 Cb 1.05 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.19 3m07 h TRP 487 CO 1.00 0.00 0.21 0.87 -3.56 0.00 0.00 178.44 176.96 3m07 h LYS 488 N 0.00 0.76 -0.54 0.49 1.57 -1.98 -1.61 116.57 115.26 3m07 h LYS 488 Ca 0.00 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.55 3m07 h LYS 488 Cb 0.41 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3m07 h LYS 488 CO 0.00 0.66 -0.02 0.37 -0.57 0.00 0.00 179.45 179.89 3m07 h GLN 489 N 0.69 0.97 -0.99 3.15 4.15 -1.80 0.17 115.11 121.44 3m07 h GLN 489 Ca 0.17 -0.32 0.14 0.00 0.77 0.00 0.00 58.65 59.41 3m07 h GLN 489 Cb 0.18 -0.08 -0.09 0.00 0.21 0.00 0.00 27.48 27.70 3m07 h GLN 489 CO -0.02 0.99 0.61 0.37 -1.93 0.00 0.00 178.83 178.85 3m07 h GLN 490 N 0.85 0.87 0.00 1.69 -0.00 -1.17 0.44 115.11 117.78 3m07 h GLN 490 Ca 0.15 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.75 3m07 h GLN 490 Cb 0.56 -0.20 0.00 0.00 0.00 0.00 0.00 27.48 27.85 3m07 h GLN 490 CO 0.03 0.57 -0.19 0.72 0.00 0.00 0.00 178.83 179.97 3m07 n HIS 491 N -4.69 0.56 -0.98 3.99 8.25 -0.63 -4.14 115.22 117.59 3m07 n HIS 491 Ca 0.20 0.16 -0.29 0.00 -0.26 0.00 0.00 57.72 57.54 3m07 n HIS 491 Cb 0.42 -0.72 0.20 0.00 1.12 0.00 0.00 29.99 31.01 3m07 n HIS 491 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3m07 s SER 492 N -3.99 2.20 0.15 0.41 1.04 0.14 -4.78 113.70 108.87 3m07 s SER 492 Ca 0.10 1.33 -0.11 0.00 0.48 0.00 0.00 55.95 57.75 3m07 s SER 492 Cb 0.14 -2.02 -0.01 0.00 0.10 0.00 0.00 66.02 64.23 3m07 s SER 492 CO 0.62 -3.42 1.53 -0.33 0.98 0.00 0.00 173.24 172.62 3m07 h GLU 493 N -2.09 0.94 -0.48 4.02 4.39 -1.91 0.18 114.58 119.63 3m07 h GLU 493 Ca -0.56 -0.41 -0.08 0.00 0.34 0.00 0.00 59.36 58.65 3m07 h GLU 493 Cb 1.33 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 3m07 h GLU 493 CO 0.55 1.07 -0.04 1.49 -1.16 0.00 0.00 179.01 180.92 3m07 h GLU 494 N 0.77 0.82 -0.49 2.33 4.81 -1.93 -1.55 114.58 119.35 3m07 h GLU 494 Ca 0.10 -0.24 -0.11 0.00 -0.13 0.00 0.00 59.36 58.98 3m07 h GLU 494 Cb 0.79 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 3m07 h GLU 494 CO 0.07 0.85 -0.11 0.78 -0.73 0.00 0.00 179.01 179.86 3m07 h GLY 495 N 0.98 1.02 2.00 1.92 0.00 -1.61 -2.63 103.07 104.75 3m07 h GLY 495 Ca 0.14 -0.84 -0.04 0.00 0.00 0.00 0.00 47.33 46.59 3m07 h GLY 495 CO 0.03 0.76 -0.20 0.50 0.00 0.00 0.00 176.54 177.63 3m07 h LYS 496 N 0.79 0.00 -0.18 4.80 1.79 -0.55 -0.05 116.57 123.17 3m07 h LYS 496 Ca 0.12 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 3m07 h LYS 496 Cb 0.67 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 3m07 h LYS 496 CO 0.05 0.20 -0.01 0.00 -1.08 0.00 0.00 179.45 178.61 3m07 h ALA 497 N 1.80 0.25 -0.68 3.86 0.00 -1.12 -0.79 119.26 122.58 3m07 h ALA 497 Ca -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3m07 h ALA 497 Cb 0.39 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3m07 h ALA 497 CO 0.03 -0.03 0.40 -1.49 0.00 0.00 0.00 179.25 178.15 3m07 h TRP 498 N 0.07 0.90 -0.74 0.00 4.06 -1.09 -1.77 115.95 117.38 3m07 h TRP 498 Ca 0.05 -0.01 -0.03 0.00 2.06 0.00 0.00 58.89 60.97 3m07 h TRP 498 Cb 0.40 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.23 3m07 h TRP 498 CO 0.04 0.62 0.36 -0.07 -3.56 0.00 0.00 178.44 175.83 3m07 h LEU 499 N 0.92 0.96 -0.79 -4.49 3.38 -0.72 0.40 115.31 114.98 3m07 h LEU 499 Ca 0.24 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3m07 h LEU 499 Cb -0.01 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3m07 h LEU 499 CO -0.04 0.82 0.11 0.00 0.09 0.00 0.00 178.44 179.41 3m07 h ALA 500 N 1.18 1.00 0.06 1.53 0.00 -0.96 0.90 119.26 122.98 