#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oja s LYS 4 N 0.00 3.69 0.37 1.20 1.02 -1.26 0.02 119.74 124.79 1oja s LYS 4 Ca 0.00 -0.16 -0.10 0.00 0.02 0.00 0.00 55.97 55.73 1oja s LYS 4 Cb 0.00 -3.27 0.04 0.00 -0.52 0.00 0.00 37.83 34.08 1oja s LYS 4 CO 0.00 0.62 0.66 0.00 -0.92 0.00 0.00 175.35 175.71 1oja h ASP 6 N 1.94 0.18 -3.55 0.00 3.32 -1.18 -3.29 116.42 113.83 1oja h ASP 6 Ca -0.30 -0.92 -0.32 0.00 0.02 0.00 0.00 57.03 55.50 1oja h ASP 6 Cb 1.19 -0.06 -0.33 0.00 0.22 0.00 0.00 39.33 40.35 1oja h ASP 6 CO 0.40 1.23 -0.74 -0.69 -1.72 0.00 0.00 179.24 177.71 1oja s VAL 7 N -2.32 0.13 -0.21 -1.35 1.01 -0.99 -0.89 120.40 115.79 1oja s VAL 7 Ca -0.18 0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.77 1oja s VAL 7 Cb -0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 36.11 1oja s VAL 7 CO 0.73 0.12 0.16 -0.69 0.00 0.00 0.00 175.10 175.42 1oja s VAL 8 N 0.85 5.38 -0.22 2.92 1.01 -0.88 -1.73 120.40 127.72 1oja s VAL 8 Ca -0.08 0.24 -0.07 0.00 0.00 0.00 0.00 61.98 62.07 1oja s VAL 8 Cb -0.11 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1oja s VAL 8 CO -0.02 0.40 0.06 -0.69 0.00 0.00 0.00 175.10 174.85 1oja s VAL 9 N 0.61 4.41 -0.35 2.92 1.01 0.48 -0.95 120.40 128.53 1oja s VAL 9 Ca 0.09 -0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.75 1oja s VAL 9 Cb -0.12 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.22 1oja s VAL 9 CO 0.01 0.38 0.46 -0.69 0.00 0.00 0.00 175.10 175.26 1oja s VAL 10 N 1.19 5.07 0.00 2.92 1.01 0.75 -0.69 120.40 130.66 1oja s VAL 10 Ca 0.04 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1oja s VAL 10 Cb -0.14 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1oja s VAL 10 CO 0.03 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1oja n GLY 11 N 4.86 2.00 2.15 4.51 0.00 0.16 -0.52 105.19 118.34 1oja n GLY 11 Ca -0.06 -1.31 -0.28 0.00 0.00 0.00 0.00 46.02 44.37 1oja n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 12 N 2.44 6.21 0.91 -0.02 0.00 -1.26 -4.03 105.19 109.44 1oja n GLY 12 Ca 0.00 -2.55 -0.07 0.00 0.00 0.00 0.00 46.02 43.40 1oja n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 13 N -0.77 -1.63 0.37 -0.02 0.00 -1.26 -1.21 105.19 100.67 1oja n GLY 13 Ca 0.50 -1.61 0.02 0.00 0.00 0.00 0.00 46.02 44.93 1oja n GLY 13 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1oja h ILE 14 N -1.38 1.14 -0.04 -0.61 2.04 -1.94 -0.41 117.51 116.30 1oja h ILE 14 Ca -0.10 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1oja h ILE 14 Cb 0.29 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1oja h ILE 14 CO 0.07 0.21 0.01 -1.28 0.00 0.00 0.00 178.15 177.17 1oja h SER 15 N 1.15 0.06 -0.42 1.72 0.87 -1.90 0.11 113.55 115.14 1oja h SER 15 Ca 0.38 -0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 1oja h SER 15 Cb 0.05 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1oja h SER 15 CO -0.12 0.24 0.19 1.23 -0.53 0.00 0.00 176.83 177.85 1oja h GLY 16 N -0.12 0.65 1.00 5.77 0.00 -1.64 -0.74 103.07 107.98 1oja h GLY 16 Ca 0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1oja h GLY 16 CO -0.00 0.31 0.36 -0.33 0.00 0.00 0.00 176.54 176.89 1oja h MET 17 N 0.53 0.86 -0.55 4.80 2.07 -0.99 0.12 114.93 121.78 1oja h MET 17 Ca 0.14 -0.09 -0.05 0.00 -2.07 0.00 0.00 59.70 57.63 1oja h MET 17 Cb 0.14 -0.18 -0.02 0.00 -1.87 0.00 0.00 31.60 29.67 1oja h MET 17 CO -0.02 0.64 0.14 0.00 1.07 0.00 0.00 176.91 178.74 1oja h ALA 18 N 1.18 0.72 -0.08 6.32 0.00 -0.54 0.11 119.26 126.98 1oja h ALA 18 Ca 0.22 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1oja h ALA 18 Cb 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1oja h ALA 18 CO -0.04 0.42 0.05 0.00 0.00 0.00 0.00 179.25 179.67 1oja h ALA 19 N 1.02 0.10 -0.72 0.00 0.00 -0.92 -1.92 119.26 116.82 1oja h ALA 19 Ca 0.17 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1oja h ALA 19 Cb 0.33 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1oja h ALA 19 CO 0.00 -0.39 0.27 0.00 0.00 0.00 0.00 179.25 179.13 1oja h ALA 20 N 1.00 0.93 -0.45 0.00 0.00 -0.51 -1.57 119.26 118.66 1oja h ALA 20 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1oja h ALA 20 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1oja h ALA 20 CO -0.01 0.57 0.25 -0.22 0.00 0.00 0.00 179.25 179.84 1oja h LYS 21 N 1.03 0.62 -0.48 0.00 3.64 -0.71 0.73 116.57 121.40 1oja h LYS 21 Ca 0.24 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1oja h LYS 21 Cb 0.24 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1oja h LYS 21 CO -0.02 0.49 0.27 1.25 -2.27 0.00 0.00 179.45 179.17 1oja h LEU 22 N 0.59 0.60 -0.40 5.20 6.46 -0.96 0.59 115.31 127.38 1oja h LEU 22 Ca 0.16 -0.08 -0.07 0.00 -0.12 0.00 0.00 57.88 57.77 1oja h LEU 22 Cb 0.05 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1oja h LEU 22 CO -0.03 0.51 -0.01 -0.07 -0.62 0.00 0.00 178.44 178.23 1oja h LEU 23 N 0.64 0.71 -0.58 2.25 3.38 -1.14 -1.75 115.31 118.82 1oja h LEU 23 Ca 0.17 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1oja h LEU 23 Cb 0.04 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1oja h LEU 23 CO -0.03 0.85 0.38 -0.74 0.09 0.00 0.00 178.44 178.99 1oja h HIS 24 N 0.55 0.72 0.00 1.13 2.76 -0.64 -1.58 115.15 118.08 1oja h HIS 24 Ca 0.11 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.26 1oja h HIS 24 Cb 0.49 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 1oja h HIS 24 CO 0.04 0.44 -0.19 -0.44 -1.30 0.00 0.00 177.93 176.48 1oja h ASP 25 N 0.77 0.00 0.15 3.26 3.32 -0.70 -1.24 116.42 121.98 1oja h ASP 25 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1oja h ASP 25 Cb -0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1oja h ASP 25 CO -0.06 0.19 -0.07 -1.54 -1.72 0.00 0.00 179.24 176.05 1oja n SER 26 N -3.82 0.77 0.00 6.45 3.41 -0.67 -4.92 113.62 114.83 1oja n SER 26 Ca -0.02 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 1oja n SER 26 Cb 0.29 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1oja n SER 26 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oja n GLY 27 N 1.19 0.84 3.87 5.00 0.00 -0.47 -5.07 105.19 110.55 1oja n GLY 27 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1oja n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oja s LEU 28 N 0.00 3.87 -0.37 0.99 1.43 -0.64 -5.01 118.68 118.95 1oja s LEU 28 Ca 0.00 1.13 -0.23 0.00 -1.03 0.00 0.00 54.13 54.00 1oja s LEU 28 Cb 0.00 -4.00 0.01 0.00 0.03 0.00 0.00 46.19 42.23 1oja s LEU 28 CO 0.00 -0.36 0.80 0.20 0.23 0.00 0.00 176.35 177.21 1oja s ASN 29 N -3.03 6.55 0.12 2.29 0.01 -1.26 -4.15 114.94 115.48 1oja s ASN 29 Ca 0.51 0.34 0.09 0.00 -0.71 0.00 0.00 52.86 53.10 1oja s ASN 29 Cb -0.10 -2.40 -0.04 0.00 0.41 0.00 0.00 41.25 39.12 1oja s ASN 29 CO 0.29 -0.76 -0.20 0.68 -1.51 0.00 0.00 177.10 175.61 1oja s VAL 30 N 3.15 2.72 -0.02 1.60 -7.23 -1.26 -0.68 120.40 118.67 1oja s VAL 30 Ca 0.32 -1.56 0.04 0.00 -1.81 0.00 0.00 61.98 58.97 1oja s VAL 30 Cb -0.13 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 1oja s VAL 30 CO 0.17 0.10 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.25 1oja s VAL 31 N -1.12 1.02 -0.21 1.32 1.01 -0.70 -4.81 120.40 116.90 1oja s VAL 31 Ca 0.17 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.58 1oja s VAL 31 Cb -0.10 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1oja s VAL 31 CO 0.09 0.30 -0.01 -0.69 0.00 0.00 0.00 175.10 174.78 1oja s VAL 32 N -0.11 3.75 -0.32 2.92 1.01 -0.13 -0.38 120.40 127.12 1oja s VAL 32 Ca 0.01 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.53 1oja s VAL 32 Cb -0.07 -2.70 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1oja s VAL 32 CO 0.00 0.42 0.14 -0.76 0.00 0.00 0.00 175.10 174.91 1oja s LEU 33 N 1.20 4.19 -0.15 3.92 1.43 0.14 -0.70 118.68 128.72 1oja s LEU 33 Ca 0.03 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 1oja s LEU 33 Cb -0.15 -1.97 -0.00 0.00 0.03 0.00 0.00 46.19 44.10 1oja s LEU 33 CO 0.00 -0.25 -0.16 -0.70 0.23 0.00 0.00 176.35 175.48 1oja s GLU 34 N 1.56 3.23 0.18 1.70 2.56 -0.52 -0.67 118.70 126.74 1oja s GLU 34 Ca 0.03 -0.75 -0.10 0.00 0.00 0.00 0.00 54.97 54.16 1oja s GLU 34 Cb -0.18 -2.60 0.08 0.00 2.00 0.00 0.00 34.13 33.44 1oja s GLU 34 CO 0.05 0.06 1.68 0.00 -0.56 0.00 0.00 175.26 176.50 1oja h ALA 35 N 7.15 0.85 -2.28 6.30 0.00 -1.85 0.13 119.26 129.56 1oja h ALA 35 Ca -0.30 -0.26 -0.46 0.00 0.00 0.00 0.00 54.91 53.89 1oja h ALA 35 Cb 1.20 -0.24 0.12 0.00 0.00 0.00 0.00 17.79 18.86 1oja h ALA 35 CO 0.56 0.59 0.37 1.03 0.00 0.00 0.00 179.25 181.80 1oja s ARG 36 N -5.24 1.51 -0.03 0.00 0.52 -1.26 -3.68 118.95 110.76 1oja s ARG 36 Ca -0.12 -0.21 0.05 0.00 -0.52 0.00 0.00 55.73 54.92 1oja s ARG 36 Cb 0.14 -1.97 0.20 0.00 0.52 0.00 0.00 34.95 33.84 1oja s ARG 36 CO 0.84 -1.83 0.98 -0.40 0.02 0.00 0.00 175.30 174.92 1oja n ASP 37 N -3.39 1.72 -3.87 0.23 5.75 -1.26 -0.50 116.55 115.24 1oja n ASP 37 Ca 0.11 -2.13 -0.09 0.00 -0.01 0.00 0.00 54.79 52.66 1oja n ASP 37 Cb 0.60 -0.36 -0.07 0.00 -1.03 0.00 0.00 41.12 40.27 1oja n ASP 37 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oja s ARG 38 N -1.60 1.05 0.58 0.11 1.70 -1.26 -4.94 118.95 114.59 1oja s ARG 38 Ca 0.14 -1.02 0.03 0.00 -0.47 0.00 0.00 55.73 54.41 1oja s ARG 38 Cb 0.09 0.39 0.06 0.00 -0.57 0.00 0.00 34.95 34.92 1oja s ARG 38 CO 0.07 -0.38 0.81 0.14 -1.08 0.00 0.00 175.30 174.86 1oja s VAL 39 N -3.90 2.49 0.00 4.99 -7.23 -1.26 -4.74 120.40 110.75 1oja s VAL 39 Ca 0.10 -0.75 0.00 0.00 -1.81 0.00 0.00 61.98 59.53 1oja s VAL 39 Cb 0.03 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.23 1oja s VAL 39 CO -0.06 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 1oja n GLY 40 N -2.39 1.76 7.00 2.32 0.00 -0.35 -4.91 105.19 108.62 1oja n GLY 40 Ca 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1oja n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 41 N 0.00 2.75 0.00 -0.02 0.00 -1.26 -0.80 105.19 105.86 1oja n GLY 41 Ca 0.00 0.21 0.15 0.00 0.00 0.00 0.00 46.02 46.38 1oja n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oja n ARG 42 N 6.86 0.87 -4.08 1.61 1.74 -1.26 -4.53 116.66 117.87 1oja n ARG 42 Ca 0.00 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 1oja n ARG 42 Cb 0.00 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.87 1oja n ARG 42 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1oja s THR 43 N -2.11 4.98 -0.28 0.55 -4.23 0.02 -1.15 115.64 113.43 1oja s THR 43 Ca 0.43 -0.10 -0.07 0.00 -1.18 0.00 0.00 61.69 60.77 1oja s THR 43 Cb 0.21 -3.19 0.14 0.00 1.34 0.00 0.00 72.50 71.00 1oja s THR 43 CO 0.38 0.52 0.57 -0.47 -0.54 0.00 0.00 174.62 175.08 1oja s TYR 44 N -1.06 -1.28 -0.26 3.99 5.04 -1.26 -4.51 117.35 118.02 1oja s TYR 44 Ca 0.18 1.91 -0.07 0.00 -2.44 0.00 0.00 57.07 56.65 1oja s TYR 44 Cb -0.12 0.59 -0.01 0.00 0.35 0.00 0.00 41.96 42.77 1oja s TYR 44 CO 0.07 -0.69 0.06 0.99 -1.34 0.00 0.00 175.55 174.63 1oja s THR 45 N 2.81 4.05 -0.08 4.34 2.01 -1.26 -0.67 115.64 126.84 1oja s THR 45 Ca 0.03 -0.39 -0.15 0.00 0.31 0.00 0.00 61.69 61.49 1oja s THR 45 Cb -0.13 -2.95 -0.05 0.00 0.01 0.00 0.00 72.50 69.38 1oja s THR 45 CO -0.18 0.27 0.39 -0.22 -0.69 0.00 0.00 174.62 174.19 1oja s LEU 46 N 1.56 4.36 -0.10 4.42 2.96 -0.08 -4.88 118.68 126.92 1oja s LEU 46 Ca 0.05 0.79 0.02 0.00 -0.22 0.00 0.00 54.13 54.77 1oja s LEU 46 Cb -0.16 -2.