3m07 h ALA 500 Ca 0.26 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m07 h ALA 500 Cb 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3m07 h ALA 500 CO -0.03 0.63 -0.03 0.35 0.00 0.00 0.00 179.25 180.17 3m07 h PHE 501 N 0.96 -0.08 -0.37 0.00 3.57 -0.83 -1.65 116.94 118.53 3m07 h PHE 501 Ca 0.19 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3m07 h PHE 501 Cb 0.41 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 3m07 h PHE 501 CO 0.03 0.06 0.20 1.15 -2.23 0.00 0.00 178.31 177.51 3m07 h THR 502 N -0.21 1.15 -0.61 4.41 2.02 -0.75 -1.90 112.91 117.04 3m07 h THR 502 Ca -0.01 -0.42 0.06 0.00 0.77 0.00 0.00 66.41 66.81 3m07 h THR 502 Cb 0.18 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 3m07 h THR 502 CO 0.01 0.16 0.31 -0.09 0.37 0.00 0.00 175.52 176.29 3m07 h ARG 503 N 0.47 0.56 -0.40 6.66 2.43 -0.78 -1.87 114.38 121.46 3m07 h ARG 503 Ca 0.13 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3m07 h ARG 503 Cb 0.08 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3m07 h ARG 503 CO -0.02 0.37 0.24 1.49 -1.51 0.00 0.00 179.97 180.54 3m07 h GLU 504 N 0.58 0.54 -0.68 0.20 4.81 -1.05 -1.73 114.58 117.25 3m07 h GLU 504 Ca 0.28 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.47 3m07 h GLU 504 Cb 0.21 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3m07 h GLU 504 CO -0.20 0.41 0.44 -0.07 -0.73 0.00 0.00 179.01 178.86 3m07 h LEU 505 N 0.52 0.74 -0.84 1.64 3.38 -0.93 -1.42 115.31 118.40 3m07 h LEU 505 Ca 0.14 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 3m07 h LEU 505 Cb 0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3m07 h LEU 505 CO -0.03 0.53 -0.30 -0.07 0.09 0.00 0.00 178.44 178.66 3m07 h LEU 506 N 0.88 0.52 -0.23 1.67 3.38 -1.16 0.12 115.31 120.49 3m07 h LEU 506 Ca 0.26 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3m07 h LEU 506 Cb -0.05 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3m07 h LEU 506 CO -0.08 0.80 0.06 0.25 0.09 0.00 0.00 178.44 179.57 3m07 h LEU 507 N 0.44 0.35 -0.73 1.67 5.85 -1.00 -1.14 115.31 120.75 3m07 h LEU 507 Ca 0.06 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 3m07 h LEU 507 Cb 0.75 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 3m07 h LEU 507 CO 0.06 0.48 0.38 -0.07 -0.34 0.00 0.00 178.44 178.94 3m07 h LEU 508 N 0.20 0.94 -0.02 2.25 3.38 -1.06 -1.08 115.31 119.91 3m07 h LEU 508 Ca 0.07 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.95 3m07 h LEU 508 Cb 0.27 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3m07 h LEU 508 CO -0.00 0.79 -0.09 -0.09 0.09 0.00 0.00 178.44 179.14 3m07 h ARG 509 N 1.02 -0.14 -0.93 1.13 2.43 -0.54 -0.23 114.38 117.12 3m07 h ARG 509 Ca 0.25 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3m07 h ARG 509 Cb 0.08 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 3m07 h ARG 509 CO -0.04 -0.10 0.59 0.37 -1.51 0.00 0.00 179.97 179.28 3m07 h GLN 510 N -0.15 1.24 -0.05 0.20 5.75 -1.02 -0.70 115.11 120.37 3m07 h GLN 510 Ca 0.04 -0.09 -0.21 0.00 -0.15 0.00 0.00 58.65 58.24 3m07 h GLN 510 Cb 0.21 -0.27 0.01 0.00 1.07 0.00 0.00 27.48 28.50 3m07 h GLN 510 CO -0.11 0.84 -0.77 -0.22 -2.65 0.00 0.00 178.83 175.92 3m07 h LYS 511 N 1.27 0.61 0.00 1.69 3.64 -1.02 -3.39 116.57 119.37 3m07 h LYS 511 Ca 0.34 -0.59 -0.13 0.00 -1.27 0.00 0.00 60.65 58.99 3m07 h LYS 511 Cb -0.10 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3m07 h LYS 511 CO -0.07 1.20 -1.50 0.72 -2.27 0.00 0.00 179.45 177.54 3m07 n HIS 512 N -4.04 0.00 -0.10 1.91 8.25 -0.11 -4.71 115.22 116.41 3m07 n HIS 512 Ca -0.10 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.17 3m07 n HIS 512 Cb 0.75 -0.35 -0.09 0.00 1.12 0.00 0.00 29.99 31.42 3m07 n HIS 512 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3m07 n ILE 513 N -2.34 1.51 -0.33 1.59 2.08 -0.40 -4.43 119.36 117.03 3m07 n ILE 513 Ca -0.12 -0.05 0.12 0.00 0.56 0.00 0.00 62.75 63.26 3m07 n ILE 513 Cb 0.72 -2.10 0.31 0.00 -0.75 0.00 0.00 39.64 37.82 3m07 n ILE 513 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3m07 h VAL 514 N -1.00 0.65 0.00 1.39 2.07 -1.39 -0.71 116.25 117.27 3m07 h VAL 514 Ca -0.34 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3m07 h VAL 514 Cb 1.20 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3m07 h VAL 514 CO -0.20 0.12 0.00 -0.65 0.02 0.00 0.00 177.57 176.86 3m07 h PRO 515 N 0.66 0.00 0.00 1.57 0.11 -1.77 -1.80 132.00 130.77 3m07 h PRO 515 Ca 0.56 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.67 3m07 h PRO 515 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3m07 h PRO 515 CO -0.41 0.00 -0.07 -0.07 -0.21 0.00 0.00 178.00 177.23 3m07 h LEU 516 N 0.00 0.00 0.01 2.35 3.38 -1.34 -3.40 115.31 116.32 3m07 h LEU 516 Ca 0.00 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.74 3m07 h LEU 516 Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3m07 h LEU 516 CO 0.00 0.00 -1.05 -0.07 0.09 0.00 0.00 178.44 177.42 3m07 h LEU 517 N 0.00 0.05 -0.66 1.67 3.38 -1.35 -3.32 115.31 115.09 3m07 h LEU 517 Ca 0.00 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3m07 h LEU 517 Cb 0.90 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 3m07 h LEU 517 CO 0.00 1.04 0.15 -1.28 0.09 0.00 0.00 178.44 178.44 3m07 h SER 518 N 0.01 1.00 0.69 -0.43 0.87 -1.77 -2.55 113.55 111.37 3m07 h SER 518 Ca -0.03 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3m07 h SER 518 Cb 1.80 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.50 3m07 h SER 518 CO 0.14 0.98 0.00 0.00 -0.53 0.00 0.00 176.83 177.42 3m07 n ALA 519 N -2.44 2.36 -2.62 6.23 0.00 -1.25 -4.71 120.51 118.08 3m07 n ALA 519 Ca 0.04 -0.12 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 3m07 n ALA 519 Cb 0.26 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 3m07 n ALA 519 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m07 s ALA 520 N -2.73 2.87 -0.40 0.00 0.00 -0.96 -4.77 121.76 115.77 3m07 s ALA 520 Ca 0.22 -1.41 0.23 0.00 0.00 0.00 0.00 51.96 51.00 3m07 s ALA 520 Cb 0.19 -4.13 0.23 0.00 0.00 0.00 0.00 23.12 19.40 3m07 s ALA 520 CO 0.46 -3.08 1.35 0.00 0.00 0.00 0.00 175.76 174.48 3m07 h ARG 521 N 9.85 0.00 -4.89 0.00 2.47 -1.87 -3.41 114.38 116.54 3m07 h ARG 521 Ca -0.28 0.00 -0.40 0.00 -1.26 0.00 0.00 59.98 58.04 3m07 h ARG 521 Cb 1.06 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.24 3m07 h ARG 521 CO 1.24 0.00 -0.57 -1.83 0.56 0.00 0.00 179.97 179.37 3m07 s GLU 522 N -3.26 1.55 0.19 0.04 -1.05 -1.26 -3.20 118.70 111.71 3m07 s GLU 522 Ca 0.04 -1.88 -0.17 0.00 -0.15 0.00 0.00 54.97 52.81 3m07 s GLU 522 Cb 0.08 -0.16 0.16 0.00 -0.44 0.00 0.00 34.13 33.77 3m07 s GLU 522 CO 0.72 -0.41 1.62 0.66 0.95 0.00 0.00 175.26 178.80 3m07 h SER 523 N 2.25 -0.77 -0.53 0.83 4.64 0.18 -3.38 113.55 116.76 3m07 h SER 523 Ca -0.35 0.19 -0.15 0.00 -0.47 0.00 0.00 61.79 61.01 3m07 h SER 523 Cb 1.25 0.43 -0.06 0.00 -0.31 0.00 0.00 62.40 63.71 3m07 h SER 523 CO 0.55 -0.25 -0.14 -1.20 -0.87 0.00 0.00 176.83 174.92 3m07 n SER 524 N -5.42 -4.59 -4.89 4.97 7.64 -1.26 -4.72 113.62 105.35 3m07 n SER 524 Ca 0.05 0.18 -0.34 0.00 1.01 0.00 0.00 58.87 59.76 3m07 n SER 524 Cb 0.32 -3.36 -0.05 0.00 -1.01 0.00 0.00 64.21 60.11 3m07 n SER 524 