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.98 1oja s LEU 46 CO 0.02 0.18 -0.16 -0.13 -1.32 0.00 0.00 176.35 174.94 1oja s ARG 47 N -0.20 3.05 0.30 1.98 3.00 -1.26 -0.52 118.95 125.29 1oja s ARG 47 Ca 0.22 -0.74 -0.20 0.00 0.00 0.00 0.00 55.73 55.01 1oja s ARG 47 Cb -0.15 -2.47 0.03 0.00 0.00 0.00 0.00 34.95 32.35 1oja s ARG 47 CO 0.10 0.31 0.73 0.54 0.00 0.00 0.00 175.30 176.98 1oja s ASN 48 N 0.06 -0.21 0.37 0.23 2.20 -1.09 -5.00 114.94 111.50 1oja s ASN 48 Ca -0.07 -0.70 0.13 0.00 -0.94 0.00 0.00 52.86 51.28 1oja s ASN 48 Cb -0.15 0.75 0.70 0.00 -2.00 0.00 0.00 41.25 40.55 1oja s ASN 48 CO 0.05 -1.40 1.81 -0.61 -2.94 0.00 0.00 177.10 174.01 1oja h GLN 49 N 2.00 0.00 -0.08 3.55 4.15 -2.00 0.16 115.11 122.90 1oja h GLN 49 Ca -0.21 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.07 1oja h GLN 49 Cb 1.25 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.93 1oja h GLN 49 CO 0.26 0.39 -0.58 0.87 -1.93 0.00 0.00 178.83 177.83 1oja h LYS 50 N 0.00 0.25 0.00 1.69 1.79 -2.02 -3.30 116.57 114.98 1oja h LYS 50 Ca -0.00 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1oja h LYS 50 Cb 0.69 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 1oja h LYS 50 CO 0.05 0.76 -0.59 1.33 -1.08 0.00 0.00 179.45 179.91 1oja n VAL 51 N -3.89 0.00 0.00 0.50 0.24 -1.11 -4.97 118.33 109.10 1oja n VAL 51 Ca -0.02 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 1oja n VAL 51 Cb 0.60 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.81 1oja n VAL 51 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1oja n LYS 52 N -1.32 0.00 -3.85 7.34 4.81 0.55 -4.61 118.16 121.08 1oja n LYS 52 Ca 0.01 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.33 1oja n LYS 52 Cb 0.14 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.09 1oja n LYS 52 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 1oja s TYR 53 N 0.00 0.01 -0.13 5.64 -0.85 -1.26 -2.66 117.35 118.11 1oja s TYR 53 Ca 0.00 -0.10 -0.09 0.00 -0.52 0.00 0.00 57.07 56.36 1oja s TYR 53 Cb 0.00 -0.02 0.04 0.00 0.38 0.00 0.00 41.96 42.36 1oja s TYR 53 CO 0.00 -0.33 0.32 0.54 -1.52 0.00 0.00 175.55 174.56 1oja s VAL 54 N -1.62 -0.02 -0.38 -3.49 0.11 0.32 -4.97 120.40 110.36 1oja s VAL 54 Ca -0.13 0.07 -0.29 0.00 -2.93 0.00 0.00 61.98 58.70 1oja s VAL 54 Cb -0.06 -0.47 0.02 0.00 -1.53 0.00 0.00 36.38 34.34 1oja s VAL 54 CO 0.01 0.03 1.11 -1.81 -3.33 0.00 0.00 175.10 171.11 1oja s ASP 55 N 0.79 6.81 0.04 3.54 1.01 -1.26 -0.90 116.67 126.70 1oja s ASP 55 Ca -0.05 0.85 0.23 0.00 0.71 0.00 0.00 52.55 54.28 1oja s ASP 55 Cb -0.06 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.32 1oja s ASP 55 CO -0.05 -1.03 0.98 0.18 0.21 0.00 0.00 175.17 175.46 1oja n LEU 56 N 7.27 0.60 0.00 1.23 4.77 0.16 -4.92 117.00 126.11 1oja n LEU 56 Ca 0.12 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1oja n LEU 56 Cb 0.48 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1oja n LEU 56 CO 0.64 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1oja n GLY 57 N 1.37 3.76 3.69 -0.72 0.00 -1.19 -4.75 105.19 107.35 1oja n GLY 57 Ca 0.02 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 1oja n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 58 N 5.00 0.56 0.76 -0.02 0.00 -0.30 -4.83 105.19 106.36 1oja n GLY 58 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1oja n GLY 58 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1oja n SER 59 N 1.02 0.15 -4.82 1.61 2.88 -1.26 -4.66 113.62 108.54 1oja n SER 59 Ca 0.06 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.23 1oja n SER 59 Cb 0.35 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.75 1oja n SER 59 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1oja s TYR 60 N -1.43 3.73 0.19 0.66 1.51 -1.26 -4.18 117.35 116.57 1oja s TYR 60 Ca 0.00 1.23 0.04 0.00 -1.01 0.00 0.00 57.07 57.33 1oja s TYR 60 Cb 0.00 -2.48 -0.05 0.00 -0.11 0.00 0.00 41.96 39.32 1oja s TYR 60 CO 0.00 0.51 -0.05 0.14 -1.11 0.00 0.00 175.55 175.04 1oja s VAL 61 N -1.26 1.08 0.27 0.71 -7.23 -0.03 -4.88 120.40 109.05 1oja s VAL 61 Ca 0.33 -2.05 -0.18 0.00 -1.81 0.00 0.00 61.98 58.27 1oja s VAL 61 Cb -0.18 -2.11 0.07 0.00 0.56 0.00 0.00 36.38 34.71 1oja s VAL 61 CO 0.19 -0.52 0.92 0.61 -0.31 0.00 0.00 175.10 175.99 1oja n GLY 62 N -0.31 0.77 3.63 2.32 0.00 -1.25 -0.70 105.19 109.65 1oja n GLY 62 Ca -0.07 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 1oja n GLY 62 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oja n PRO 63 N -0.64 1.49 -0.42 1.61 -0.04 -1.25 -1.97 135.00 133.78 1oja n PRO 63 Ca -0.05 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 1oja n PRO 63 Cb 0.58 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.94 1oja n PRO 63 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1oja n THR 64 N -0.34 0.00 -2.60 0.52 -2.24 -1.26 -4.78 114.28 103.58 1oja n THR 64 Ca 0.09 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.44 1oja n THR 64 Cb 0.38 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.62 1oja n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oja n GLN 65 N -2.00 4.33 0.15 -0.78 6.02 -0.83 -4.80 117.38 119.46 1oja n GLN 65 Ca 0.00 -4.08 0.02 0.00 -0.01 0.00 0.00 57.00 52.94 1oja n GLN 65 Cb 0.00 -2.66 0.14 0.00 1.02 0.00 0.00 30.24 28.74 1oja n GLN 65 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1oja h ASN 66 N 5.27 0.00 -0.06 1.08 2.35 -1.89 -2.93 115.58 119.39 1oja h ASN 66 Ca 0.37 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.10 1oja h ASN 66 Cb 0.54 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 1oja h ASN 66 CO 1.44 0.52 -0.04 0.03 -1.65 0.00 0.00 177.43 177.72 1oja h ARG 67 N 0.00 0.14 -0.44 0.81 3.08 -1.90 -0.83 114.38 115.24 1oja h ARG 67 Ca -0.01 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1oja h ARG 67 Cb 1.22 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.25 1oja h ARG 67 CO 0.07 0.55 -0.04 0.97 -1.07 0.00 0.00 179.97 180.45 1oja h ILE 68 N -0.26 1.24 -0.62 2.04 6.09 -1.83 -0.50 117.51 123.67 1oja h ILE 68 Ca 0.01 -1.03 -0.05 0.00 -1.37 0.00 0.00 64.86 62.43 1oja h ILE 68 Cb 0.51 0.95 -0.03 0.00 0.47 0.00 0.00 36.82 38.72 1oja h ILE 68 CO 0.01 0.36 0.21 -0.07 -3.07 0.00 0.00 178.15 175.59 1oja h LEU 69 N 0.69 0.89 -0.19 2.19 3.38 -1.48 -0.08 115.31 120.70 1oja h LEU 69 Ca 0.13 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1oja h LEU 69 Cb 0.48 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1oja h LEU 69 CO 0.02 0.85 -0.08 -0.09 0.09 0.00 0.00 178.44 179.23 1oja h ARG 70 N 0.88 0.38 -0.16 1.13 1.12 -0.88 -1.05 114.38 115.81 1oja h ARG 70 Ca 0.20 -0.17 0.00 0.00 -1.11 0.00 0.00 59.98 58.91 1oja h ARG 70 Cb 0.27 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.21 1oja h ARG 70 CO -0.01 0.68 0.11 1.25 -3.11 0.00 0.00 179.97 178.89 1oja h LEU 71 N 0.08 0.18 -0.63 3.80 5.85 -0.99 -1.28 115.31 122.32 1oja h LEU 71 Ca 0.04 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1oja h LEU 71 Cb 0.56 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1oja h LEU 71 CO 0.03 0.13 0.27 0.00 -0.34 0.00 0.00 178.44 178.53 1oja h ALA 72 N 1.06 0.81 -0.59 1.25 0.00 -1.01 -2.07 119.26 118.71 1oja h ALA 72 Ca 0.06 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1oja h ALA 72 Cb -0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1oja h ALA 72 CO -0.01 0.41 0.38 -0.22 0.00 0.00 0.00 179.25 179.81 1oja h LYS 73 N 0.87 0.75 -0.33 0.00 3.64 -1.01 -0.91 116.57 119.58 1oja h LYS 73 Ca 0.21 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1oja h LYS 73 Cb 0.17 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1oja h LYS 73 CO -0.02 0.49 0.15 1.49 -2.27 0.00 0.00 179.45 179.30 1oja h GLU 74 N 0.77 0.45 -0.00 1.90 4.81 -0.89 -0.73 114.58 120.89 1oja h GLU 74 Ca 0.23 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1oja h GLU 74 Cb -0.05 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.24 1oja h GLU 74 CO -0.07 0.36 -0.01 1.28 -0.73 0.00 0.00 179.01 179.84 1oja n LEU 75 N -4.42 0.34 0.00 1.64 4.77 -0.80 -4.89 117.00 113.63 1oja n LEU 75 Ca 0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1oja n LEU 75 Cb 0.12 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1oja n LEU 75 CO 0.36 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1oja n GLY 76 N 1.08 0.81 3.90 -0.72 0.00 -0.28 -5.05 105.19 104.94 1oja n GLY 76 Ca 0.21 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1oja n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oja s LEU 77 N 0.00 3.94 0.18 0.99 1.43 -0.41 -5.01 118.68 119.80 1oja s LEU 77 Ca 0.00 0.84 0.07 0.00 -1.03 0.00 0.00 54.13 54.01 1oja s LEU 77 Cb 0.00 -3.69 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 1oja s LEU 77 CO 0.00 -0.31 -0.15 -1.61 0.23 0.00 0.00 176.35 174.52 1oja s GLU 78 N -3.84 1.24 0.36 1.70 2.02 -1.26 -4.26 118.70 114.66 1oja s GLU 78 Ca 0.46 -1.48 0.08 0.00 0.02 0.00 0.00 54.97 54.05 1oja s GLU 78 Cb -0.10 -1.07 -0.04 0.00 0.10 0.00 0.00 34.13 33.02 1oja s GLU 78 CO 0.33 0.19 0.22 0.95 0.02 0.00 0.00 175.26 176.96 1oja s THR 79 N -2.70 2.99 0.11 3.63 -4.23 -1.26 -0.62 115.64 113.56 1oja s THR 79 Ca 0.18 -1.57 -0.00 0.00 -1.18 0.00 0.00 61.69 59.12 1oja s THR 79 Cb -0.02 -3.03 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1oja s THR 79 CO 0.05 -0.13 0.01 -0.72 -0.54 0.00 0.00 174.62 173.29 1oja s TYR 80 N -2.43 0.83 0.01 3.99 -0.85 -0.41 -4.78 117.35 113.71 1oja s TYR 80 Ca 0.40 -1.11 -0.23 0.00 -0.52 0.00 0.00 57.07 55.61 1oja s TYR 80 Cb -0.03 -0.50 -0.05 0.00 0.38 0.00 0.00 41.96 41.76 1oja s TYR 80 CO 0.24 -0.38 0.68 0.15 -1.52 0.00 0.00 175.55 174.72 1oja s LYS 81 N -3.96 4.40 0.31 -3.49 1.02 -1.26 -1.46 119.74 115.30 1oja s LYS 81 Ca 0.18 0.88 -0.29 0.00 0.02 0.00 0.00 55.97 56.76 1oja s LYS 81 Cb 0.07 -3.36 -0.11 0.00 -0.52 0.00 0.00 37.83 33.91 1oja s LYS 81 CO -0.02 0.30 1.52 0.08 -0.92 0.00 0.00 175.35 176.31 1oja s VAL 82 N -0.03 2.23 -0.05 3.17 1.01 0.20 -4.89 120.40 122.04 1oja s VAL 82 Ca 0.35 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 1oja s VAL 82 Cb -0.19 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.00 1oja s VAL 82 CO 0.20 0.04 1.78 0.21 0.00 0.00 0.00 175.10 177.32 1oja s ASN 83 N 0.25 6.50 -0.04 3.32 2.47 -1.26 -4.82 114.94 121.35 1oja s ASN 83 Ca 0.59 2.29 0.25 0.00 0.42 0.00 0.00 52.86 56.41 1oja s ASN 83 Cb -0.46 -2.53 0.44 0.00 -1.45 0.00 0.00 41.25 37.25 1oja s ASN 83 CO 0.51 -1.06 1.16 1.21 -3.72 0.00 0.00 177.10 175.20 1oja n GLU 84 N 7.41 0.28 -0.04 0.43 2.13 -1.26 -4.67 120.64 124.92 1oja n GLU 84 Ca 0.19 -2.24 -0.13 0.00 0.66 0.00 0.00 57.16 55.64 1oja n GLU 84 Cb 0.43 -0.26 -0.09 0.00 0.27 0.00 0.00 31.44 31.79 1oja n GLU 84 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1oja h VAL 85 N 6.75 1.40 -2.79 6.31 2.07 -1.92 -3.46 116.25 124.61 1oja h VAL 85 Ca -0.21 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 65.93 1oja h VAL 85 Cb 1.80 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 33.71 1oja h VAL 85 CO 0.11 0.38 0.00 -0.62 0.02 0.00 0.00 177.57 177.46 1oja n GLU 86 N -4.65 0.99 -2.72 1.57 4.71 -1.26 -4.99 120.64 114.29 1oja n GLU 86 Ca -0.08 0.00 -0.38 0.00 -0.01 0.00 0.00 57.16 56.70 1oja n GLU 86 Cb 0.35 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.72 1oja n GLU 86 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1oja s ARG 87 N -1.28 4.56 0.65 3.49 0.52 -0.45 -4.17 118.95 122.28 1oja s ARG 87 Ca 0.00 1.42 -0.11 0.00 -0.52 0.00 0.00 55.73 56.51 1oja s ARG 87 Cb 0.00 -2.85 -0.02 0.00 0.52 0.00 0.00 34.95 32.60 1oja s ARG 87 CO 0.00 0.24 1.05 -0.51 0.02 0.00 0.00 175.30 176.11 1oja s LEU 88 N -1.98 3.11 -0.05 2.53 1.02 0.13 -0.50 118.68 122.94 1oja s LEU 88 Ca 0.50 1.34 0.05 0.00 0.02 0.00 0.00 54.13 56.05 1oja s LEU 88 Cb -0.21 -4.30 -0.01 0.00 0.02 0.00 0.00 46.19 41.69 1oja s LEU 88 CO 0.27 -1.07 -0.22 -0.63 0.02 0.00 0.00 176.35 174.72 1oja s ILE 89 N -3.22 1.82 -0.24 -0.59 1.01 -0.37 -0.59 121.20 119.01 1oja s ILE 89 Ca 0.56 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 60.23 1oja s ILE 89 Cb -0.11 -1.55 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 1oja s ILE 89 CO 0.53 0.51 0.01 -2.28 0.00 0.00 0.00 174.94 173.71 1oja s HIS 90 N -0.08 3.03 -0.30 3.97 5.65 -0.53 -0.33 115.29 126.69 1oja s HIS 90 Ca -0.04 -0.87 -0.09 0.00 0.25 0.00 0.00 55.06 54.31 1oja s HIS 90 Cb -0.13 -2.16 -0.01 0.00 -1.18 0.00 0.00 32.58 29.10 1oja s HIS 90 CO 0.03 -0.52 0.14 -1.58 -0.65 0.00 0.00 174.74 172.16 1oja s HIS 91 N 1.50 3.17 -0.02 3.88 2.46 0.71 -0.21 115.29 126.78 1oja s HIS 91 Ca 0.05 -0.53 -0.01 0.00 0.47 0.00 0.00 55.06 55.03 1oja s HIS 91 Cb -0.15 -2.33 0.01 0.00 -0.13 0.00 0.00 32.58 29.97 1oja s HIS 91 CO -0.01 -0.43 0.04 0.54 -2.47 0.00 0.00 174.74 172.41 1oja s VAL 92 N 1.62 -0.01 -1.49 0.89 0.11 -0.36 -1.15 120.40 120.00 1oja s VAL 92 Ca 0.05 0.04 -0.07 0.00 -2.93 0.00 0.00 61.98 59.07 1oja s VAL 92 Cb -0.17 -0.07 0.05 0.00 -1.53 0.00 0.00 36.38 34.67 1oja s VAL 92 CO 0.06 0.02 0.64 0.29 -3.33 0.00 0.00 175.10 172.77 1oja n LYS 93 N 3.28 -3.84 -1.07 1.54 5.02 -1.26 -2.06 118.16 119.77 1oja n LYS 93 Ca -0.15 0.45 -0.02 0.00 -2.02 0.00 0.00 58.31 56.57 1oja n LYS 93 Cb 0.58 -4.91 -0.01 0.00 -0.02 0.00 0.00 35.03 30.67 1oja n LYS 93 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oja n GLY 94 N -1.74 0.57 3.01 0.72 0.00 -1.26 -5.01 105.19 101.47 1oja n GLY 94 Ca -0.15 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.27 1oja n GLY 94 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oja s LYS 95 N -1.44 0.57 -0.12 1.61 2.20 -0.87 -5.08 119.74 116.60 1oja s LYS 95 Ca 0.00 -0.36 -0.14 0.00 -0.36 0.00 0.00 55.97 55.11 1oja s LYS 95 Cb 0.00 -0.52 -0.05 0.00 -1.51 0.00 0.00 37.83 35.76 1oja s LYS 95 CO 0.00 0.13 0.35 -1.12 -0.36 0.00 0.00 175.35 174.35 1oja s SER 96 N -0.45 6.56 -0.34 1.43 0.01 -1.26 -1.23 113.70 118.42 1oja s SER 96 Ca 0.00 0.67 0.03 0.00 1.31 0.00 0.00 55.95 57.96 1oja s SER 96 Cb -0.04 -2.21 0.10 0.00 0.21 0.00 0.00 66.02 64.08 1oja s SER 96 CO -0.00 0.14 0.06 -0.31 0.41 0.00 0.00 173.24 173.54 1oja s TYR 97 N 0.09 3.43 0.46 2.43 1.51 0.71 -4.97 117.35 121.01 1oja s TYR 97 Ca 0.20 -2.80 -0.23 0.00 -1.01 0.00 0.00 57.07 53.23 1oja s TYR 97 Cb -0.14 -2.73 -0.08 0.00 -0.11 0.00 0.00 41.96 38.90 1oja s TYR 97 CO 0.07 -0.94 1.14 -2.14 -1.11 0.00 0.00 175.55 172.57 1oja s PRO 98 N 1.02 3.79 0.17 -1.71 0.02 -1.26 -1.46 135.00 135.56 1oja s PRO 98 Ca 0.11 1.70 -0.15 0.00 0.02 0.00 0.00 61.00 62.68 1oja s PRO 98 Cb -0.19 -2.38 0.02 0.00 0.02 0.00 0.00 34.50 31.98 1oja s PRO 98 CO -0.11 -0.51 0.44 -0.59 -0.33 0.00 0.00 177.00 175.90 1oja s PHE 99 N -1.60 -0.03 0.16 6.54 -0.12 0.24 -4.93 117.98 118.24 1oja s PHE 99 Ca 0.64 -0.31 0.08 0.00 -0.05 0.00 0.00 56.93 57.29 1oja s PHE 99 Cb -0.27 0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.35 1oja s PHE 99 CO 0.32 -0.82 -0.09 1.03 -0.05 0.00 0.00 175.22 175.61 1oja s ARG 100 N -3.87 2.09 0.00 1.99 0.52 -1.26 -0.69 118.95 117.72 1oja s ARG 100 Ca 0.09 -1.19 0.00 0.00 -0.52 0.00 0.00 55.73 54.11 1oja s ARG 100 Cb 0.01 -2.21 0.00 0.00 0.52 0.00 0.00 34.95 33.27 1oja s ARG 100 CO -0.05 0.46 0.00 0.41 0.02 0.00 0.00 175.30 176.14 1oja n GLY 101 N 0.22 0.24 0.21 -3.53 0.00 -1.26 -4.66 105.19 96.40 1oja n GLY 101 Ca -0.12 -1.83 0.15 0.00 0.00 0.00 0.00 46.02 44.22 1oja n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oja h PRO 102 N 0.00 0.00 -5.00 1.61 0.13 -1.96 -3.45 132.00 123.32 1oja h PRO 102 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 1oja h PRO 102 Cb 0.00 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 30.80 1oja h PRO 102 CO 0.00 0.00 -0.84 -0.06 -0.23 0.00 0.00 178.00 176.87 1oja s PHE 103 N -3.49 1.83 0.20 1.56 2.99 -1.26 -4.96 117.98 114.85 1oja s PHE 103 Ca 0.03 -0.66 -0.31 0.00 0.00 0.00 0.00 56.93 55.99 1oja s PHE 103 Cb 0.09 -1.27 -0.11 0.00 0.00 0.00 0.00 43.02 41.74 1oja s PHE 103 CO 0.48 -0.28 1.60 -2.14 -0.00 0.00 0.00 175.22 174.88 1oja s PRO 104 N 0.38 4.18 0.54 0.24 0.02 -1.26 -4.90 135.00 134.20 1oja s PRO 104 Ca -0.12 2.45 -0.21 0.00 0.02 0.00 0.00 61.00 63.14 1oja s PRO 104 Cb -0.15 -3.11 -0.05 0.00 0.02 0.00 0.00 34.50 31.21 1oja s PRO 104 CO 0.05 -0.63 1.29 -2.14 -0.33 0.00 0.00 177.00 175.23 1oja s PRO 105 N 0.78 3.21 -0.08 5.54 0.02 -1.26 -5.04 135.00 138.16 1oja s PRO 105 Ca 0.69 2.06 0.03 0.00 0.02 0.00 0.00 61.00 63.81 1oja s PRO 105 Cb -0.46 -2.22 0.01 0.00 0.02 0.00 0.00 34.50 31.85 1oja s PRO 105 CO 0.35 -1.08 -0.17 0.08 -0.33 0.00 0.00 177.00 175.85 1oja s VAL 106 N -1.40 1.53 -0.21 3.83 1.01 -1.26 -5.07 120.40 118.82 1oja s VAL 106 Ca 0.71 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1oja s VAL 106 Cb -0.36 -1.35 -0.14 0.00 0.00 0.00 0.00 36.38 34.53 1oja s VAL 106 CO 0.42 0.44 -0.19 0.79 0.00 0.00 0.00 175.10 176.56 1oja n TRP 107 N 3.73 0.00 -1.78 5.22 7.02 -1.26 -4.74 117.44 125.64 1oja n TRP 107 Ca -0.21 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.85 1oja n TRP 107 Cb 0.52 -0.82 -0.03 0.00 -2.42 0.00 0.00 31.31 28.56 1oja n TRP 107 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1oja s ASN 108 N -6.11 6.44 0.25 -0.99 3.84 -1.26 -4.87 114.94 112.25 1oja s ASN 108 Ca -0.29 2.77 -0.03 0.00 0.21 0.00 0.00 52.86 55.52 1oja s ASN 108 Cb 0.08 -2.59 0.30 0.00 -0.55 0.00 0.00 41.25 38.48 1oja s ASN 108 CO 0.49 -0.95 1.74 1.55 -2.79 0.00 0.00 177.10 177.14 1oja h PRO 109 N 7.35 0.82 -0.31 0.43 0.13 -1.99 0.34 132.00 138.77 1oja h PRO 109 Ca -0.44 -0.23 -0.12 0.00 -0.87 0.00 0.00 66.00 64.35 1oja h PRO 109 Cb 1.21 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1oja h PRO 109 CO 0.95 0.83 -0.26 0.82 -0.23 0.00 0.00 178.00 180.11 1oja h ILE 110 N 0.76 1.30 -0.57 -3.56 1.08 -2.00 -1.81 117.51 112.70 1oja h ILE 110 Ca 0.14 -1.41 -0.01 0.00 -0.39 0.00 0.00 64.86 63.19 1oja h ILE 110 Cb 0.48 1.51 -0.03 0.00 -3.07 0.00 0.00 36.82 35.71 1oja h ILE 110 CO 0.02 0.46 0.31 0.74 -0.69 0.00 0.00 178.15 178.99 1oja h THR 111 N 0.49 1.19 -0.50 -0.27 2.02 -1.83 -1.27 112.91 112.73 1oja h THR 111 Ca 0.06 -0.48 0.08 0.00 0.77 0.00 0.00 66.41 66.84 1oja h THR 111 Cb 0.82 0.46 -0.06 0.00 -1.74 0.00 0.00 68.15 67.63 1oja h THR 111 CO 0.07 0.20 0.14 0.22 0.37 0.00 0.00 175.52 176.52 1oja h TYR 112 N 0.77 0.23 -0.75 3.16 5.03 -0.12 0.10 116.97 125.40 1oja h TYR 112 Ca 0.20 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.49 1oja h TYR 112 Cb 0.05 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.26 1oja h TYR 112 CO -0.01 0.04 0.27 -0.07 -1.32 0.00 0.00 178.16 177.08 1oja h LEU 113 N 0.29 1.04 -0.10 2.82 3.38 -0.94 0.30 115.31 122.10 1oja h LEU 113 Ca 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1oja h LEU 113 Cb 0.30 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1oja h LEU 113 CO -0.29 0.94 0.01 -0.78 0.09 0.00 0.00 178.44 178.42 1oja h ASP 114 N 1.09 0.17 -0.16 -0.43 3.58 -0.63 -0.56 116.42 119.48 1oja h ASP 114 Ca 0.25 -0.28 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 1oja h ASP 114 Cb 0.24 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1oja h ASP 114 CO -0.02 0.40 0.09 0.45 -2.88 0.00 0.00 179.24 177.29 1oja h HIS 115 N -0.07 0.22 -0.49 0.28 3.86 -0.89 -1.57 115.15 116.50 1oja h HIS 115 Ca 0.03 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.28 1oja h HIS 115 Cb 0.31 -0.07 -0.05 0.00 1.06 0.00 0.00 27.41 28.66 1oja h HIS 115 CO 0.02 0.21 0.22 -0.97 0.86 0.00 0.00 177.93 178.28 1oja h ASN 116 N 0.17 0.30 -0.46 2.45 -0.73 -0.85 -2.13 115.58 114.32 1oja h ASN 116 Ca 0.06 0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.20 1oja h ASN 116 Cb 0.06 -0.01 -0.02 0.00 0.27 0.00 0.00 38.32 38.62 1oja h ASN 116 CO -0.01 0.21 0.06 -1.13 -0.37 0.00 0.00 177.43 176.19 1oja h ASN 117 N 0.44 0.79 0.45 1.15 -0.73 -0.96 -2.39 115.58 114.33 1oja h ASN 117 Ca 0.22 -0.17 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 1oja h ASN 117 Cb 0.16 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 38.55 1oja h ASN 117 CO -0.18 0.82 -0.22 0.15 -0.37 0.00 0.00 177.43 177.64 1oja h PHE 118 N 0.79 -0.56 -0.74 0.67 3.57 -0.61 0.19 116.94 120.24 1oja h PHE 118 Ca 0.16 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 1oja h PHE 118 Cb 0.39 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 1oja h PHE 118 CO 0.02 -0.32 0.27 -1.49 -2.23 0.00 0.00 178.31 174.56 1oja h TRP 119 N -0.65 1.17 -0.56 0.41 4.06 -1.48 -0.88 115.95 118.01 1oja h TRP 119 Ca -0.06 -0.10 0.00 0.00 2.06 0.00 0.00 58.89 60.79 1oja h TRP 119 Cb 0.49 -0.34 -0.03 0.00 -1.00 0.00 0.00 29.16 28.28 1oja h TRP 119 CO -0.03 0.91 0.35 -0.09 -3.56 0.00 0.00 178.44 176.01 1oja h ARG 120 N 1.09 0.74 -0.60 0.49 2.43 -1.30 -1.92 114.38 115.31 1oja h ARG 120 Ca 0.24 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 1oja h ARG 120 Cb 0.26 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1oja h ARG 120 CO -0.01 0.52 0.02 1.15 -1.51 0.00 0.00 179.97 180.14 1oja h THR 121 N 0.75 1.26 -0.60 0.20 2.02 -0.23 0.16 112.91 116.47 1oja h THR 121 Ca 0.20 -1.12 0.05 0.00 0.77 0.00 0.00 66.41 66.31 1oja h THR 121 Cb -0.04 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1oja h THR 121 CO -0.04 0.41 0.33 0.24 0.37 0.00 0.00 175.52 176.83 1oja h MET 122 N 0.95 0.61 -0.15 6.66 2.86 -0.87 0.17 114.93 125.15 1oja h MET 122 Ca 0.17 -0.04 -0.20 0.00 -2.06 0.00 0.00 59.70 57.58 1oja h MET 122 Cb 0.53 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1oja h MET 122 CO 0.03 0.40 -0.71 -0.44 1.06 0.00 0.00 176.91 177.24 1oja h ASP 123 N 0.62 0.78 -0.43 1.22 3.32 -0.99 -1.55 116.42 119.40 1oja h ASP 123 Ca 0.26 -0.49 0.04 0.00 0.02 0.00 0.00 57.03 56.86 1oja h ASP 123 Cb 0.14 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 1oja h ASP 123 CO -0.16 1.26 0.20 0.44 -1.72 0.00 0.00 179.24 179.26 1oja h ASP 124 N 0.47 0.28 -0.77 6.45 3.32 -0.23 -2.04 116.42 123.89 1oja h ASP 124 Ca -0.03 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1oja h ASP 124 Cb 1.32 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.81 1oja h ASP 124 CO 0.14 0.20 0.34 0.24 -1.72 0.00 0.00 179.24 178.44 1oja h MET 125 N 0.41 1.14 -0.46 3.56 2.86 -0.59 -2.70 114.93 119.14 1oja h MET 125 Ca 0.19 -0.19 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1oja h MET 125 Cb 0.12 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 1oja h MET 125 CO -0.15 0.91 0.31 0.78 1.06 0.00 0.00 176.91 179.82 1oja h GLY 126 N 1.11 0.55 2.00 8.32 0.00 -0.71 -1.83 103.07 112.52 1oja h GLY 126 Ca 0.26 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 1oja h GLY 126 CO -0.03 0.16 -0.01 3.21 0.00 0.00 0.00 176.54 179.87 1oja h ARG 127 N 0.47 0.00 -0.15 4.80 3.08 -1.04 -0.78 114.38 120.75 1oja h ARG 127 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1oja h ARG 127 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1oja h ARG 127 CO -0.05 0.01 0.00 0.39 -1.07 0.00 0.00 179.97 179.25 1oja n GLU 128 N -3.13 1.83 -3.79 0.04 -0.58 -0.69 -4.83 120.64 109.49 1oja n GLU 128 Ca -0.02 -1.24 -0.37 0.00 -0.42 0.00 0.00 57.16 55.11 1oja n GLU 128 Cb 0.16 -1.43 -0.13 0.00 -0.57 0.00 0.00 31.44 29.47 1oja n GLU 128 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1oja s ILE 129 N -1.81 3.62 0.19 -3.67 1.01 -0.30 -4.14 121.20 116.09 1oja s ILE 129 Ca 0.34 -1.10 -0.32 0.00 0.00 0.00 0.00 60.65 59.57 1oja s ILE 129 Cb 0.19 -3.01 -0.11 0.00 0.01 0.00 0.00 42.46 39.54 1oja s ILE 129 CO 0.28 -0.10 1.68 -2.84 0.00 0.00 0.00 174.94 173.96 1oja s PRO 130 N 1.39 4.16 0.32 2.79 0.02 -1.26 -4.90 135.00 137.52 1oja s PRO 130 Ca -0.02 2.52 0.01 0.00 0.02 0.00 0.00 61.00 63.54 1oja s PRO 130 Cb -0.19 -3.14 0.57 0.00 0.02 0.00 0.00 34.50 31.76 1oja s PRO 130 CO 0.02 -0.71 1.95 0.77 -0.33 0.00 0.00 177.00 178.70 1oja h SER 131 N 6.93 0.84 -0.10 2.53 0.02 -1.94 -2.30 113.55 119.52 1oja h SER 131 Ca -0.43 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1oja h SER 131 Cb 1.20 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.55 1oja h SER 131 CO 0.94 0.57 0.00 -0.90 -1.14 0.00 0.00 176.83 176.30 1oja n ASP 132 N -4.46 1.71 -2.72 3.07 5.75 -1.26 -4.54 116.55 114.10 1oja n ASP 132 Ca 0.11 -1.63 -0.07 0.00 -0.01 0.00 0.00 54.79 53.19 1oja n ASP 132 Cb 0.14 -0.06 0.08 0.00 -1.03 0.00 0.00 41.12 40.25 1oja n ASP 132 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oja n ALA 133 N 0.34 -1.76 0.16 2.12 0.00 -0.91 -5.01 120.51 115.45 1oja n ALA 133 Ca 0.18 -1.13 0.16 0.00 0.00 0.00 0.00 53.44 52.65 1oja n ALA 133 Cb 0.36 -1.79 0.76 0.00 0.00 0.00 0.00 19.45 18.78 1oja n ALA 133 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1oja h PRO 134 N 3.30 0.00 0.00 0.00 0.13 -1.68 0.21 132.00 133.97 1oja h PRO 134 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1oja h PRO 134 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1oja h PRO 134 CO 0.14 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.24 1oja n TRP 135 N -4.10 0.00 1.04 1.56 2.14 -1.26 -1.62 117.44 115.20 1oja n TRP 135 Ca 0.03 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.72 1oja n TRP 135 Cb 0.35 -0.42 0.32 0.00 -0.81 0.00 0.00 31.31 30.75 1oja n TRP 135 CO 0.00 0.00 0.00 1.63 2.07 0.00 0.00 177.69 181.39 1oja n LYS 136 N -1.42 2.02 -1.71 -2.67 5.02 0.06 -4.76 118.16 114.70 1oja n LYS 136 Ca 0.04 -1.51 -0.41 0.00 -2.02 0.00 0.00 58.31 54.41 1oja n LYS 136 Cb 0.12 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.68 1oja n LYS 136 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1oja n ALA 137 N 0.77 1.39 -0.34 7.82 0.00 -0.64 -4.87 120.51 124.64 1oja n ALA 137 Ca 0.17 0.26 0.11 0.00 0.00 0.00 0.00 53.44 53.98 1oja n ALA 137 Cb 0.46 -2.28 0.29 0.00 0.00 0.00 0.00 19.45 17.91 1oja n ALA 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1oja h PRO 138 N 2.11 0.74 -0.73 0.00 0.11 -1.92 -0.84 132.00 131.47 1oja h PRO 138 Ca -0.48 -0.04 -0.41 0.00 0.11 0.00 0.00 66.00 65.17 1oja h PRO 138 Cb 1.29 -0.17 -0.24 0.00 0.11 0.00 0.00 31.00 32.00 1oja h PRO 138 CO 0.60 0.49 0.29 1.28 -0.21 0.00 0.00 178.00 180.45 1oja n LEU 139 N -4.78 5.74 -0.16 2.35 4.77 -1.26 -4.80 117.00 118.86 1oja n LEU 139 Ca 0.21 -3.87 -0.03 0.00 -0.03 0.00 0.00 56.01 52.29 1oja n LEU 139 Cb 0.51 -0.75 0.03 0.00 -2.33 0.00 0.00 43.42 40.89 1oja n LEU 139 CO 0.22 1.28 0.77 0.00 -1.33 0.00 0.00 177.39 178.33 1oja h ALA 140 N 1.24 0.33 -0.08 -1.18 0.00 -1.44 -0.84 119.26 117.29 1oja h ALA 140 Ca 0.45 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.55 1oja h ALA 140 Cb 1.99 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 20.15 1oja h ALA 140 CO 0.88 -0.44 0.01 0.93 0.00 0.00 0.00 179.25 180.63 1oja h GLU 141 N 0.00 0.13 -0.47 0.00 5.08 -1.87 0.10 114.58 117.56 1oja h GLU 141 Ca 0.24 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.65 1oja h GLU 141 Cb 0.36 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.52 1oja h GLU 141 CO -0.51 0.36 -0.01 1.49 -1.00 0.00 0.00 179.01 179.34 1oja h GLU 142 N -0.12 0.10 -0.04 2.33 4.81 -1.85 -0.84 114.58 118.98 1oja h GLU 142 Ca 0.02 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 1oja h GLU 142 Cb 0.30 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1oja h GLU 142 CO 0.00 0.06 -0.72 -1.49 -0.73 0.00 0.00 179.01 176.14 1oja h TRP 143 N 0.10 0.29 0.00 0.92 6.55 -1.06 -3.12 115.95 119.62 1oja h TRP 143 Ca 0.23 -0.13 -0.04 0.00 0.95 0.00 0.00 58.89 59.91 1oja h TRP 143 Cb 0.35 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 28.60 1oja h TRP 143 CO -0.31 0.85 -0.18 0.22 -1.05 0.00 0.00 178.44 177.97 1oja h ASP 144 N 0.14 0.00 -0.16 -3.49 3.58 -0.32 -2.16 116.42 114.02 1oja h ASP 144 Ca -0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1oja h ASP 144 Cb 1.27 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.32 1oja h ASP 144 CO 0.11 0.18 0.00 0.59 -2.88 0.00 0.00 179.24 177.24 1oja n ASN 145 N -3.28 1.84 -4.43 2.28 3.02 -0.36 -0.65 115.26 113.67 1oja n ASN 145 Ca 0.01 -1.71 -0.27 0.00 -0.03 0.00 0.00 54.58 52.58 1oja n ASN 145 Cb 0.44 -0.10 -0.12 0.00 -0.61 0.00 0.00 39.78 39.40 1oja n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1oja s MET 146 N -1.80 1.55 0.68 3.52 0.23 -1.18 -4.90 119.30 117.40 1oja s MET 146 Ca 0.34 -1.46 -0.09 0.00 -1.03 0.00 0.00 55.69 53.45 1oja s MET 146 Cb 0.19 -1.89 0.03 0.00 -1.53 0.00 0.00 34.83 31.63 1oja s MET 146 CO 0.28 0.41 1.03 0.95 -2.03 0.00 0.00 175.02 175.66 1oja s THR 147 N -1.55 3.12 0.49 3.16 -4.23 -1.26 -1.05 115.64 114.31 1oja s THR 147 Ca 0.20 0.12 0.15 0.00 -1.18 0.00 0.00 61.69 60.98 1oja s THR 147 Cb -0.08 -3.32 0.23 0.00 1.34 0.00 0.00 72.50 70.67 1oja s THR 147 CO 0.10 -0.37 2.08 0.24 -0.54 0.00 0.00 174.62 176.12 1oja h MET 148 N -0.54 0.00 -0.41 3.99 2.86 -0.61 -2.00 114.93 118.21 1oja h MET 148 Ca -0.45 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.17 1oja h MET 148 Cb 1.28 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.92 1oja h MET 148 CO 0.62 0.08 0.18 -0.22 1.06 0.00 0.00 176.91 178.63 1oja h LYS 149 N 0.00 0.60 -0.78 1.72 3.64 -1.56 0.23 116.57 120.43 1oja h LYS 149 Ca -0.00 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1oja h LYS 149 Cb 0.14 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 1oja h LYS 149 CO 0.01 0.55 0.45 0.93 -2.27 0.00 0.00 179.45 179.11 1oja h GLU 150 N 0.52 1.07 -0.23 1.90 5.08 -1.73 -0.41 114.58 120.79 1oja h GLU 150 Ca 0.14 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1oja h GLU 150 Cb 0.15 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1oja h GLU 150 CO -0.01 0.77 0.12 1.25 -1.00 0.00 0.00 179.01 180.14 1oja h LEU 151 N 1.07 0.29 -0.86 1.33 5.85 -0.98 -1.24 115.31 120.77 1oja h LEU 151 Ca 0.28 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1oja h LEU 151 Cb -0.00 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 1oja h LEU 151 CO -0.05 0.30 0.56 -0.07 -0.34 0.00 0.00 178.44 178.85 1oja h LEU 152 N 0.26 0.99 -1.25 2.25 3.38 -0.78 0.14 115.31 120.30 1oja h LEU 152 Ca 0.08 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1oja h LEU 152 Cb 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1oja h LEU 152 CO -0.01 0.72 0.17 0.44 0.09 0.00 0.00 178.44 179.85 1oja h ASP 153 N 1.16 0.63 -0.12 -0.43 3.32 -0.80 0.43 116.42 120.61 1oja h ASP 153 Ca 0.31 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 1oja h ASP 153 Cb -0.13 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.27 1oja h ASP 153 CO -0.07 0.58 -0.38 0.11 -1.72 0.00 0.00 179.24 177.76 1oja h LYS 154 N 0.68 0.47 0.07 3.56 1.57 -0.50 -3.38 116.57 119.04 1oja h LYS 154 Ca 0.16 -0.35 -0.30 0.00 -1.87 0.00 0.00 60.65 58.29 1oja h LYS 154 Cb 0.17 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1oja h LYS 154 CO -0.01 0.97 -1.60 -0.07 -0.57 0.00 0.00 179.45 178.17 1oja h LEU 155 N 0.07 0.24 -8.78 2.94 3.38 -0.72 -3.45 115.31 108.98 1oja h LEU 155 Ca -0.01 -0.39 -0.63 0.00 0.09 0.00 0.00 57.88 56.94 1oja h LEU 155 Cb 1.01 -0.08 -0.13 0.00 0.09 0.00 0.00 40.66 41.55 1oja h LEU 155 CO 0.08 1.33 0.15 0.00 0.09 0.00 0.00 178.44 180.09 1oja n TRP 157 N 6.05 0.00 -4.42 0.00 7.02 -1.26 -4.84 117.44 120.00 1oja n TRP 157 Ca -0.01 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.20 1oja n TRP 157 Cb 0.49 -0.23 -0.13 0.00 -2.42 0.00 0.00 31.31 29.01 1oja n TRP 157 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1oja s THR 158 N -2.79 1.98 0.31 -0.99 -4.23 -1.26 -5.03 115.64 103.63 1oja s THR 158 Ca 0.17 -1.59 0.03 0.00 -1.18 0.00 0.00 61.69 59.12 1oja s THR 158 Cb 0.18 -1.76 0.14 0.00 1.34 0.00 0.00 72.50 72.41 1oja s THR 158 CO 0.60 0.06 1.84 -0.33 -0.54 0.00 0.00 174.62 176.25 1oja h GLU 159 N 4.12 0.59 0.01 3.99 4.39 -1.99 -2.09 114.58 123.60 1oja h GLU 159 Ca -0.48 -0.14 0.02 0.00 0.34 0.00 0.00 59.36 59.10 1oja h GLU 159 Cb 1.17 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.72 1oja h GLU 159 CO 0.40 0.62 -0.10 1.03 -1.16 0.00 0.00 179.01 179.80 1oja h SER 160 N 0.56 -0.29 -0.53 1.42 0.87 -1.99 0.58 113.55 114.18 1oja h SER 160 Ca 0.12 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.68 1oja h SER 160 Cb 0.38 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.44 1oja h SER 160 CO 0.01 -0.15 0.19 0.00 -0.53 0.00 0.00 176.83 176.35 1oja h ALA 161 N 0.79 0.69 -0.59 6.23 0.00 -1.87 -2.13 119.26 122.37 1oja h ALA 161 Ca 0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1oja h ALA 161 Cb 0.22 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1oja h ALA 161 CO -0.10 0.32 0.15 -0.22 0.00 0.00 0.00 179.25 179.40 1oja h LYS 162 N 0.72 0.91 -0.31 0.00 3.64 -1.08 0.78 116.57 121.24 1oja h LYS 162 Ca 0.17 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1oja h LYS 162 Cb 0.24 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1oja h LYS 162 CO -0.01 0.81 -0.14 1.96 -2.27 0.00 0.00 179.45 179.80 1oja h GLN 163 N 0.88 0.63 -0.43 1.90 4.20 -0.69 -0.73 115.11 120.86 1oja h GLN 163 Ca 0.19 -0.27 -0.14 0.00 0.06 0.00 0.00 58.65 58.49 1oja h GLN 163 Cb 0.30 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1oja h GLN 163 CO -0.00 0.85 -0.29 1.25 -0.67 0.00 0.00 178.83 179.97 1oja h LEU 164 N 0.39 1.00 -1.18 1.46 5.85 -1.15 -1.80 115.31 119.88 1oja h LEU 164 Ca 0.07 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.34 1oja h LEU 164 Cb 0.66 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1oja h LEU 164 CO 0.04 1.21 0.16 0.00 -0.34 0.00 0.00 178.44 179.52 1oja h ALA 165 N 0.85 1.34 -0.27 1.25 0.00 -0.80 -0.64 119.26 120.99 1oja h ALA 165 Ca 0.09 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1oja h ALA 165 Cb 0.88 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1oja h ALA 165 CO 0.08 0.48 0.07 1.15 0.00 0.00 0.00 179.25 181.03 1oja h THR 166 N 0.73 1.21 -0.56 0.00 2.02 -0.91 -1.30 112.91 114.10 1oja h THR 166 Ca 0.17 -0.70 0.02 0.00 0.77 0.00 0.00 66.41 66.67 1oja h THR 166 Cb 0.20 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 1oja h THR 166 CO -0.01 0.23 0.34 0.25 0.37 0.00 0.00 175.52 176.70 1oja h LEU 167 N 0.28 0.55 -0.39 2.58 6.46 -0.98 -0.29 115.31 123.53 1oja h LEU 167 Ca 0.09 0.00 0.06 0.00 -0.12 0.00 0.00 57.88 57.91 1oja h LEU 167 Cb 0.28 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.04 1oja h LEU 167 CO 0.00 0.39 0.09 0.15 -0.62 0.00 0.00 178.44 178.45 1oja h PHE 168 N 0.67 0.14 -0.20 1.25 3.57 -0.91 0.85 116.94 122.32 1oja h PHE 168 Ca 0.22 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1oja h PHE 168 Cb 0.02 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1oja h PHE 168 CO -0.06 0.03 0.08 0.28 -2.23 0.00 0.00 178.31 176.41 1oja h VAL 169 N 0.22 1.16 -0.91 1.41 2.07 -0.75 -0.94 116.25 118.51 1oja h VAL 169 Ca 0.18 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.27 1oja h VAL 169 Cb 0.21 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 1oja h VAL 169 CO -0.23 0.15 0.59 0.78 0.02 0.00 0.00 177.57 178.88 1oja h ASN 170 N 0.18 0.97 -0.15 0.57 -0.26 -0.53 -1.75 115.58 114.61 1oja h ASN 170 Ca 0.07 -0.00 -0.22 0.00 -0.56 0.00 0.00 56.30 55.58 1oja h ASN 170 Cb 0.16 -0.21 0.01 0.00 -1.06 0.00 0.00 38.32 37.22 1oja h ASN 170 CO -0.01 0.66 -0.78 0.25 -1.06 0.00 0.00 177.43 176.49 1oja h LEU 171 N 1.13 0.95 -0.50 1.61 5.85 -0.71 0.07 115.31 123.71 1oja h LEU 171 Ca 0.37 -0.63 -0.17 0.00 0.84 0.00 0.00 57.88 58.29 1oja h LEU 171 Cb 0.03 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1oja h LEU 171 CO -0.13 1.43 -0.58 0.00 -0.34 0.00 0.00 178.44 178.82 1oja n VAL 173 N -3.94 0.54 -4.23 0.00 0.24 -0.69 -4.97 118.33 105.28 1oja n VAL 173 Ca -0.03 -0.57 -0.34 0.00 -2.04 0.00 0.00 64.34 61.35 1oja n VAL 173 Cb 0.62 0.65 -0.04 0.00 -1.47 0.00 0.00 33.84 33.60 1oja n VAL 173 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1oja n THR 174 N -0.31 -1.28 -3.82 3.34 -2.24 0.01 -4.56 114.28 105.41 1oja n THR 174 Ca 0.01 -0.17 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 1oja n THR 174 Cb 0.44 -1.61 -0.07 0.00 -2.10 0.00 0.00 70.33 66.99 1oja n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oja s ALA 175 N -3.56 -0.37 0.56 6.98 0.00 -1.24 -1.43 121.76 122.70 1oja s ALA 175 Ca 0.51 -0.43 -0.16 0.00 0.00 0.00 0.00 51.96 51.88 1oja s ALA 175 Cb -0.28 0.45 -0.06 0.00 0.00 0.00 0.00 23.12 23.23 1oja s ALA 175 CO 0.95 -0.48 1.02 -1.21 0.00 0.00 0.00 175.76 176.03 1oja s GLU 176 N -3.47 3.65 0.41 0.00 0.41 -1.26 -3.80 118.70 114.64 1oja s GLU 176 Ca 0.02 1.04 0.10 0.00 -0.41 0.00 0.00 54.97 55.71 1oja s GLU 176 Cb 0.03 -2.09 0.88 0.00 -1.78 0.00 0.00 34.13 31.17 1oja s GLU 176 CO -0.09 -0.53 2.00 1.79 -0.49 0.00 0.00 175.26 177.94 1oja h THR 177 N 0.60 1.12 0.00 3.63 1.35 -1.94 -1.43 112.91 116.25 1oja h THR 177 Ca -0.47 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1oja h THR 177 Cb 1.20 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1oja h THR 177 CO 0.60 0.16 0.00 0.00 -0.25 0.00 0.00 175.52 176.03 1oja n HIS 178 N -4.38 0.00 0.06 4.73 1.44 -1.26 -1.53 115.22 114.28 1oja n HIS 178 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 1oja n HIS 178 Cb 0.17 -0.45 -0.05 0.00 0.12 0.00 0.00 29.99 29.79 1oja n HIS 178 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 1oja h GLU 179 N 0.00 0.00 -6.37 -1.40 5.08 -1.63 -3.47 114.58 106.79 1oja h GLU 179 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 1oja h GLU 179 Cb 0.42 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.50 1oja h GLU 179 CO 0.00 0.30 -0.71 0.14 -1.00 0.00 0.00 179.01 177.74 1oja s VAL 180 N -2.98 3.60 0.32 3.13 -7.23 -1.22 -4.14 120.40 111.88 1oja s VAL 180 Ca -0.01 -0.94 -0.29 0.00 -1.81 0.00 0.00 61.98 58.93 1oja s VAL 180 Cb 0.09 -2.61 -0.11 0.00 0.56 0.00 0.00 36.38 34.31 1oja s VAL 180 CO 0.79 0.28 1.42 -0.55 -0.31 0.00 0.00 175.10 176.74 1oja s SER 181 N -1.74 6.57 0.14 4.85 0.15 0.13 -1.32 113.70 122.48 1oja s SER 181 Ca 0.19 2.83 -0.13 0.00 0.70 0.00 0.00 55.95 59.54 1oja s SER 181 Cb -0.11 -2.65 -0.00 0.00 -1.71 0.00 0.00 66.02 61.55 1oja s SER 181 CO 0.10 -0.72 1.59 0.00 1.20 0.00 0.00 173.24 175.42 1oja h ALA 182 N 3.77 0.60 -0.38 5.45 0.00 -1.08 -1.16 119.26 126.47 1oja h ALA 182 Ca -0.49 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.19 1oja h ALA 182 Cb 1.23 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1oja h ALA 182 CO 0.69 0.39 0.17 1.25 0.00 0.00 0.00 179.25 181.75 1oja h LEU 183 N 0.63 0.22 -0.43 0.00 5.85 -1.63 -0.05 115.31 119.91 1oja h LEU 183 Ca 0.13 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 1oja h LEU 183 Cb 0.49 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1oja h LEU 183 CO 0.02 0.17 0.08 -0.25 -0.34 0.00 0.00 178.44 178.12 1oja h TRP 184 N 0.35 0.75 -0.51 1.25 7.01 -1.84 -0.25 115.95 122.71 1oja h TRP 184 Ca 0.16 -0.10 -0.07 0.00 2.11 0.00 0.00 58.89 61.00 1oja h TRP 184 Cb 0.10 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 1oja h TRP 184 CO -0.12 0.71 0.05 0.35 -2.79 0.00 0.00 178.44 176.65 1oja h PHE 185 N 0.57 0.93 -0.74 2.65 3.57 -0.85 0.13 116.94 123.19 1oja h PHE 185 Ca 0.13 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 1oja h PHE 185 Cb 0.36 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 1oja h PHE 185 CO 0.02 0.85 0.29 -0.07 -2.23 0.00 0.00 178.31 177.17 1oja h LEU 186 N 0.74 1.02 -0.55 0.59 3.38 -0.85 -1.37 115.31 118.28 1oja h LEU 186 Ca 0.15 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1oja h LEU 186 Cb 0.44 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1oja h LEU 186 CO 0.02 0.91 0.33 -0.25 0.09 0.00 0.00 178.44 179.54 1oja h TRP 187 N 1.08 0.72 -0.69 1.13 7.01 -0.68 -1.92 115.95 122.59 1oja h TRP 187 Ca 0.25 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.25 1oja h TRP 187 Cb 0.22 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 27.01 1oja h TRP 187 CO 0.02 0.49 0.42 -0.92 -2.79 0.00 0.00 178.44 175.66 1oja h TYR 188 N 0.74 0.91 -0.16 2.65 3.20 0.18 0.10 116.97 124.58 1oja h TYR 188 Ca 0.20 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.02 1oja h TYR 188 Cb -0.02 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 37.94 1oja h TYR 188 CO -0.03 0.61 -0.09 0.28 -1.64 0.00 0.00 178.16 177.29 1oja h VAL 189 N 0.94 1.32 -0.97 1.81 2.07 -1.28 -3.03 116.25 117.11 1oja h VAL 189 Ca 0.25 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.62 1oja h VAL 189 Cb -0.04 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1oja h VAL 189 CO -0.05 0.34 0.62 0.50 0.02 0.00 0.00 177.57 179.00 1oja h LYS 190 N 0.01 1.30 0.00 1.57 3.11 -0.85 -0.80 116.57 120.91 1oja h LYS 190 Ca 0.03 -0.09 0.00 0.00 -2.81 0.00 0.00 60.65 57.78 1oja h LYS 190 Cb 0.57 -0.28 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1oja h LYS 190 CO 0.03 0.88 0.00 0.00 -2.81 0.00 0.00 179.45 177.54 1oja n GLN 191 N -4.37 0.23 -0.20 1.90 -0.00 0.32 -1.19 117.38 114.07 1oja n GLN 191 Ca 0.11 0.07 0.10 0.00 -0.00 0.00 0.00 57.00 57.28 1oja n GLN 191 Cb 0.03 -1.50 0.27 0.00 -0.00 0.00 0.00 30.24 29.04 1oja n GLN 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1oja n GLY 193 N 1.35 0.79 0.00 0.00 0.00 -0.33 -4.35 105.19 102.65 1oja n GLY 193 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1oja n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 194 N -2.16 0.65 0.17 -0.02 0.00 -0.38 -4.48 105.19 98.97 1oja n GLY 194 Ca 0.00 -2.13 -0.09 0.00 0.00 0.00 0.00 46.02 43.80 1oja n GLY 194 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1oja h THR 195 N 0.00 1.15 -0.37 2.61 1.35 -1.92 -1.43 112.91 114.29 1oja h THR 195 Ca 0.00 -0.39 -0.01 0.00 -0.55 0.00 0.00 66.41 65.46 1oja h THR 195 Cb 0.00 0.75 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 1oja h THR 195 CO 0.00 0.15 0.20 0.74 -0.25 0.00 0.00 175.52 176.36 1oja h THR 196 N 0.45 1.15 -0.49 6.82 2.02 -1.97 -2.23 112.91 118.66 1oja h THR 196 Ca 0.12 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.84 1oja h THR 196 Cb 0.07 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1oja h THR 196 CO -0.02 0.16 0.06 -0.09 0.37 0.00 0.00 175.52 176.00 1oja h ARG 197 N 0.47 0.82 -0.08 6.66 9.65 -1.71 -2.02 114.38 128.18 1oja h ARG 197 Ca 0.13 -0.23 -0.14 0.00 -1.10 0.00 0.00 59.98 58.65 1oja h ARG 197 Cb 0.08 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 1oja h ARG 197 CO -0.02 0.83 -0.56 0.97 2.80 0.00 0.00 179.97 183.99 1oja h ILE 198 N 0.69 1.37 0.00 1.20 2.10 -1.18 -1.25 117.51 120.45 1oja h ILE 198 Ca 0.15 -1.88 0.00 0.00 1.08 0.00 0.00 64.86 64.21 1oja h ILE 198 Cb 0.42 1.93 0.00 0.00 -1.09 0.00 0.00 36.82 38.08 1oja h ILE 198 CO 0.01 0.55 -1.00 0.00 -1.08 0.00 0.00 178.15 176.64 1oja n ILE 199 N -3.91 0.10 -3.13 2.19 0.13 -0.85 -4.37 119.36 109.52 1oja n ILE 199 Ca -0.02 -0.17 -0.33 0.00 -1.10 0.00 0.00 62.75 61.13 1oja n ILE 199 Cb 0.58 0.38 -0.06 0.00 -0.84 0.00 0.00 39.64 39.70 1oja n ILE 199 CO 0.00 0.00 0.00 -0.44 2.80 0.00 0.00 176.55 178.91 1oja s SER 200 N -3.61 6.84 0.00 9.51 0.01 -0.77 -4.93 113.70 120.75 1oja s SER 200 Ca 0.05 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.63 1oja s SER 200 Cb 0.15 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 64.00 1oja s SER 200 CO 0.81 -0.15 0.00 0.41 0.41 0.00 0.00 173.24 174.72 1oja n THR 201 N -0.11 0.00 -1.67 1.44 -1.04 -1.26 -2.14 114.28 109.49 1oja n THR 201 Ca 0.02 0.05 -0.47 0.00 -2.04 0.00 0.00 64.05 61.62 1oja n THR 201 Cb 0.53 -0.45 -0.04 0.00 -1.82 0.00 0.00 70.33 68.54 1oja n THR 201 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1oja n THR 202 N -0.97 0.22 -1.36 12.58 -1.04 -1.26 -1.27 114.28 121.18 1oja n THR 202 Ca 0.00 -0.04 -0.12 0.00 -2.04 0.00 0.00 64.05 61.85 1oja n THR 202 Cb 0.00 -1.68 -0.05 0.00 -1.82 0.00 0.00 70.33 66.78 1oja n THR 202 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1oja n ASN 203 N 4.64 -4.71 -0.58 8.00 5.15 -1.26 -4.97 115.26 121.54 1oja n ASN 203 Ca 0.19 0.31 0.00 0.00 -0.60 0.00 0.00 54.58 54.48 1oja n ASN 203 Cb 0.29 -3.30 0.00 0.00 -0.53 0.00 0.00 39.78 36.24 1oja n ASN 203 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oja n GLY 204 N -1.17 4.49 0.31 8.20 0.00 -0.40 -4.79 105.19 111.83 1oja n GLY 204 Ca -0.12 -1.55 0.15 0.00 0.00 0.00 0.00 46.02 44.49 1oja n GLY 204 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1oja h GLY 205 N 0.00 0.00 -3.39 -0.02 0.00 -0.85 -2.57 103.07 96.24 1oja h GLY 205 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 1oja h GLY 205 CO 0.00 0.00 0.20 -1.06 0.00 0.00 0.00 176.54 175.68 1oja n GLN 206 N -4.00 3.67 -0.04 4.80 3.00 -0.91 -3.59 117.38 120.31 1oja n GLN 206 Ca -0.01 -3.09 -0.07 0.00 -0.01 0.00 0.00 57.00 53.82 1oja n GLN 206 Cb 0.20 -2.17 0.11 0.00 0.00 0.00 0.00 30.24 28.37 1oja n GLN 206 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1oja h GLU 207 N 2.63 0.66 -4.41 -1.09 4.81 -1.19 -3.42 114.58 112.56 1oja h GLU 207 Ca 0.22 -0.29 -0.16 0.00 -0.13 0.00 0.00 59.36 58.99 1oja h GLU 207 Cb 2.19 -0.02 -0.15 0.00 0.63 0.00 0.00 28.75 31.41 1oja h GLU 207 CO 0.65 0.88 -0.68 1.03 -0.73 0.00 0.00 179.01 180.16 1oja s ARG 208 N -4.44 0.73 0.24 1.92 0.52 0.12 -0.63 118.95 117.41 1oja s ARG 208 Ca -0.08 -1.29 0.05 0.00 -0.52 0.00 0.00 55.73 53.89 1oja s ARG 208 Cb 0.13 0.07 -0.05 0.00 0.52 0.00 0.00 34.95 35.61 1oja s ARG 208 CO 0.83 -0.10 -0.05 0.15 0.02 0.00 0.00 175.30 176.15 1oja s LYS 209 N -3.91 1.40 0.00 3.54 1.02 -0.53 -0.85 119.74 120.41 1oja s LYS 209 Ca 0.11 -1.69 -0.24 0.00 0.02 0.00 0.00 55.97 54.17 1oja s LYS 209 Cb 0.07 -0.89 -0.05 0.00 -0.52 0.00 0.00 37.83 36.44 1oja s LYS 209 CO -0.07 0.00 0.71 -0.06 -0.92 0.00 0.00 175.35 175.02 1oja s PHE 210 N -3.20 3.68 0.08 3.18 0.40 -1.26 -1.29 117.98 119.58 1oja s PHE 210 Ca 0.27 1.35 -0.31 0.00 -0.60 0.00 0.00 56.93 57.65 1oja s PHE 210 Cb 0.04 -2.77 -0.09 0.00 0.51 0.00 0.00 43.02 40.70 1oja s PHE 210 CO 0.09 0.24 1.85 0.08 0.70 0.00 0.00 175.22 178.18 1oja s VAL 211 N 0.16 2.79 0.00 -0.44 1.01 0.21 -1.59 120.40 122.55 1oja s VAL 211 Ca 0.37 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.46 1oja s VAL 211 Cb -0.19 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1oja s VAL 211 CO 0.20 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.91 1oja n GLY 212 N 4.32 1.26 0.00 4.51 0.00 -1.26 -4.67 105.19 109.34 1oja n GLY 212 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1oja n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 213 N -2.00 2.43 0.24 -0.02 0.00 -0.62 -4.76 105.19 100.45 1oja n GLY 213 Ca 0.00 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.40 1oja n GLY 213 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1oja h SER 214 N 0.00 0.00 -0.24 1.61 4.64 -1.83 -2.99 113.55 114.74 1oja h SER 214 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 1oja h SER 214 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1oja h SER 214 CO 0.00 0.08 0.31 1.23 -0.87 0.00 0.00 176.83 177.58 1oja h GLY 215 N 2.87 0.00 2.00 -0.77 0.00 -1.87 -0.42 103.07 104.88 1oja h GLY 215 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1oja h GLY 215 CO 0.01 0.00 -0.08 1.46 0.00 0.00 0.00 176.54 177.93 1oja h GLN 216 N 0.00 0.00 0.49 4.80 4.20 -1.82 -1.41 115.11 121.37 1oja h GLN 216 Ca 0.11 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 1oja h GLN 216 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 1oja h GLN 216 CO -0.00 0.08 -0.24 0.28 -0.67 0.00 0.00 178.83 178.29 1oja h VAL 217 N 0.00 0.52 -0.25 -0.54 2.07 -1.31 0.39 116.25 117.13 1oja h VAL 217 Ca -0.00 -0.02 -0.12 0.00 0.82 0.00 0.00 66.70 67.37 1oja h VAL 217 Cb 0.20 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1oja h VAL 217 CO 0.01 0.00 -0.36 0.28 0.02 0.00 0.00 177.57 177.52 1oja h SER 218 N -0.67 0.58 -0.44 0.57 0.02 -1.66 -2.59 113.55 109.36 1oja h SER 218 Ca -0.07 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.57 1oja h SER 218 Cb 0.51 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 1oja h SER 218 CO 0.11 0.89 -0.01 -0.33 -1.14 0.00 0.00 176.83 176.36 1oja h GLU 219 N 0.47 0.78 0.00 3.45 5.08 -1.16 -0.45 114.58 122.75 1oja h GLU 219 Ca 0.05 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.02 1oja h GLU 219 Cb 0.84 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1oja h GLU 219 CO 0.07 0.85 -0.64 0.00 -1.00 0.00 0.00 179.01 178.29 1oja h ARG 220 N 0.62 0.00 -0.28 2.33 3.08 -0.86 0.45 114.38 119.72 1oja h ARG 220 Ca 0.12 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.00 1oja h ARG 220 Cb 0.50 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1oja h ARG 220 CO 0.02 0.64 -0.52 0.82 -1.07 0.00 0.00 179.97 179.86 1oja h ILE 221 N 0.00 1.29 -0.84 2.04 2.04 -1.32 -2.15 117.51 118.57 1oja h ILE 221 Ca -0.01 -1.72 0.04 0.00 1.00 0.00 0.00 64.86 64.18 1oja h ILE 221 Cb 1.14 1.62 -0.05 0.00 -0.74 0.00 0.00 36.82 38.79 1oja h ILE 221 CO 0.08 0.55 0.55 -0.03 0.00 0.00 0.00 178.15 179.31 1oja h MET 222 N 0.62 0.99 -0.46 2.37 4.05 -0.62 -0.35 114.93 121.52 1oja h MET 222 Ca 0.02 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1oja h MET 222 Cb 1.11 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 31.66 1oja h MET 222 CO 0.11 0.66 0.29 -0.44 0.23 0.00 0.00 176.91 177.76 1oja h ASP 223 N 1.02 0.55 -0.72 1.39 3.32 -0.65 -0.80 116.42 120.52 1oja h ASP 223 Ca 0.34 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1oja h ASP 223 Cb 0.07 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 1oja h ASP 223 CO -0.10 0.42 0.46 -0.07 -1.72 0.00 0.00 179.24 178.23 1oja h LEU 224 N 0.62 0.84 0.00 1.55 3.38 -0.72 -3.10 115.31 117.89 1oja h LEU 224 Ca 0.17 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1oja h LEU 224 Cb -0.04 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1oja h LEU 224 CO -0.03 0.62 -0.16 -0.07 0.09 0.00 0.00 178.44 178.89 1oja h LEU 225 N 0.98 0.00 0.00 1.67 3.38 -0.68 -3.49 115.31 117.17 1oja h LEU 225 Ca 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1oja h LEU 225 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1oja h LEU 225 CO -0.05 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.10 1oja n GLY 226 N 1.21 3.65 0.00 0.83 0.00 -0.34 -2.21 105.19 108.33 1oja n GLY 226 Ca 0.04 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.06 1oja n GLY 226 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1oja n ASP 227 N 5.25 0.00 0.26 1.61 5.68 -1.26 -2.71 116.55 125.38 1oja n ASP 227 Ca 0.00 -1.49 0.16 0.00 -0.50 0.00 0.00 54.79 52.97 1oja n ASP 227 Cb 0.00 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 40.60 1oja n ASP 227 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1oja h ARG 228 N 0.00 0.00 -5.39 0.11 3.08 -1.76 -3.42 114.38 107.01 1oja h ARG 228 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1oja h ARG 228 Cb 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 29.93 1oja h ARG 228 CO 0.00 0.00 -0.11 0.08 -1.07 0.00 0.00 179.97 178.87 1oja s VAL 229 N -3.60 5.14 -0.34 2.04 1.01 -1.10 -0.96 120.40 122.59 1oja s VAL 229 Ca 0.02 0.80 -0.05 0.00 0.00 0.00 0.00 61.98 62.75 1oja s VAL 229 Cb 0.09 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.74 1oja s VAL 229 CO 0.55 0.17 0.10 -0.54 0.00 0.00 0.00 175.10 175.38 1oja s LYS 230 N 1.78 2.52 0.38 2.72 -0.14 0.12 -4.96 119.74 122.15 1oja s LYS 230 Ca 0.20 -1.28 -0.12 0.00 -1.36 0.00 0.00 55.97 53.42 1oja s LYS 230 Cb -0.15 -3.42 -0.07 0.00 -1.68 0.00 0.00 37.83 32.51 1oja s LYS 230 CO 0.09 -0.71 0.76 -0.51 -0.76 0.00 0.00 175.35 174.22 1oja s LEU 231 N 1.34 3.91 -1.35 3.17 1.43 -1.26 -1.44 118.68 124.48 1oja s LEU 231 Ca -0.01 1.18 -0.08 0.00 -1.03 0.00 0.00 54.13 54.19 1oja s LEU 231 Cb -0.20 -4.04 0.01 0.00 0.03 0.00 0.00 46.19 42.00 1oja s LEU 231 CO 0.01 -0.33 1.15 -0.62 0.23 0.00 0.00 176.35 176.79 1oja n GLU 232 N -0.98 -7.68 -3.51 1.70 1.02 0.35 -4.92 120.64 106.63 1oja n GLU 232 Ca 0.03 0.82 -0.27 0.00 -0.02 0.00 0.00 57.16 57.72 1oja n GLU 232 Cb 0.54 -5.86 -0.09 0.00 -0.02 0.00 0.00 31.44 26.01 1oja n GLU 232 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1oja n ARG 233 N -4.88 2.05 -2.06 3.49 3.00 0.26 -4.71 116.66 113.81 1oja n ARG 233 Ca -0.03 -4.39 -0.42 0.00 -0.01 0.00 0.00 57.85 53.00 1oja n ARG 233 Cb 0.57 -2.12 -0.03 0.00 0.00 0.00 0.00 32.46 30.89 1oja n ARG 233 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 1oja s PRO 234 N -1.97 4.26 0.07 5.56 0.02 -1.26 -3.70 135.00 137.98 1oja s PRO 234 Ca 0.35 2.20 -0.30 0.00 0.02 0.00 0.00 61.00 63.28 1oja s PRO 234 Cb 0.10 -3.29 -0.05 0.00 0.02 0.00 0.00 34.50 31.29 1oja s PRO 234 CO -0.07 -0.55 1.04 0.08 -0.33 0.00 0.00 177.00 177.17 1oja s VAL 235 N 1.42 4.47 -0.04 3.83 1.01 -1.26 0.01 120.40 129.83 1oja s VAL 235 Ca 0.68 1.88 0.02 0.00 0.00 0.00 0.00 61.98 64.56 1oja s VAL 235 Cb -0.39 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 1oja s VAL 235 CO 0.31 0.21 0.06 2.30 0.00 0.00 0.00 175.10 177.98 1oja n ILE 236 N 3.41 0.00 -3.65 2.22 -5.35 -0.18 -4.52 119.36 111.29 1oja n ILE 236 Ca 0.05 -0.20 -0.09 0.00 -0.27 0.00 0.00 62.75 62.25 1oja n ILE 236 Cb 0.49 0.65 -0.07 0.00 -1.74 0.00 0.00 39.64 38.96 1oja n ILE 236 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1oja