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3m07 s GLY 525 N -1.95 2.24 0.01 0.23 0.00 -1.20 -1.44 107.32 105.21 3m07 s GLY 525 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.13 3m07 s GLY 525 CO 0.00 -0.41 -0.02 -1.08 0.00 0.00 0.00 173.10 171.59 3m07 s THR 526 N -1.30 0.10 -0.22 0.90 -1.32 0.39 -4.70 115.64 109.48 3m07 s THR 526 Ca 0.28 -0.38 -0.26 0.00 -1.21 0.00 0.00 61.69 60.11 3m07 s THR 526 Cb -0.13 -0.15 -0.00 0.00 -1.51 0.00 0.00 72.50 70.70 3m07 s THR 526 CO 0.16 -0.18 0.88 -0.69 -2.21 0.00 0.00 174.62 172.58 3m07 s VAL 527 N -0.58 4.81 -0.13 5.08 1.01 -1.26 -1.38 120.40 127.95 3m07 s VAL 527 Ca -0.06 1.70 -0.16 0.00 0.00 0.00 0.00 61.98 63.46 3m07 s VAL 527 Cb -0.04 -4.17 -0.14 0.00 0.00 0.00 0.00 36.38 32.03 3m07 s VAL 527 CO -0.00 -0.07 0.36 -0.07 0.00 0.00 0.00 175.10 175.31 3m07 h LEU 528 N 9.00 0.00 -7.24 3.92 3.38 -1.13 -3.49 115.31 119.76 3m07 h LEU 528 Ca -0.24 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.16 3m07 h LEU 528 Cb 1.10 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.69 3m07 h LEU 528 CO 0.89 0.86 0.01 -1.10 0.09 0.00 0.00 178.44 179.19 3m07 s GLN 529 N -2.00 1.04 0.05 1.13 -1.52 -1.09 -5.02 119.66 112.26 3m07 s GLN 529 Ca -0.13 -0.33 -0.03 0.00 -1.95 0.00 0.00 55.36 52.92 3m07 s GLN 529 Cb -0.01 0.47 -0.03 0.00 -0.22 0.00 0.00 33.01 33.23 3m07 s GLN 529 CO 0.40 -0.38 0.04 0.95 -0.25 0.00 0.00 175.29 176.04 3m07 s THR 530 N -2.71 0.18 0.25 -0.19 -4.23 -1.26 -1.11 115.64 106.58 3m07 s THR 530 Ca -0.04 -1.51 -0.21 0.00 -1.18 0.00 0.00 61.69 58.76 3m07 s THR 530 Cb -0.00 -1.31 0.03 0.00 1.34 0.00 0.00 72.50 72.56 3m07 s THR 530 CO -0.04 -0.83 0.68 0.00 -0.54 0.00 0.00 174.62 173.88 3m07 s ALA 531 N -3.56 -1.22 -0.02 3.99 0.00 -0.59 -5.00 121.76 115.37 3m07 s ALA 531 Ca 0.03 -0.20 -0.36 0.00 0.00 0.00 0.00 51.96 51.43 3m07 s ALA 531 Cb 0.05 0.87 -0.14 0.00 0.00 0.00 0.00 23.12 23.89 3m07 s ALA 531 CO -0.09 -0.97 1.64 -2.30 0.00 0.00 0.00 175.76 174.04 3m07 n PRO 532 N -0.44 1.69 -1.02 0.00 -0.02 -1.26 -0.82 135.00 133.14 3m07 n PRO 532 Ca -0.06 0.61 -0.01 0.00 -2.02 0.00 0.00 63.50 62.02 3m07 n PRO 532 Cb 0.60 -2.35 -0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3m07 n PRO 532 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m07 n GLY 533 N 3.63 0.40 2.88 -1.23 0.00 -1.26 -4.78 105.19 104.83 3m07 n GLY 533 Ca 0.21 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 3m07 n GLY 533 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3m07 s PHE 534 N -1.74 -0.10 0.06 1.61 5.36 0.00 -0.37 117.98 122.79 3m07 s PHE 534 Ca 0.00 0.38 0.03 0.00 -0.96 0.00 0.00 56.93 56.38 3m07 s PHE 534 Cb 0.00 -0.13 -0.03 0.00 -0.34 0.00 0.00 43.02 42.52 3m07 s PHE 534 CO 0.00 -0.14 -0.10 0.96 -1.46 0.00 0.00 175.22 174.47 3m07 s ILE 535 N 1.14 0.78 -0.08 3.12 -4.36 -0.56 -1.54 121.20 119.70 3m07 s ILE 535 Ca -0.09 -1.19 -0.03 0.00 -0.26 0.00 0.00 60.65 59.08 3m07 s ILE 535 Cb -0.12 -0.82 0.04 0.00 1.25 0.00 0.00 42.46 42.82 3m07 s ILE 535 CO -0.05 -0.33 0.16 0.00 0.24 0.00 0.00 174.94 174.96 3m07 s ALA 536 N -1.38 -0.22 0.09 2.27 0.00 -0.26 -0.98 121.76 121.29 3m07 s ALA 536 Ca -0.06 0.62 0.02 0.00 0.00 0.00 0.00 51.96 52.54 3m07 s ALA 536 Cb -0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 3m07 s ALA 536 CO 0.01 -0.39 -0.07 0.14 0.00 0.00 0.00 175.76 175.45 3m07 s VAL 537 N 1.80 0.72 0.01 0.00 -7.23 0.14 -0.50 120.40 115.35 3m07 s VAL 537 Ca -0.02 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.38 3m07 s VAL 537 Cb -0.12 -1.49 -0.01 0.00 0.56 0.00 0.00 36.38 35.32 3m07 s VAL 537 CO -0.06 -0.76 -0.05 -0.55 -0.31 0.00 0.00 175.10 173.37 3m07 s SER 538 N -2.76 0.51 -0.11 4.85 0.15 -0.48 -0.85 113.70 115.01 3m07 s SER 538 Ca 0.08 -0.22 0.02 0.00 0.70 0.00 0.00 55.95 56.54 3m07 s SER 538 Cb 0.02 -0.02 0.01 0.00 -1.71 0.00 0.00 66.02 64.32 3m07 s SER 538 CO -0.03 -0.04 -0.19 0.26 1.20 0.00 0.00 173.24 174.44 3m07 s TRP 539 N -0.51 2.25 -0.78 3.44 0.51 0.11 -0.46 118.94 123.50 3m07 s TRP 539 Ca -0.03 -1.04 -0.07 0.00 -2.12 0.00 0.00 56.10 52.85 3m07 s TRP 539 Cb -0.04 -1.56 0.20 0.00 -0.81 0.00 0.00 33.47 31.26 3m07 s TRP 539 CO -0.00 -0.49 0.67 0.50 -0.51 0.00 0.00 176.95 177.12 3m07 s ARG 540 N 0.77 3.17 0.37 4.98 3.52 -0.52 -0.93 118.95 130.30 3m07 s ARG 540 Ca -0.10 -2.72 -0.00 0.00 -0.13 0.00 0.00 55.73 52.78 3m07 s ARG 540 Cb -0.16 -4.06 -0.03 0.00 -1.56 0.00 0.00 34.95 29.13 3m07 s ARG 540 CO 0.01 -1.23 0.58 -0.06 -0.81 0.00 0.00 175.30 173.79 3m07 s PHE 541 N -0.35 3.50 0.45 5.12 0.08 -0.50 -4.89 117.98 121.40 3m07 s PHE 541 Ca 0.20 0.41 0.18 0.00 0.12 0.00 0.00 56.93 57.85 3m07 s PHE 541 Cb -0.14 -1.96 1.14 0.00 -0.57 0.00 0.00 43.02 41.49 3m07 s PHE 541 CO -0.07 0.06 1.92 -1.35 -0.10 0.00 0.00 175.22 175.68 3m07 h PRO 542 N 0.67 0.31 -0.01 0.24 0.11 -1.88 -2.07 132.00 129.37 3m07 h PRO 542 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3m07 h PRO 542 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3m07 h PRO 542 CO 0.61 0.21 -0.10 0.41 -0.21 0.00 0.00 178.00 178.92 3m07 n GLY 543 N -1.55 -0.17 0.00 -0.55 0.00 -1.26 -5.02 105.19 96.64 3m07 n GLY 543 Ca 0.14 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3m07 n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m07 n GLY 544 N 1.25 2.74 3.34 -0.02 0.00 -0.78 -4.78 105.19 106.94 3m07 n GLY 544 Ca 0.16 -1.09 -0.37 0.00 0.00 0.00 0.00 46.02 44.71 3m07 n GLY 544 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m07 s THR 545 N -2.00 3.98 -0.14 2.61 2.01 0.18 -1.40 115.64 120.88 3m07 s THR 545 Ca 0.00 -0.75 -0.12 0.00 0.31 0.00 0.00 61.69 61.13 3m07 s THR 545 Cb 0.00 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 69.38 3m07 s THR 545 CO 0.00 0.03 0.25 -0.22 -0.69 0.00 0.00 174.62 173.99 3m07 s LEU 546 N 1.49 4.30 0.03 4.42 2.96 -0.11 -0.83 118.68 130.94 3m07 s LEU 546 Ca 0.02 0.52 0.04 0.00 -0.22 0.00 0.00 54.13 54.48 3m07 s LEU 546 Cb -0.18 -2.29 -0.02 0.00 0.50 0.00 0.00 46.19 44.21 3m07 s LEU 546 CO 0.03 0.21 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.71 3m07 s SER 547 N -0.10 1.35 -0.01 3.68 0.01 0.18 0.08 113.70 118.88 3m07 s SER 547 Ca 0.16 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.03 3m07 s SER 547 Cb -0.13 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.03 3m07 s SER 547 CO 0.04 0.02 0.01 -0.22 0.41 0.00 0.00 173.24 173.50 3m07 s LEU 548 N -0.94 1.44 -0.01 2.44 0.20 -0.03 -0.84 118.68 120.94 3m07 s LEU 548 Ca 0.00 0.00 0.02 0.00 0.69 0.00 0.00 54.13 54.85 3m07 s LEU 548 Cb -0.07 -0.10 -0.00 0.00 -0.43 0.00 0.00 46.19 45.59 3m07 s LEU 548 CO 0.01 -0.07 -0.07 0.00 -0.29 0.00 0.00 176.35 175.93 3m07 s ALA 549 N 0.65 0.59 -0.03 5.97 0.00 -0.25 -0.68 121.76 128.02 3m07 s ALA 549 Ca -0.06 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.65 3m07 s ALA 549 Cb -0.08 -0.18 0.01 0.00 0.00 0.00 0.00 23.12 22.86 3m07 s ALA 549 CO -0.02 0.12 -0.06 -1.17 0.00 0.00 0.00 175.76 174.64 3m07 s LEU 550 N -0.02 1.62 -0.21 0.00 2.96 -0.15 -1.25 118.68 121.64 3m07 s LEU 550 Ca 0.01 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 53.78 3m07 s LEU 550 Cb -0.04 -0.41 0.06 0.00 0.50 0.00 0.00 46.19 46.29 3m07 s LEU 550 CO -0.00 0.01 -0.01 0.21 -1.32 0.00 0.00 176.35 175.24 3m07 s ASN 551 N 0.45 3.34 0.00 3.68 2.47 -0.25 -1.50 114.94 123.13 3m07 s ASN 551 Ca -0.06 -0.98 0.18 0.00 0.42 0.00 0.00 52.86 52.43 3m07 s ASN 551 Cb -0.10 -0.87 0.38 0.00 -1.45 0.00 0.00 41.25 39.21 3m07 s ASN 551 CO 0.00 -0.27 1.30 2.30 -3.72 0.00 0.00 177.10 176.71 3m07 n ILE 552 N 4.87 0.61 -1.38 -5.21 -5.35 0.50 -1.34 119.36 112.07 3m07 n ILE 552 Ca -0.10 -0.81 -0.29 0.00 -0.27 0.00 0.00 62.75 61.28 3m07 n ILE 552 Cb 0.46 0.84 0.15 0.00 -1.74 0.00 0.00 39.64 39.35 3m07 n ILE 552 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3m07 s SER 553 N -1.22 3.16 0.00 7.28 1.04 -1.24 -4.57 113.70 118.15 3m07 s SER 553 Ca 0.33 1.08 0.31 0.00 0.48 0.00 0.00 55.95 58.14 3m07 s SER 553 Cb 0.19 -1.70 1.62 0.00 0.10 0.00 0.00 66.02 66.23 3m07 s SER 553 CO 0.26 -2.78 2.07 0.00 0.98 0.00 0.00 173.24 173.76 3m07 n ALA 554 N -3.93 2.66 -2.32 5.32 0.00 -1.26 -3.24 120.51 117.74 3m07 n ALA 554 Ca 0.06 -0.26 -0.13 0.00 0.00 0.00 0.00 53.44 53.11 3m07 n ALA 554 Cb 0.58 -1.41 -0.10 0.00 0.00 0.00 0.00 19.45 18.52 3m07 n ALA 554 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3m07 s THR 555 N -2.06 0.90 0.47 0.00 -4.23 -1.26 -4.79 115.64 104.66 3m07 s THR 555 Ca 0.43 -1.84 -0.24 0.00 -1.18 0.00 0.00 61.69 58.86 3m07 s THR 555 Cb 0.22 -1.58 -0.07 0.00 1.34 0.00 0.00 72.50 72.40 3m07 s THR 555 CO 0.37 -0.72 1.36 -0.89 -0.54 0.00 0.00 174.62 174.20 3m07 s THR 556 N -3.08 2.27 0.10 3.99 2.01 -1.26 -4.11 115.64 115.56 3m07 s THR 556 Ca 0.10 0.23 0.09 0.00 0.31 0.00 0.00 61.69 62.42 3m07 s THR 556 Cb 0.01 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 3m07 s THR 556 CO -0.02 0.02 -0.24 0.68 -0.69 0.00 0.00 174.62 174.37 3m07 s VAL 557 N -1.27 2.00 0.30 3.82 -7.23 -0.47 -4.97 120.40 112.57 3m07 s VAL 557 Ca 0.63 -1.56 -0.28 0.00 -1.81 0.00 0.00 61.98 58.96 3m07 s VAL 557 Cb -0.40 -1.77 -0.09 0.00 0.56 0.00 0.00 36.38 34.67 3m07 s VAL 557 CO 0.50 0.10 0.96 -0.76 -0.31 0.00 0.00 175.10 175.60 3m07 s LEU 558 N -1.77 4.45 0.14 1.32 1.43 -1.26 -0.53 118.68 122.46 3m07 s LEU 558 Ca 0.11 1.92 0.04 0.00 -1.03 0.00 0.00 54.13 55.16 3m07 s LEU 558 Cb -0.10 -3.86 -0.04 0.00 0.03 0.00 0.00 46.19 42.23 3m07 s LEU 558 CO 0.04 -0.02 0.15 -0.76 0.23 0.00 0.00 176.35 176.00 3m07 s LEU 559 N -1.74 3.91 0.79 1.79 1.43 -0.45 -4.90 118.68 119.52 3m07 s LEU 559 Ca 0.47 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.42 3m07 s LEU 559 Cb -0.22 -2.52 0.07 0.00 0.03 0.00 0.00 46.19 43.54 3m07 s LEU 559 CO 0.28 0.09 1.09 -2.16 0.23 0.00 0.00 176.35 175.88 3m07 s PRO 560 N -2.97 2.09 -0.85 1.29 0.04 -1.26 -4.86 135.00 128.49 3m07 s PRO 560 Ca 0.31 1.01 -0.24 0.00 0.04 0.00 0.00 61.00 62.11 3m07 s PRO 560 Cb -0.11 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 32.59 3m07 s PRO 560 CO 0.24 -1.71 1.29 -0.51 0.04 0.00 0.00 177.00 176.35 3m07 s ASP 561 N -3.50 6.32 -0.06 6.66 -0.00 -1.26 -4.98 116.67 119.86 3m07 s ASP 561 Ca 0.61 -1.00 -0.29 0.00 -0.00 0.00 0.00 52.55 51.88 3m07 s ASP 561 Cb -0.17 -2.54 -0.02 0.00 -0.00 0.00 0.00 42.92 40.20 3m07 s ASP 561 CO 0.56 -1.61 0.95 -0.76 -0.00 0.00 0.00 175.17 174.30 3m07 s LEU 562 N 5.04 4.31 0.50 1.23 1.43 -1.26 -5.04 118.68 124.88 3m07 s LEU 562 Ca 0.37 1.52 -0.10 0.00 -1.03 0.00 0.00 54.13 54.90 3m07 s LEU 562 Cb -0.06 -3.48 -0.05 0.00 0.03 0.00 0.00 46.19 42.63 3m07 s LEU 562 CO 0.03 -0.32 0.88 -2.16 0.23 0.00 0.00 176.35 175.01 3m07 s PRO 563 N 1.43 3.68 0.31 1.29 0.04 -1.26 -4.99 135.00 135.50 3m07 s PRO 563 Ca 0.48 0.53 0.00 0.00 0.04 0.00 0.00 61.00 62.05 3m07 s PRO 563 Cb -0.19 