s TYR 237 N -1.81 -0.96 -0.09 4.28 5.04 -1.13 -0.56 117.35 122.11 1oja s TYR 237 Ca -0.00 2.00 0.00 0.00 -2.44 0.00 0.00 57.07 56.63 1oja s TYR 237 Cb 0.02 0.53 0.02 0.00 0.35 0.00 0.00 41.96 42.87 1oja s TYR 237 CO 0.09 -0.48 -0.08 0.42 -1.34 0.00 0.00 175.55 174.16 1oja s ILE 238 N 1.35 0.96 -0.19 3.14 1.01 -0.74 -0.58 121.20 126.16 1oja s ILE 238 Ca -0.08 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.28 1oja s ILE 238 Cb -0.05 -0.96 0.02 0.00 0.01 0.00 0.00 42.46 41.47 1oja s ILE 238 CO -0.15 0.34 -0.18 -0.62 0.00 0.00 0.00 174.94 174.33 1oja s ASP 239 N 1.37 3.30 -0.13 3.58 -1.08 0.14 -1.17 116.67 122.68 1oja s ASP 239 Ca -0.02 -0.67 0.16 0.00 -0.52 0.00 0.00 52.55 51.50 1oja s ASP 239 Cb -0.14 -1.51 0.39 0.00 -1.46 0.00 0.00 42.92 40.21 1oja s ASP 239 CO -0.04 -0.01 1.29 0.00 0.52 0.00 0.00 175.17 176.93 1oja n GLN 240 N 4.63 2.42 0.14 4.34 6.02 0.17 -1.29 117.38 133.80 1oja n GLN 240 Ca -0.20 -2.58 0.13 0.00 -0.01 0.00 0.00 57.00 54.34 1oja n GLN 240 Cb 0.50 -1.61 0.31 0.00 1.02 0.00 0.00 30.24 30.46 1oja n GLN 240 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1oja h THR 241 N 1.14 0.00 -0.52 5.09 1.35 -1.89 -3.46 112.91 114.62 1oja h THR 241 Ca 0.00 -0.65 -0.58 0.00 -0.55 0.00 0.00 66.41 64.64 1oja h THR 241 Cb 1.16 1.62 -0.04 0.00 -1.73 0.00 0.00 68.15 69.16 1oja h THR 241 CO 0.11 0.00 -0.27 -0.13 -0.25 0.00 0.00 175.52 174.99 1oja s ARG 242 N -3.14 2.25 0.16 4.72 0.52 -1.26 -5.05 118.95 117.15 1oja s ARG 242 Ca 0.09 -2.00 -0.15 0.00 -0.52 0.00 0.00 55.73 53.15 1oja s ARG 242 Cb 0.10 -2.16 0.09 0.00 0.52 0.00 0.00 34.95 33.51 1oja s ARG 242 CO 0.63 -0.69 1.75 1.49 0.02 0.00 0.00 175.30 178.50 1oja h GLU 243 N 0.64 0.29 -6.13 3.54 4.81 -1.97 -3.41 114.58 112.35 1oja h GLU 243 Ca -0.35 -0.02 -0.64 0.00 -0.13 0.00 0.00 59.36 58.22 1oja h GLU 243 Cb 1.30 -0.07 -0.08 0.00 0.63 0.00 0.00 28.75 30.53 1oja h GLU 243 CO 0.55 0.19 -0.59 -0.80 -0.73 0.00 0.00 179.01 177.63 1oja s ASN 244 N -5.37 5.65 0.21 1.04 0.01 -1.26 -4.99 114.94 110.22 1oja s ASN 244 Ca -0.13 0.04 -0.30 0.00 -0.71 0.00 0.00 52.86 51.76 1oja s ASN 244 Cb 0.13 -1.56 -0.08 0.00 0.41 0.00 0.00 41.25 40.15 1oja s ASN 244 CO 0.72 0.18 1.15 -0.69 -1.51 0.00 0.00 177.10 176.95 1oja s VAL 245 N -1.38 3.62 -0.17 1.60 1.01 0.43 -4.85 120.40 120.66 1oja s VAL 245 Ca 0.29 1.43 -0.04 0.00 0.00 0.00 0.00 61.98 63.67 1oja s VAL 245 Cb -0.12 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 1oja s VAL 245 CO 0.22 0.26 -0.04 -0.76 0.00 0.00 0.00 175.10 174.78 1oja s LEU 246 N -0.57 3.17 -0.17 3.92 1.43 -0.41 -1.01 118.68 125.04 1oja s LEU 246 Ca 0.50 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1oja s LEU 246 Cb -0.32 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.16 1oja s LEU 246 CO 0.37 0.14 -0.18 -0.69 0.23 0.00 0.00 176.35 176.22 1oja s VAL 247 N 0.55 1.92 -0.08 -1.59 1.01 0.11 -0.68 120.40 121.64 1oja s VAL 247 Ca -0.03 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 1oja s VAL 247 Cb -0.14 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 1oja s VAL 247 CO 0.03 0.49 0.01 -0.70 0.00 0.00 0.00 175.10 174.93 1oja s GLU 248 N 1.34 3.00 0.31 2.72 2.12 0.26 -0.41 118.70 128.04 1oja s GLU 248 Ca 0.04 -0.40 0.07 0.00 0.36 0.00 0.00 54.97 55.04 1oja s GLU 248 Cb -0.13 -2.81 -0.02 0.00 0.26 0.00 0.00 34.13 31.42 1oja s GLU 248 CO -0.12 0.70 0.32 0.95 -0.54 0.00 0.00 175.26 176.57 1oja s THR 249 N -0.92 3.99 0.33 -1.70 -4.23 -0.57 -1.01 115.64 111.53 1oja s THR 249 Ca 0.14 -1.25 0.01 0.00 -1.18 0.00 0.00 61.69 59.41 1oja s THR 249 Cb -0.11 -3.34 0.26 0.00 1.34 0.00 0.00 72.50 70.65 1oja s THR 249 CO 0.03 -0.22 1.99 0.25 -0.54 0.00 0.00 174.62 176.14 1oja h LEU 250 N 1.20 0.82 -1.65 4.79 5.85 -0.75 -2.03 115.31 123.55 1oja h LEU 250 Ca -0.46 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1oja h LEU 250 Cb 1.25 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1oja h LEU 250 CO 0.58 0.59 0.02 -0.46 -0.34 0.00 0.00 178.44 178.83 1oja n ASN 251 N -4.43 2.12 -2.46 1.25 6.94 -1.26 -4.87 115.26 112.55 1oja n ASN 251 Ca 0.08 -2.19 -0.14 0.00 -0.02 0.00 0.00 54.58 52.31 1oja n ASN 251 Cb 0.04 -0.54 0.05 0.00 -2.36 0.00 0.00 39.78 36.97 1oja n ASN 251 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1oja n HIS 252 N 0.13 -1.67 -4.28 -2.53 8.25 -0.76 -5.04 115.22 109.31 1oja n HIS 252 Ca 0.06 0.62 -0.29 0.00 -0.26 0.00 0.00 57.72 57.85 1oja n HIS 252 Cb 0.48 -3.66 -0.11 0.00 1.12 0.00 0.00 29.99 27.82 1oja n HIS 252 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1oja s GLU 253 N -5.51 1.86 -0.09 -0.41 2.02 -1.25 -4.98 118.70 110.33 1oja s GLU 253 Ca 0.25 -1.14 0.05 0.00 0.02 0.00 0.00 54.97 54.14 1oja s GLU 253 Cb -0.11 -2.16 -0.00 0.00 0.10 0.00 0.00 34.13 31.96 1oja s GLU 253 CO 0.46 0.49 -0.24 1.41 0.02 0.00 0.00 175.26 177.39 1oja s MET 254 N -2.16 2.86 -0.02 1.61 -2.45 -1.26 -1.52 119.30 116.36 1oja s MET 254 Ca 0.19 -0.88 0.07 0.00 -1.25 0.00 0.00 55.69 53.81 1oja s MET 254 Cb -0.11 -2.23 -0.02 0.00 1.25 0.00 0.00 34.83 33.71 1oja s MET 254 CO 0.11 0.24 -0.21 0.71 1.05 0.00 0.00 175.02 176.92 1oja s TYR 255 N 0.18 2.48 -0.10 4.11 1.51 0.45 -3.93 117.35 122.04 1oja s TYR 255 Ca -0.14 -0.33 0.03 0.00 -1.01 0.00 0.00 57.07 55.63 1oja s TYR 255 Cb -0.17 -1.53 0.01 0.00 -0.11 0.00 0.00 41.96 40.16 1oja s TYR 255 CO 0.07 0.08 -0.21 -2.00 -1.11 0.00 0.00 175.55 172.39 1oja s GLU 256 N -0.80 2.70 0.13 -0.62 2.12 0.10 0.04 118.70 122.38 1oja s GLU 256 Ca 0.11 -0.75 -0.07 0.00 0.36 0.00 0.00 54.97 54.62 1oja s GLU 256 Cb -0.10 -2.11 -0.02 0.00 0.26 0.00 0.00 34.13 32.16 1oja s GLU 256 CO 0.00 0.09 0.19 0.00 -0.54 0.00 0.00 175.26 175.00 1oja s ALA 257 N 0.55 0.16 0.14 6.30 0.00 -0.18 -1.07 121.76 127.66 1oja s ALA 257 Ca -0.15 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 1oja s ALA 257 Cb -0.17 0.72 -0.07 0.00 0.00 0.00 0.00 23.12 23.59 1oja s ALA 257 CO 0.05 -0.56 1.32 0.87 0.00 0.00 0.00 175.76 177.45 1oja h LYS 258 N 2.71 0.42 -3.99 0.00 1.57 -1.08 0.12 116.57 116.33 1oja h LYS 258 Ca -0.33 -0.43 -0.11 0.00 -1.87 0.00 0.00 60.65 57.91 1oja h LYS 258 Cb 1.21 0.12 -0.14 0.00 0.08 0.00 0.00 32.23 33.50 1oja h LYS 258 CO 0.54 1.09 -0.44 0.71 -0.57 0.00 0.00 179.45 180.78 1oja s TYR 259 N -3.33 0.38 0.01 -1.35 1.51 -0.91 -4.64 117.35 109.02 1oja s TYR 259 Ca -0.06 -0.80 0.05 0.00 -1.01 0.00 0.00 57.07 55.25 1oja s TYR 259 Cb 0.09 -0.17 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 1oja s TYR 259 CO 0.86 -0.56 -0.15 0.08 -1.11 0.00 0.00 175.55 174.67 1oja s VAL 260 N -3.93 1.17 -0.18 0.71 1.01 -0.46 -2.08 120.40 116.64 1oja s VAL 260 Ca 0.11 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1oja s VAL 260 Cb 0.05 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1oja s VAL 260 CO -0.06 0.19 -0.05 -0.63 0.00 0.00 0.00 175.10 174.55 1oja s ILE 261 N -0.57 3.57 -0.44 2.22 1.01 -0.13 -0.80 121.20 126.07 1oja s ILE 261 Ca 0.04 -0.45 -0.20 0.00 0.00 0.00 0.00 60.65 60.03 1oja s ILE 261 Cb -0.07 -2.58 0.02 0.00 0.01 0.00 0.00 42.46 39.85 1oja s ILE 261 CO 0.00 0.47 0.63 -0.55 0.00 0.00 0.00 174.94 175.49 1oja s SER 262 N 0.81 6.31 -0.40 3.58 0.15 0.46 -0.17 113.70 124.43 1oja s SER 262 Ca -0.02 -0.37 0.05 0.00 0.70 0.00 0.00 55.95 56.31 1oja s SER 262 Cb -0.15 -2.31 0.44 0.00 -1.71 0.00 0.00 66.02 62.30 1oja s SER 262 CO 0.02 -0.77 1.33 0.00 1.20 0.00 0.00 173.24 175.02 1oja n ALA 263 N 6.21 5.28 -2.46 5.45 0.00 0.32 -0.72 120.51 134.59 1oja n ALA 263 Ca -0.02 -3.88 -0.25 0.00 0.00 0.00 0.00 53.44 49.29 1oja n ALA 263 Cb 0.48 -0.64 -0.11 0.00 0.00 0.00 0.00 19.45 19.18 1oja n ALA 263 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1oja s ILE 264 N -4.85 2.46 0.30 0.00 -4.36 -1.25 -4.56 121.20 108.93 1oja s ILE 264 Ca 0.52 -2.24 -0.28 0.00 -0.26 0.00 0.00 60.65 58.40 1oja s ILE 264 Cb 0.42 -2.25 -0.14 0.00 1.25 0.00 0.00 42.46 41.75 1oja s ILE 264 CO -0.04 -0.28 1.01 -2.65 0.24 0.00 0.00 174.94 173.22 1oja n PRO 265 N -0.26 1.36 -0.22 0.37 -0.02 -1.26 -4.78 135.00 130.20 1oja n PRO 265 Ca -0.08 0.48 0.02 0.00 -2.02 0.00 0.00 63.50 61.89 1oja n PRO 265 Cb 0.58 -1.86 0.11 0.00 -0.02 0.00 0.00 33.50 32.32 1oja n PRO 265 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1oja h PRO 266 N 1.97 0.11 0.00 0.52 0.11 -1.94 0.13 132.00 132.91 1oja h PRO 266 Ca -0.40 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.67 1oja h PRO 266 Cb 1.34 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 1oja h PRO 266 CO 0.60 0.08 -0.19 0.00 -0.21 0.00 0.00 178.00 178.28 1oja h THR 267 N 0.12 0.73 0.00 -1.15 1.03 -1.75 -1.23 112.91 110.65 1oja h THR 267 Ca 0.34 -0.78 0.00 0.00 -0.01 0.00 0.00 66.41 65.96 1oja h THR 267 Cb 0.56 1.48 0.00 0.00 -1.07 0.00 0.00 68.15 69.12 1oja h THR 267 CO -0.56 0.19 0.00 0.18 -0.01 0.00 0.00 175.52 175.32 1oja n LEU 268 N -3.73 0.00 0.33 0.00 4.77 0.03 -1.22 117.00 117.19 1oja n LEU 268 Ca -0.02 0.50 0.20 0.00 -0.03 0.00 0.00 56.01 56.66 1oja n LEU 268 Cb 0.30 -0.50 1.05 0.00 -2.33 0.00 0.00 43.42 41.94 1oja n LEU 268 CO 0.33 -0.22 1.16 1.23 -1.33 0.00 0.00 177.39 178.56 1oja h GLY 269 N 2.78 0.00 2.00 -0.72 0.00 -1.22 -2.06 103.07 103.85 1oja h GLY 269 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1oja h GLY 269 CO 0.00 0.00 -0.10 -0.33 0.00 0.00 0.00 176.54 176.11 1oja h MET 270 N 0.00 0.00 0.00 4.80 2.86 -1.36 -2.45 114.93 118.78 1oja h MET 270 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1oja h MET 270 Cb 0.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1oja h MET 270 CO -0.00 0.10 0.00 1.63 1.06 0.00 0.00 176.91 179.70 1oja n LYS 271 N -3.52 0.53 -4.55 1.72 5.02 -0.77 -4.69 118.16 111.90 1oja n LYS 271 Ca -0.02 0.03 -0.34 0.00 -2.02 0.00 0.00 58.31 55.97 1oja n LYS 271 Cb 0.24 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.63 1oja n LYS 271 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1oja s ILE 272 N -2.35 3.67 -0.12 -0.18 1.01 -0.92 -4.56 121.20 117.75 1oja s ILE 272 Ca 0.29 -0.45 -0.18 0.00 0.00 0.00 0.00 60.65 60.31 1oja s ILE 272 Cb 0.17 -2.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 1oja s ILE 272 CO 0.34 0.53 0.47 -1.00 0.00 0.00 0.00 174.94 175.29 1oja s HIS 273 N 0.01 3.52 -0.10 3.97 3.76 0.28 -4.93 115.29 121.79 1oja s HIS 273 Ca -0.01 0.89 -0.01 0.00 -0.15 0.00 0.00 55.06 55.78 1oja s HIS 273 Cb -0.14 -2.54 -0.03 0.00 1.11 0.00 0.00 32.58 30.98 1oja s HIS 273 CO 0.03 0.18 -0.03 -0.06 -0.85 0.00 0.00 174.74 174.01 1oja s PHE 274 N 0.58 3.05 -0.10 1.40 0.40 -1.26 -1.79 117.98 120.25 1oja s PHE 274 Ca 0.26 0.01 -0.01 0.00 -0.60 0.00 0.00 56.93 56.58 1oja s PHE 274 Cb -0.15 -1.81 0.03 0.00 0.51 0.00 0.00 43.02 41.60 1oja s PHE 274 CO 0.10 0.29 -0.01 1.21 0.70 0.00 0.00 175.22 177.51 1oja s ASN 275 N -0.52 1.94 1.09 1.36 2.47 -0.32 -3.33 114.94 117.63 1oja s ASN 275 Ca 0.08 -0.25 -0.14 0.00 0.42 0.00 0.00 52.86 52.97 1oja s ASN 275 Cb -0.12 -0.57 0.23 0.00 -1.45 0.00 0.00 41.25 39.35 1oja s ASN 275 CO 0.02 -0.19 1.08 -2.16 -3.72 0.00 0.00 177.10 172.13 1oja s PRO 276 N 1.89 -0.29 0.73 0.43 0.04 -1.26 0.42 135.00 136.95 1oja s PRO 276 Ca 0.04 0.40 -0.16 0.00 0.04 0.00 0.00 61.00 61.33 1oja s PRO 276 Cb -0.13 -1.66 0.02 0.00 0.04 0.00 0.00 34.50 32.77 1oja s PRO 276 CO -0.06 -3.19 1.06 -2.30 0.04 0.00 0.00 177.00 172.54 1oja n PRO 277 N -4.48 0.51 -1.41 0.56 -0.02 -1.21 -4.93 135.00 124.02 1oja n PRO 277 Ca 0.06 0.24 -0.35 0.00 -2.02 0.00 0.00 63.50 61.43 1oja n PRO 277 Cb 0.58 -2.31 0.10 0.00 -0.02 0.00 0.00 33.50 31.85 1oja n PRO 277 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1oja s LEU 278 N -3.79 3.32 0.66 2.45 1.43 -1.26 -4.97 118.68 116.53 1oja s LEU 278 Ca 0.74 2.42 -0.17 0.00 -1.03 0.00 0.00 54.13 56.09 1oja s LEU 278 Cb -0.34 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.28 1oja s LEU 278 CO 0.49 -2.33 1.15 -2.65 0.23 0.00 0.00 176.35 173.25 1oja n PRO 279 N -2.70 0.90 -0.28 1.29 -0.02 -1.26 -4.64 135.00 128.28 1oja n PRO 279 Ca 0.14 0.36 0.10 0.00 -2.02 0.00 0.00 63.50 62.08 1oja n PRO 279 Cb 0.50 -2.39 0.25 0.00 -0.02 0.00 0.00 33.50 31.84 1oja n PRO 279 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1oja h MET 280 N 0.30 0.20 -0.35 -0.52 1.85 -1.99 -0.70 114.93 113.72 1oja h MET 280 Ca -0.50 -0.01 -0.09 0.00 -0.61 0.00 0.00 59.70 58.50 1oja h MET 280 Cb 1.34 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 33.32 1oja h MET 280 CO 0.51 0.13 -0.12 0.52 -0.40 0.00 0.00 176.91 177.55 1oja h MET 281 N 0.21 0.70 -0.37 0.39 2.86 -2.00 -1.79 114.93 114.93 1oja h MET 281 Ca 0.50 -0.28 -0.14 0.00 -2.06 0.00 0.00 59.70 57.71 1oja h MET 281 Cb 0.96 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 1oja h MET 281 CO -0.63 0.88 -0.34 -0.09 1.06 0.00 0.00 176.91 177.78 1oja h ARG 282 N 0.49 0.84 -0.69 1.72 2.43 -1.82 0.36 114.38 117.70 1oja h ARG 282 Ca 0.08 -0.41 0.12 0.00 -0.81 0.00 0.00 59.98 58.96 1oja h ARG 282 Cb 0.64 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.11 1oja h ARG 282 CO 0.04 1.05 0.27 -0.97 -1.51 0.00 0.00 179.97 178.84 1oja h ASN 283 N 0.70 0.25 0.69 -3.80 -1.24 -0.85 -2.17 115.58 109.16 1oja h ASN 283 Ca 0.07 0.09 -0.26 0.00 0.71 0.00 0.00 56.30 56.91 1oja h ASN 283 Cb 0.90 0.07 -0.01 0.00 0.73 0.00 0.00 38.32 40.02 1oja h ASN 283 CO 0.08 0.12 -1.27 1.56 -1.29 0.00 0.00 177.43 176.64 1oja h GLN 284 N 0.43 0.17 -0.83 6.67 4.20 -1.26 -3.35 115.11 121.14 1oja h GLN 284 Ca 0.36 -0.30 0.05 0.00 0.06 0.00 0.00 58.65 58.82 1oja h GLN 284 Cb 0.51 0.11 -0.06 0.00 0.30 0.00 0.00 27.48 28.34 1oja h GLN 284 CO -0.36 1.09 0.52 1.98 -0.67 0.00 0.00 178.83 181.39 1oja h MET 285 N 0.05 0.96 0.00 1.46 4.05 -0.31 -2.07 114.93 119.06 1oja h MET 285 Ca -0.13 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 1oja h MET 285 Cb 1.93 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 32.51 1oja h MET 285 CO 0.17 0.63 0.00 0.44 0.23 0.00 0.00 176.91 178.38 1oja n ILE 286 N -4.61 0.21 0.94 1.77 -5.35 -0.90 -1.02 119.36 110.41 1oja n ILE 286 Ca 0.11 0.05 0.12 0.00 -0.27 0.00 0.00 62.75 62.76 1oja n ILE 286 Cb 0.13 -0.73 0.11 0.00 -1.74 0.00 0.00 39.64 37.41 1oja n ILE 286 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1oja n THR 287 N -1.15 0.04 -0.02 7.28 -2.24 -0.78 -4.28 114.28 113.13 1oja n THR 287 Ca 0.12 -0.52 0.03 0.00 -2.27 0.00 0.00 64.05 61.41 1oja n THR 287 Cb 0.12 1.46 0.07 0.00 -2.10 0.00 0.00 70.33 69.87 1oja n THR 287 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oja n ARG 288 N 1.35 2.28 -3.51 -0.78 1.74 -0.18 -4.89 116.66 112.66 1oja n ARG 288 Ca 0.14 -1.60 -0.27 0.00 -0.77 0.00 0.00 57.85 55.36 1oja n ARG 288 Cb 0.59 -1.14 -0.10 0.00 -1.02 0.00 0.00 32.46 30.79 1oja n ARG 288 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1oja n VAL 289 N 0.11 -0.21 -1.60 1.55 0.24 -1.24 -4.48 118.33 112.69 1oja n VAL 289 Ca 0.06 -3.97 -0.30 0.00 -2.04 0.00 0.00 64.34 58.09 1oja n VAL 289 Cb 0.30 -1.85 0.09 0.00 -1.47 0.00 0.00 33.84 30.91 1oja n VAL 289 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1oja s PRO 290 N -0.62 2.09 0.18 7.34 0.04 -1.24 -4.33 135.00 138.47 1oja s PRO 290 Ca 0.31 0.57 0.04 0.00 0.04 0.00 0.00 61.00 61.97 1oja s PRO 290 Cb 0.04 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 1oja s PRO 290 CO -0.17 -1.60 0.25 -0.51 0.04 0.00 0.00 177.00 175.01 1oja s LEU 291 N -5.75 4.14 0.00 -3.56 1.02 -1.26 -0.48 118.68 112.79 1oja s LEU 291 Ca 0.61 0.03 -0.17 0.00 0.02 0.00 0.00 54.13 54.61 1oja s LEU 291 Cb -0.14 -2.71 0.25 0.00 0.02 0.00 0.00 46.19 43.61 1oja s LEU 291 CO 0.54 0.02 0.94 0.61 0.02 0.00 0.00 176.35 178.47 1oja n GLY 292 N -0.75 -2.62 3.03 -3.19 0.00 -0.73 -4.77 105.19 96.16 1oja n GLY 292 Ca -0.08 -1.50 -0.26 0.00 0.00 0.00 0.00 46.02 44.17 1oja n GLY 292 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oja s SER 293 N -4.07 2.09 -0.19 1.61 0.01 -0.51 -2.03 113.70 110.61 1oja s SER 293 Ca 0.60 -0.35 -0.24 0.00 1.31 0.00 0.00 55.95 57.27 1oja s SER 293 Cb -0.06 -0.94 0.06 0.00 0.21 0.00 0.00 66.02 65.30 1oja s SER 293 CO 0.46 0.02 0.63 0.54 0.41 0.00 0.00 173.24 175.30 1oja s VAL 294 N 0.83 0.00 -0.20 3.43 0.11 -1.26 -0.35 120.40 122.96 1oja s VAL 294 Ca -0.11 -0.03 -0.03 0.00 -2.93 0.00 0.00 61.98 58.88 1oja s VAL 294 Cb -0.15 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 33.79 1oja s VAL 294 CO 0.02 -0.01 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.09 1oja s ILE 295 N -0.07 3.41 -0.18 7.04 1.01 -0.53 -1.92 121.20 129.94 1oja s ILE 295 Ca -0.03 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 59.97 1oja s ILE 295 Cb -0.04 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1oja s ILE 295 CO 0.03 0.44 0.40 -0.75 0.00 0.00 0.00 174.94 175.06 1oja s LYS 296 N 1.22 4.21 -0.05 2.79 2.20 -0.44 -1.00 119.74 128.67 1oja s LYS 296 Ca 0.03 0.23 0.03 0.00 -0.36 0.00 0.00 55.97 55.89 1oja s LYS 296 Cb -0.14 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.67 1oja s LYS 296 CO -0.01 0.02 -0.13 0.00 -0.36 0.00 0.00 175.35 174.87 1oja s ILE 298 N 0.45 1.35 -0.21 0.00 1.09 0.94 -0.39 121.20 124.43 1oja s ILE 298 Ca -0.10 -0.73 -0.09 0.00 -1.10 0.00 0.00 60.65 58.62 1oja s ILE 298 Cb -0.14 -1.44 -0.05 0.00 -1.06 0.00 0.00 42.46 39.77 1oja s ILE 298 CO 0.03 0.21 0.12 -0.69 -0.10 0.00 0.00 174.94 174.51 1oja s VAL 299 N 1.54 5.13 -0.03 2.92 1.01 -0.50 -1.41 120.40 129.05 1oja s VAL 299 Ca 0.01 0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1oja s VAL 299 Cb -0.15 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1oja s VAL 299 CO -0.08 0.40 0.14 -0.31 0.00 0.00 0.00 175.10 175.25 1oja s TYR 300 N 0.72 3.48 0.18 5.22 1.51 -0.28 -0.81 117.35 127.36 1oja s TYR 300 Ca 0.06 0.35 0.02 0.00 -1.01 0.00 0.00 57.07 56.50 1oja s TYR 300 Cb -0.13 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.85 1oja s TYR 300 CO 0.02 0.64 -0.01 0.71 -1.11 0.00 0.00 175.55 175.79 1oja s TYR 301 N -1.21 1.26 0.20 2.71 1.51 0.42 -0.64 117.35 121.60 1oja s TYR 301 Ca 0.23 -0.97 -0.12 0.00 -1.01 0.00 0.00 57.07 55.21 1oja s TYR 301 Cb -0.12 -0.72 0.12 0.00 -0.11 0.00 0.00 41.96 41.13 1oja s TYR 301 CO 0.14 -0.15 1.86 -0.22 -1.11 0.00 0.00 175.55 176.07 1oja h LYS 302 N 2.68 0.89 -4.41 -0.62 3.64 -1.85 -3.30 116.57 113.60 1oja h LYS 302 Ca -0.37 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 58.76 1oja h LYS 302 Cb 1.20 -0.20 -0.17 0.00 -0.41 0.00 0.00 32.23 32.66 1oja h LYS 302 CO 0.63 0.60 -0.70 -1.21 -2.27 0.00 0.00 179.45 176.51 1oja s GLU 303 N -6.10 0.63 -1.26 1.90 2.02 -1.26 -4.65 118.70 109.98 1oja s GLU 303 Ca -0.13 -1.09 -0.15 0.00 0.02 0.00 0.00 54.97 53.62 1oja s GLU 303 Cb 0.14 -0.05 -0.04 0.00 0.10 0.00 0.00 34.13 34.29 1oja s GLU 303 CO 0.77 -0.04 2.24 -0.35 0.02 0.00 0.00 175.26 177.90 1oja n PRO 304 N 0.51 2.55 0.30 0.39 -0.04 -1.26 -4.75 135.00 132.71 1oja n PRO 304 Ca -0.16 -2.26 0.15 0.00 -0.04 0.00 0.00 63.50 61.19 1oja n PRO 304 Cb 0.59 -3.07 0.92 0.00 -0.04 0.00 0.00 33.50 31.91 1oja n PRO 304 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1oja h PHE 305 N 6.39 0.00 -0.05 0.54 -0.00 -1.97 -1.21 116.94 120.64 1oja h PHE 305 Ca 0.57 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.50 1oja h PHE 305 Cb 0.56 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.51 1oja h PHE 305 CO 1.50 0.01 -0.13 0.11 -0.00 0.00 0.00 178.31 179.80 1oja h TRP 306 N 0.00 0.08 0.00 6.09 0.09 -1.85 -2.16 115.95 118.20 1oja h TRP 306 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 58.89 58.97 1oja h TRP 306 Cb 0.01 -0.02 -0.00 0.00 0.08 0.00 0.00 29.16 29.23 1oja h TRP 306 CO 0.00 0.20 -0.02 0.00 0.09 0.00 0.00 178.44 178.72 1oja h ARG 307 N 0.07 0.00 0.00 0.12 3.08 -1.11 -1.48 114.38 115.07 1oja h ARG 307 Ca 0.02 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1oja h ARG 307 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1oja h ARG 307 CO 0.02 0.02 -0.19 0.87 -1.07 0.00 0.00 179.97 179.62 1oja h LYS 308 N 0.00 0.00 -0.63 0.04 1.57 -1.55 -1.44 116.57 114.56 1oja h LYS 308 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1oja h LYS 308 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1oja h LYS 308 CO 0.00 0.19 0.00 1.63 -0.57 0.00 0.00 179.45 180.70 1oja n LYS 309 N -3.40 2.85 -3.51 3.15 5.02 -0.64 -4.93 118.16 116.70 1oja n LYS 309 Ca -0.00 -2.31 -0.23 0.00 -2.02 0.00 0.00 58.31 53.75 1oja n LYS 309 Cb 0.38 -1.63 0.07 0.00 -0.02 0.00 0.00 35.03 33.84 1oja n LYS 309 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1oja n ASP 310 N 1.13 -6.17 -4.42 4.39 2.03 -0.54 -4.98 116.55 107.98 1oja n ASP 310 Ca 0.21 -0.50 -0.33 0.00 0.52 0.00 0.00 54.79 54.70 1oja n ASP 310 Cb 0.64 -4.80 -0.14 0.00 -0.72 0.00 0.00 41.12 36.10 1oja n ASP 310 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1oja s TYR 311 N -3.29 2.70 -0.48 -0.67 4.12 -0.71 -1.34 117.35 117.68 1oja s TYR 311 Ca 0.54 -0.35 0.24 0.00 0.02 0.00 0.00 57.07 57.51 1oja s TYR 311 Cb -0.24 -1.68 0.38 0.00 -1.52 0.00 0.00 41.96 38.90 1oja s TYR 311 CO 0.67 0.03 1.55 0.00 0.02 0.00 0.00 175.55 177.82 1oja n GLY 313 N 1.16 1.24 3.69 0.00 0.00 -1.26 -4.37 105.19 105.64 1oja n GLY 313 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1oja n GLY 313 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oja s THR 314 N -2.04 4.62 -0.06 2.61 2.01 -1.26 -3.86 115.64 117.66 1oja s THR 314 Ca 0.00 1.90 0.02 0.00 0.31 0.00 0.00 61.69 63.92 1oja s THR 314 Cb 0.00 -4.22 0.01 0.00 0.01 0.00 0.00 72.50 68.30 1oja s THR 314 CO 0.00 0.00 -0.10 -0.04 -0.69 0.00 0.00 174.62 173.79 1oja s MET 315 N 2.06 1.43 -0.29 4.92 1.00 -1.12 -1.24 119.30 126.06 1oja s MET 315 Ca 0.51 -0.34 -0.04 0.00 0.00 0.00 0.00 55.69 55.82 1oja s MET 315 Cb -0.20 -1.23 0.03 0.00 0.00 0.00 0.00 34.83 33.43 1oja s MET 315 CO 0.19 0.02 0.02 0.42 0.00 0.00 0.00 175.02 175.67 1oja s ILE 316 N 0.65 3.29 -0.26 2.53 1.01 0.54 -1.52 121.20 127.46 1oja s ILE 316 Ca -0.13 -1.10 0.03 0.00 0.00 0.00 0.00 60.65 59.45 1oja s ILE 316 Cb -0.15 -2.79 0.06 0.00 0.01 0.00 0.00 42.46 39.59 1oja s ILE 316 CO 0.03 0.01 -0.11 -0.63 0.00 0.00 0.00 174.94 174.23 1oja s ILE 317 N 1.35 2.22 0.49 2.92 1.01 0.47 -0.21 121.20 129.45 1oja s ILE 317 Ca -0.01 -1.58 -0.06 0.00 0.00 0.00 0.00 60.65 59.00 1oja s ILE 317 Cb -0.18 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1oja s ILE 317 CO -0.01 0.00 0.80 -0.62 0.00 0.00 0.00 174.94 175.12 1oja s ASP 318 N 1.12 6.27 0.00 3.58 -1.08 -0.30 -4.46 116.67 121.80 1oja s ASP 318 Ca -0.08 0.96 0.00 0.00 -0.52 0.00 0.00 52.55 52.91 1oja s ASP 318 Cb -0.20 -2.26 0.00 0.00 -1.46 0.00 0.00 42.92 39.00 1oja s ASP 318 CO -0.05 -0.59 0.00 0.61 0.52 0.00 0.00 175.17 175.66 1oja n GLY 319 N -2.27 2.84 0.24 2.66 0.00 -1.26 -4.72 105.19 102.68 1oja n GLY 319 Ca 0.01 -1.81 -0.06 0.00 0.00 0.00 0.00 46.02 44.15 1oja n GLY 319 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1oja h GLU 320 N 0.00 0.60 -0.00 1.61 4.57 -2.03 -3.24 114.58 116.09 1oja h GLU 320 Ca 0.00 -0.26 -0.09 0.00 -1.18 0.00 0.00 59.36 57.83 1oja h GLU 320 Cb 0.00 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1oja h GLU 320 CO 0.00 0.83 -0.44 0.93 -1.18 0.00 0.00 179.01 179.16 1oja h GLU 321 N 0.51 0.00 -6.29 1.92 3.07 -2.00 -3.43 114.58 108.37 1oja h GLU 321 Ca 0.06 -0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.37 1oja h GLU 321 Cb 0.78 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.68 1oja h GLU 321 CO 0.06 0.44 0.84 0.00 -1.40 0.00 0.00 179.01 178.96 1oja s ALA 322 N -4.04 3.58 0.33 3.43 0.00 -1.22 -4.90 121.76 118.94 1oja s ALA 322 Ca -0.02 0.71 0.03 0.00 0.00 0.00 0.00 51.96 52.68 1oja s ALA 322 Cb 0.14 -3.60 0.58 0.00 0.00 0.00 0.00 23.12 20.24 1oja s ALA 322 CO 0.74 -0.99 1.89 -1.00 0.00 0.00 0.00 175.76 176.40 1oja h PRO 323 N 8.01 0.62 -5.27 0.00 0.13 -1.90 -3.42 132.00 130.17 1oja h PRO 323 Ca -0.34 -0.11 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 1oja h PRO 323 Cb 1.16 -0.10 -0.30 0.00 0.13 0.00 0.00 31.00 31.89 1oja h PRO 323 CO 0.92 0.58 -0.81 0.08 -0.23 0.00 0.00 178.00 178.54 1oja s VAL 324 N -5.13 2.65 -0.63 1.56 1.01 -1.26 -4.33 120.40 114.27 1oja s VAL 324 Ca -0.08 -0.79 0.22 0.00 0.00 0.00 0.00 61.98 61.32 1oja s VAL 324 Cb 0.16 -2.10 -0.25 0.00 0.00 0.00 0.00 36.38 34.20 1oja s VAL 324 CO 0.77 0.53 0.79 0.00 0.00 0.00 0.00 175.10 177.19 1oja n ALA 325 N 3.75 3.93 -3.43 5.51 0.00 -1.19 -4.68 120.51 124.40 1oja n ALA 325 Ca -0.19 -0.54 -0.12 0.00 0.00 0.00 0.00 53.44 52.59 1oja n ALA 325 Cb 0.52 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 19.08 1oja n ALA 325 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1oja s TYR 326 N -3.19 -0.51 0.10 0.00 5.04 -1.26 -0.40 117.35 117.12 1oja s TYR 326 Ca 0.02 1.20 0.02 0.00 -2.44 0.00 0.00 57.07 55.87 1oja s TYR 326 Cb 0.15 0.20 -0.04 0.00 0.35 0.00 0.00 41.96 42.62 1oja s TYR 326 CO 0.87 -0.26 -0.07 0.95 -1.34 0.00 0.00 175.55 175.69 1oja s THR 327 N 0.58 0.75 0.06 4.34 -4.23 -0.57 -2.15 115.64 114.42 1oja s THR 327 Ca -0.03 -1.83 0.02 0.00 -1.18 0.00 0.00 61.69 58.66 1oja s THR 327 Cb -0.05 -1.56 -0.03 0.00 1.34 0.00 0.00 72.50 72.20 1oja s THR 327 CO -0.04 -0.78 -0.07 -0.76 -0.54 0.00 0.00 174.62 172.44 1oja s LEU 328 N -2.85 2.35 0.11 4.79 1.43 -0.28 -2.80 118.68 121.43 1oja s LEU 328 Ca 0.09 -0.73 -0.31 0.00 -1.03 0.00 0.00 54.13 52.16 1oja s LEU 328 Cb 0.03 -0.08 -0.09 0.00 0.03 0.00 0.00 46.19 46.08 1oja s LEU 328 CO -0.03 -0.33 1.54 -0.62 0.23 0.00 0.00 176.35 177.14 1oja s ASP 329 N -2.14 6.67 -0.10 2.29 -1.08 -1.25 -0.54 116.67 120.52 1oja s ASP 329 Ca -0.02 2.46 0.14 0.00 -0.52 0.00 0.00 52.55 54.60 1oja s ASP 329 Cb -0.04 -2.58 0.34 0.00 -1.46 0.00 0.00 42.92 39.19 1oja s ASP 329 CO -0.02 -0.80 1.25 -0.67 0.52 0.00 0.00 175.17 175.45 1oja n ASP 