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.08 3m07 s PRO 563 CO 0.22 -0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.41 3m07 n GLY 564 N -2.02 -2.15 3.86 0.56 0.00 -1.26 -3.81 105.19 100.36 3m07 n GLY 564 Ca 0.03 -1.84 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 3m07 n GLY 564 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m07 s LYS 565 N -0.18 3.91 0.14 1.61 -2.85 -0.63 -4.69 119.74 117.05 3m07 s LYS 565 Ca 0.00 0.56 -0.30 0.00 -1.00 0.00 0.00 55.97 55.23 3m07 s LYS 565 Cb 0.00 -2.44 -0.07 0.00 -2.06 0.00 0.00 37.83 33.26 3m07 s LYS 565 CO 0.00 0.11 1.22 0.99 0.10 0.00 0.00 175.35 177.78 3m07 s THR 566 N -2.09 3.66 -0.20 3.79 2.01 -1.26 -1.16 115.64 120.39 3m07 s THR 566 Ca 0.52 1.31 0.05 0.00 0.31 0.00 0.00 61.69 63.88 3m07 s THR 566 Cb -0.10 -3.84 -0.21 0.00 0.01 0.00 0.00 72.50 68.36 3m07 s THR 566 CO 0.22 0.17 0.02 0.18 -0.69 0.00 0.00 174.62 174.51 3m07 n LEU 567 N 3.08 2.03 -3.64 4.42 4.77 0.94 -4.92 117.00 123.69 3m07 n LEU 567 Ca 0.07 -0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 3m07 n LEU 567 Cb 0.45 -0.52 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 3m07 n LEU 567 CO 0.56 0.77 0.38 0.12 -1.33 0.00 0.00 177.39 177.89 3m07 s PHE 568 N -2.53 -0.95 -0.03 -1.77 5.36 -1.07 -5.01 117.98 111.99 3m07 s PHE 568 Ca -0.24 2.04 -0.01 0.00 -0.96 0.00 0.00 56.93 57.76 3m07 s PHE 568 Cb 0.08 0.48 0.03 0.00 -0.34 0.00 0.00 43.02 43.27 3m07 s PHE 568 CO 0.70 -0.47 0.05 0.00 -1.46 0.00 0.00 175.22 174.05 3m07 s ALA 569 N 1.11 0.12 -0.10 11.12 0.00 -1.26 -0.71 121.76 132.03 3m07 s ALA 569 Ca -0.06 0.29 -0.07 0.00 0.00 0.00 0.00 51.96 52.12 3m07 s ALA 569 Cb -0.05 -0.42 0.04 0.00 0.00 0.00 0.00 23.12 22.68 3m07 s ALA 569 CO -0.11 -0.28 0.26 -0.46 0.00 0.00 0.00 175.76 175.16 3m07 s TRP 570 N 1.56 -0.32 0.10 0.00 -0.00 -0.54 -4.25 118.94 115.48 3m07 s TRP 570 Ca -0.03 0.77 0.15 0.00 -0.00 0.00 0.00 56.10 56.99 3m07 s TRP 570 Cb -0.13 0.08 0.38 0.00 -0.00 0.00 0.00 33.47 33.80 3m07 s TRP 570 CO -0.03 -0.20 1.59 -1.35 -0.00 0.00 0.00 176.95 176.96 3m07 h PRO 571 N 6.64 0.00 -4.83 5.86 0.11 -1.85 -0.44 132.00 137.49 3m07 h PRO 571 Ca -0.35 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.45 3m07 h PRO 571 Cb 1.17 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 3m07 h PRO 571 CO 0.36 0.52 -0.63 -0.80 -0.21 0.00 0.00 178.00 177.23 3m07 s ASN 572 N -6.53 1.12 -0.11 -2.05 0.01 -1.26 -5.15 114.94 100.97 3m07 s ASN 572 Ca 0.01 -1.30 -0.03 0.00 -0.71 0.00 0.00 52.86 50.83 3m07 s ASN 572 Cb 0.10 0.16 -0.03 0.00 0.41 0.00 0.00 41.25 41.89 3m07 s ASN 572 CO 0.73 -0.68 -0.00 -0.70 -1.51 0.00 0.00 177.10 174.94 3m07 s GLU 573 N -4.00 3.26 0.11 -0.60 2.12 -1.26 -4.85 118.70 113.48 3m07 s GLU 573 Ca 0.32 -0.44 0.09 0.00 0.36 0.00 0.00 54.97 55.31 3m07 s GLU 573 Cb 0.07 -2.86 -0.04 0.00 0.26 0.00 0.00 34.13 31.56 3m07 s GLU 573 CO 0.10 0.53 -0.24 -1.12 -0.54 0.00 0.00 175.26 174.00 3m07 s SER 574 N -0.42 2.88 -0.22 -1.70 0.01 -1.26 -5.12 113.70 107.87 3m07 s SER 574 Ca 0.08 -0.71 -0.20 0.00 1.31 0.00 0.00 55.95 56.42 3m07 s SER 574 Cb -0.12 -0.18 -0.02 0.00 0.21 0.00 0.00 66.02 65.91 3m07 s SER 574 CO 0.02 0.11 0.62 -0.89 0.41 0.00 0.00 173.24 173.51 3m07 s THR 575 N -1.11 5.01 0.00 1.44 2.01 -1.26 -4.07 115.64 117.67 3m07 s THR 575 Ca 0.10 1.14 0.00 0.00 0.31 0.00 0.00 61.69 63.24 3m07 s THR 575 Cb -0.10 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.48 3m07 s THR 575 CO 0.05 0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.67 3m07 n GLY 576 N 3.96 0.43 3.42 4.40 0.00 -1.26 -4.96 105.19 111.17 3m07 n GLY 576 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3m07 n GLY 576 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3m07 s SER 577 N -2.22 0.01 -0.09 1.61 1.04 -1.26 -1.34 113.70 111.45 3m07 s SER 577 Ca 0.00 -1.00 -0.02 0.00 0.48 0.00 0.00 55.95 55.41 3m07 s SER 577 Cb 0.00 0.49 0.04 0.00 0.10 0.00 0.00 66.02 66.64 3m07 s SER 577 CO 0.00 -0.99 0.03 -0.22 0.98 0.00 0.00 173.24 173.04 3m07 s LEU 578 N -3.03 0.53 0.97 2.42 2.96 0.31 -4.29 118.68 118.56 3m07 s LEU 578 Ca 0.24 -0.19 -0.12 0.00 -0.22 0.00 0.00 54.13 53.84 3m07 s LEU 578 Cb 0.02 -0.37 0.17 0.00 0.50 0.00 0.00 46.19 46.52 3m07 s LEU 578 CO 0.06 -0.24 1.09 -0.44 -1.32 0.00 0.00 176.35 175.50 3m07 s SER 579 N 2.02 2.81 0.40 3.68 0.01 -1.26 -1.36 113.70 120.00 3m07 s SER 579 Ca 0.04 1.39 -0.25 0.00 1.31 0.00 0.00 55.95 58.44 3m07 s SER 579 Cb -0.13 -2.07 -0.11 0.00 0.21 0.00 0.00 66.02 63.92 3m07 s SER 579 CO -0.05 -3.04 1.06 0.00 0.41 0.00 0.00 173.24 171.61 3m07 n GLN 580 N -4.14 1.46 -3.66 12.44 0.00 -1.26 -3.07 117.38 119.16 3m07 n GLN 580 Ca 0.06 0.52 -0.22 0.00 0.00 0.00 0.00 57.00 57.36 3m07 n GLN 580 Cb 0.56 -2.08 0.05 0.00 0.00 0.00 0.00 30.24 28.76 3m07 n GLN 580 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3m07 n HIS 581 N -0.35 -2.15 -4.21 2.61 8.25 -0.51 -4.94 115.22 113.93 3m07 n HIS 581 Ca 0.09 0.89 -0.12 0.00 -0.26 0.00 0.00 57.72 58.32 3m07 n HIS 581 Cb 0.38 -4.56 -0.10 0.00 1.12 0.00 0.00 29.99 26.83 3m07 n HIS 581 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3m07 s SER 582 N -4.08 1.11 0.02 0.41 0.01 -0.45 -4.51 113.70 106.20 3m07 s SER 582 Ca 0.17 -1.12 -0.01 0.00 1.31 0.00 0.00 55.95 56.30 3m07 s SER 582 Cb -0.08 0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.26 3m07 s SER 582 CO 0.79 -0.55 -0.00 -0.22 0.41 0.00 0.00 173.24 173.67 3m07 s LEU 583 N -3.12 2.14 -0.01 2.44 2.96 -0.17 -1.09 118.68 121.83 3m07 s LEU 583 Ca 0.20 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.64 3m07 s LEU 583 Cb 0.06 0.19 0.01 0.00 0.50 0.00 0.00 46.19 46.95 3m07 s LEU 583 CO 0.01 -0.32 0.01 -0.51 -1.32 0.00 0.00 176.35 174.22 3m07 s ILE 584 N -1.49 0.01 -0.08 6.68 1.10 -0.38 -1.47 121.20 125.57 3m07 s ILE 584 Ca -0.15 0.06 0.02 0.00 -0.51 0.00 0.00 60.65 60.07 3m07 s ILE 584 Cb -0.09 -0.06 0.02 0.00 0.15 0.00 0.00 42.46 42.47 3m07 s ILE 584 CO -0.01 0.04 -0.12 -0.69 -2.11 0.00 0.00 174.94 172.06 3m07 s VAL 585 N 0.39 1.15 0.16 4.00 1.01 0.11 -1.09 120.40 126.12 3m07 s VAL 585 Ca -0.03 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.56 3m07 s VAL 585 Cb -0.05 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3m07 s VAL 585 CO -0.01 0.37 -0.16 -0.13 0.00 0.00 0.00 175.10 175.17 3m07 s ARG 586 N 0.88 1.20 -0.04 2.72 0.52 -0.02 -0.04 118.95 124.18 3m07 s ARG 586 Ca -0.10 -1.40 -0.02 0.00 -0.52 0.00 0.00 55.73 53.69 3m07 s ARG 586 Cb -0.15 -1.13 0.03 0.00 0.52 0.00 0.00 34.95 34.22 3m07 s ARG 586 CO 0.01 0.21 0.07 -1.17 0.02 0.00 0.00 175.30 174.44 3m07 s LEU 587 N -2.78 0.36 -0.27 2.53 2.96 -0.31 -0.65 118.68 120.53 3m07 s LEU 587 Ca 0.15 0.11 -0.08 0.00 -0.22 0.00 0.00 54.13 54.09 3m07 s LEU 587 Cb -0.04 -0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.57 3m07 s LEU 587 CO 0.05 -0.22 0.10 0.00 -1.32 0.00 0.00 176.35 174.96 3m07 s ALA 588 N 1.88 3.20 0.00 5.97 0.00 -0.01 -1.60 121.76 131.21 3m07 s ALA 588 Ca 0.01 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.77 3m07 s ALA 588 Cb -0.12 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.82 3m07 s ALA 588 CO -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 175.76 175.12