330 N 4.63 2.99 -4.76 -0.34 2.03 0.29 -4.50 116.55 116.89 1oja n ASP 330 Ca 0.14 -2.69 -0.40 0.00 0.52 0.00 0.00 54.79 52.35 1oja n ASP 330 Cb 0.40 -0.37 0.02 0.00 -0.72 0.00 0.00 41.12 40.45 1oja n ASP 330 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1oja n THR 331 N -0.58 2.77 -1.60 5.18 -1.04 -1.20 -4.56 114.28 113.25 1oja n THR 331 Ca 0.15 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.32 1oja n THR 331 Cb 0.64 -1.85 0.07 0.00 -1.82 0.00 0.00 70.33 67.37 1oja n THR 331 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1oja s LYS 332 N -2.44 2.45 0.54 -2.82 -0.14 -0.71 -4.88 119.74 111.74 1oja s LYS 332 Ca 0.61 1.61 0.24 0.00 -1.36 0.00 0.00 55.97 57.07 1oja s LYS 332 Cb -0.45 -1.89 1.40 0.00 -1.68 0.00 0.00 37.83 35.21 1oja s LYS 332 CO 0.58 -1.56 2.04 -1.00 -0.76 0.00 0.00 175.35 174.64 1oja h PRO 333 N -0.09 0.00 0.00 -1.68 0.13 -1.93 0.15 132.00 128.58 1oja h PRO 333 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1oja h PRO 333 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1oja h PRO 333 CO 0.52 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.22 1oja h GLU 334 N 0.00 0.00 0.00 0.86 3.07 -2.02 -3.46 114.58 113.03 1oja h GLU 334 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 1oja h GLU 334 Cb 0.75 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 1oja h GLU 334 CO -0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1oja n GLY 335 N 0.40 0.47 3.97 -3.84 0.00 0.54 -5.07 105.19 101.66 1oja n GLY 335 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1oja n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oja s ASN 336 N -2.74 4.82 -1.44 1.61 2.20 -1.26 -4.53 114.94 113.61 1oja s ASN 336 Ca 0.00 -1.09 -0.03 0.00 -0.94 0.00 0.00 52.86 50.80 1oja s ASN 336 Cb 0.00 0.44 0.02 0.00 -2.00 0.00 0.00 41.25 39.71 1oja s ASN 336 CO 0.00 -1.26 0.54 -1.22 -2.94 0.00 0.00 177.10 172.22 1oja n TYR 337 N -2.02 -1.74 -1.61 1.54 4.02 -1.26 -1.73 117.16 114.36 1oja n TYR 337 Ca 0.07 0.78 -0.46 0.00 -0.01 0.00 0.00 57.90 58.27 1oja n TYR 337 Cb 0.63 -3.76 -0.03 0.00 -0.02 0.00 0.00 39.34 36.16 1oja n TYR 337 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1oja n ALA 338 N -4.40 -0.09 -3.51 -0.72 0.00 -1.24 -4.13 120.51 106.41 1oja n ALA 338 Ca -0.24 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.47 1oja n ALA 338 Cb 0.65 -2.09 -0.05 0.00 0.00 0.00 0.00 19.45 17.96 1oja n ALA 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oja s ALA 339 N -0.44 -1.78 -0.16 0.00 0.00 -1.26 -0.44 121.76 117.68 1oja s ALA 339 Ca 0.67 1.23 -0.01 0.00 0.00 0.00 0.00 51.96 53.85 1oja s ALA 339 Cb -0.75 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 1oja s ALA 339 CO 0.54 -0.43 -0.11 0.42 0.00 0.00 0.00 175.76 176.18 1oja s ILE 340 N -1.64 3.05 -0.12 0.00 -1.09 0.01 -0.55 121.20 120.85 1oja s ILE 340 Ca -0.07 -0.64 -0.17 0.00 -2.23 0.00 0.00 60.65 57.54 1oja s ILE 340 Cb -0.00 -2.31 -0.04 0.00 -1.58 0.00 0.00 42.46 38.52 1oja s ILE 340 CO 0.04 0.50 0.44 -0.32 -1.23 0.00 0.00 174.94 174.37 1oja s MET 341 N 0.73 4.32 0.07 2.79 -2.45 0.30 -1.41 119.30 123.65 1oja s MET 341 Ca -0.05 0.38 0.03 0.00 -1.25 0.00 0.00 55.69 54.79 1oja s MET 341 Cb -0.15 -3.43 -0.03 0.00 1.25 0.00 0.00 34.83 32.47 1oja s MET 341 CO 0.02 0.18 -0.08 0.20 1.05 0.00 0.00 175.02 176.39 1oja s GLY 342 N 0.56 0.67 -0.14 2.11 0.00 0.47 -1.12 107.32 109.87 1oja s GLY 342 Ca 0.24 -1.03 -0.04 0.00 0.00 0.00 0.00 44.72 43.90 1oja s GLY 342 CO 0.09 -1.10 -0.02 -1.36 0.00 0.00 0.00 173.10 170.71 1oja s PHE 343 N -2.21 3.06 -0.36 1.90 2.99 -0.91 -1.05 117.98 121.40 1oja s PHE 343 Ca -0.00 -0.17 -0.15 0.00 0.00 0.00 0.00 56.93 56.60 1oja s PHE 343 Cb -0.04 -1.93 -0.01 0.00 0.00 0.00 0.00 43.02 41.04 1oja s PHE 343 CO -0.01 0.07 0.37 0.42 -0.00 0.00 0.00 175.22 176.08 1oja s ILE 344 N 0.12 5.16 -0.11 0.64 1.01 -0.17 -3.15 121.20 124.71 1oja s ILE 344 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 60.65 60.56 1oja s ILE 344 Cb -0.13 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 1oja s ILE 344 CO 0.02 -0.15 0.05 -0.76 0.00 0.00 0.00 174.94 174.10 1oja s LEU 345 N 2.02 3.83 0.00 2.97 1.43 -1.26 -1.46 118.68 126.22 1oja s LEU 345 Ca 0.11 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 1oja s LEU 345 Cb -0.17 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.14 1oja s LEU 345 CO 0.12 0.35 0.00 0.00 0.23 0.00 0.00 176.35 177.05 1oja n ALA 346 N 2.32 0.00 0.19 4.21 0.00 0.52 -1.45 120.51 126.30 1oja n ALA 346 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.38 1oja n ALA 346 Cb 0.54 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.68 1oja n ALA 346 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1oja h HIS 347 N 0.00 0.00 0.00 0.00 2.07 -1.90 -0.27 115.15 115.04 1oja h HIS 347 Ca 0.00 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 1oja h HIS 347 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 1oja h HIS 347 CO 0.00 0.00 -0.37 0.87 -3.07 0.00 0.00 177.93 175.36 1oja h LYS 348 N 0.00 0.00 -0.45 5.12 1.57 -1.60 0.11 116.57 121.32 1oja h LYS 348 Ca 0.07 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 1oja h LYS 348 Cb 0.31 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1oja h LYS 348 CO -0.00 0.37 -0.06 0.00 -0.57 0.00 0.00 179.45 179.19 1oja h ALA 349 N 1.63 1.05 -0.16 3.86 0.00 -1.09 -0.09 119.26 124.47 1oja h ALA 349 Ca -0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1oja h ALA 349 Cb 0.70 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1oja h ALA 349 CO 0.05 0.58 -0.27 0.00 0.00 0.00 0.00 179.25 179.61 1oja h ARG 350 N 0.72 0.47 -0.40 0.00 -0.00 -1.27 -2.66 114.38 111.24 1oja h ARG 350 Ca 0.13 -0.29 -0.02 0.00 -0.50 0.00 0.00 59.98 59.30 1oja h ARG 350 Cb 0.52 0.03 -0.02 0.00 0.00 0.00 0.00 29.97 30.50 1oja h ARG 350 CO 0.03 0.89 0.16 -0.22 0.00 0.00 0.00 179.97 180.83 1oja h LYS 351 N 0.11 0.60 -0.02 0.04 3.64 -0.61 -3.22 116.57 117.12 1oja h LYS 351 Ca 0.01 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1oja h LYS 351 Cb 0.85 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1oja h LYS 351 CO 0.06 0.57 -0.19 1.28 -2.27 0.00 0.00 179.45 178.90 1oja n LEU 352 N -4.64 1.84 0.23 5.20 4.77 -0.06 -4.07 117.00 120.27 1oja n LEU 352 Ca -0.00 -0.61 0.07 0.00 -0.03 0.00 0.00 56.01 55.44 1oja n LEU 352 Cb 0.15 -0.03 0.56 0.00 -2.33 0.00 0.00 43.42 41.76 1oja n LEU 352 CO 0.37 0.32 0.93 0.00 -1.33 0.00 0.00 177.39 177.68 1oja h ALA 353 N 4.13 1.63 -0.10 -1.18 0.00 -1.47 -2.67 119.26 119.59 1oja h ALA 353 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1oja h ALA 353 Cb 0.68 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1oja h ALA 353 CO 0.00 0.20 -0.14 0.00 0.00 0.00 0.00 179.25 179.31 1oja h ARG 354 N 0.00 0.16 -7.27 0.00 3.08 -1.77 -3.45 114.38 105.14 1oja h ARG 354 Ca -0.00 -0.04 -0.50 0.00 0.07 0.00 0.00 59.98 59.51 1oja h ARG 354 Cb 0.30 -0.02 0.18 0.00 0.08 0.00 0.00 29.97 30.51 1oja h ARG 354 CO 0.02 0.31 0.21 -0.51 -1.07 0.00 0.00 179.97 178.93 1oja s LEU 355 N -8.73 2.48 0.69 3.04 1.43 -1.01 -5.03 118.68 111.55 1oja s LEU 355 Ca -0.05 1.93 -0.11 0.00 -1.03 0.00 0.00 54.13 54.87 1oja s LEU 355 Cb 0.16 -4.29 0.01 0.00 0.03 0.00 0.00 46.19 42.09 1oja s LEU 355 CO 0.72 -3.04 1.08 0.42 0.23 0.00 0.00 176.35 175.76 1oja s THR 356 N -2.70 3.60 0.24 5.49 -4.23 -1.26 -4.90 115.64 111.89 1oja s THR 356 Ca 0.66 0.49 -0.04 0.00 -1.18 0.00 0.00 61.69 61.62 1oja s THR 356 Cb -0.21 -3.51 0.21 0.00 1.34 0.00 0.00 72.50 70.32 1oja s THR 356 CO 0.59 -0.67 1.80 0.50 -0.54 0.00 0.00 174.62 176.30 1oja h LYS 357 N -0.60 0.73 -0.41 3.99 3.64 -1.96 -1.33 116.57 120.63 1oja h LYS 357 Ca -0.45 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 58.79 1oja h LYS 357 Cb 1.25 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1oja h LYS 357 CO 0.63 0.48 -0.13 0.93 -2.27 0.00 0.00 179.45 179.10 1oja h GLU 358 N 0.75 0.75 -0.60 1.90 3.07 -1.99 -0.92 114.58 117.54 1oja h GLU 358 Ca 0.40 -0.25 -0.10 0.00 -0.50 0.00 0.00 59.36 58.90 1oja h GLU 358 Cb 0.38 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 1oja h GLU 358 CO -0.26 0.84 -0.02 0.93 -1.40 0.00 0.00 179.01 179.10 1oja h GLU 359 N 0.67 1.08 -0.44 2.33 5.08 -1.74 -1.60 114.58 119.96 1oja h GLU 359 Ca 0.11 -0.35 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 1oja h GLU 359 Cb 0.60 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1oja h GLU 359 CO 0.04 1.06 -0.01 0.00 -1.00 0.00 0.00 179.01 179.10 1oja h ARG 360 N 0.98 0.79 -0.50 2.33 3.08 -1.07 -2.22 114.38 117.77 1oja h ARG 360 Ca 0.17 -0.26 0.08 0.00 0.07 0.00 0.00 59.98 60.04 1oja h ARG 360 Cb 0.59 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.51 1oja h ARG 360 CO 0.03 0.86 0.15 1.25 -1.07 0.00 0.00 179.97 181.19 1oja h LEU 361 N 0.63 0.12 -0.47 3.04 5.85 -1.00 -0.57 115.31 122.91 1oja h LEU 361 Ca 0.12 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1oja h LEU 361 Cb 0.51 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1oja h LEU 361 CO 0.02 0.09 0.22 0.50 -0.34 0.00 0.00 178.44 178.94 1oja h LYS 362 N 0.31 0.67 -0.69 1.25 3.64 -1.16 -0.64 116.57 119.96 1oja h LYS 362 Ca 0.25 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1oja h LYS 362 Cb 0.29 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1oja h LYS 362 CO -0.28 0.57 0.35 0.87 -2.27 0.00 0.00 179.45 178.69 1oja h LYS 363 N 0.61 0.97 -0.34 1.90 1.57 -0.90 -1.47 116.57 118.91 1oja h LYS 363 Ca 0.16 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 1oja h LYS 363 Cb 0.12 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1oja h LYS 363 CO -0.02 0.75 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.49 1oja h LEU 364 N 0.95 0.62 -0.61 2.94 4.07 -0.87 -1.62 115.31 120.78 1oja h LEU 364 Ca 0.24 -0.34 -0.02 0.00 0.08 0.00 0.00 57.88 57.84 1oja h LEU 364 Cb 0.08 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1oja h LEU 364 CO -0.03 0.82 0.29 0.00 -1.08 0.00 0.00 178.44 178.44 1oja h GLU 366 N 0.84 1.12 0.10 0.00 5.08 -1.23 -0.24 114.58 120.24 1oja h GLU 366 Ca 0.21 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1oja h GLU 366 Cb 0.12 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1oja h GLU 366 CO -0.03 1.01 -0.05 1.25 -1.00 0.00 0.00 179.01 180.19 1oja h LEU 367 N 1.06 -0.11 -1.35 1.33 5.85 -0.95 -2.24 115.31 118.90 1oja h LEU 367 Ca 0.21 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1oja h LEU 367 Cb 0.41 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1oja h LEU 367 CO 0.01 -0.03 0.14 1.88 -0.34 0.00 0.00 178.44 180.10 1oja h TYR 368 N -0.19 0.58 -0.77 1.25 0.99 -0.61 -0.39 116.97 117.84 1oja h TYR 368 Ca -0.01 -0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.66 1oja h TYR 368 Cb 0.15 -0.18 -0.03 0.00 1.00 0.00 0.00 36.73 37.67 1oja h TYR 368 CO -0.05 0.48 0.36 0.00 -0.00 0.00 0.00 178.16 178.94 1oja h ALA 369 N 1.58 0.99 0.02 3.88 0.00 -0.89 0.16 119.26 125.00 1oja h ALA 369 Ca 0.14 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1oja h ALA 369 Cb 0.16 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1oja h ALA 369 CO -0.01 0.56 -0.01 0.87 0.00 0.00 0.00 179.25 180.66 1oja h LYS 370 N 1.08 -0.02 -0.18 0.00 1.57 -0.75 0.22 116.57 118.49 1oja h LYS 370 Ca 0.26 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.86 1oja h LYS 370 Cb 0.13 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.45 1oja h LYS 370 CO -0.03 0.29 -0.60 0.28 -0.57 0.00 0.00 179.45 178.81 1oja h VAL 371 N -0.34 1.30 -0.00 0.50 2.07 -0.84 -2.70 116.25 116.24 1oja h VAL 371 Ca -0.00 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.69 1oja h VAL 371 Cb 0.32 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1oja h VAL 371 CO 0.00 0.58 -0.03 0.18 0.02 0.00 0.00 177.57 178.32 1oja n LEU 372 N -4.07 0.05 -3.61 2.57 4.77 0.54 -4.79 117.00 112.45 1oja n LEU 372 Ca -0.07 0.40 -0.22 0.00 -0.03 0.00 0.00 56.01 56.09 1oja n LEU 372 Cb 0.65 -0.42 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1oja n LEU 372 CO 0.50 0.01 0.13 0.61 -1.33 0.00 0.00 177.39 177.30 1oja n GLY 373 N 1.44 -0.43 2.87 -0.72 0.00 -0.05 -4.99 105.19 103.30 1oja n GLY 373 Ca 0.09 0.17 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 1oja n GLY 373 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oja s SER 374 N -3.84 0.40 0.38 1.61 0.01 -0.52 -5.00 113.70 106.74 1oja s SER 374 Ca 0.31 0.31 0.28 0.00 1.31 0.00 0.00 55.95 58.15 1oja s SER 374 Cb -0.14 0.23 1.24 0.00 0.21 0.00 0.00 66.02 67.56 1oja s SER 374 CO 0.76 -0.20 1.83 -0.07 0.41 0.00 0.00 173.24 175.96 1oja h LEU 375 N 7.90 0.00 -1.94 2.44 3.38 -1.94 -2.68 115.31 122.47 1oja h LEU 375 Ca -0.26 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1oja h LEU 375 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1oja h LEU 375 CO 0.26 0.00 -0.11 -0.33 0.09 0.00 0.00 178.44 178.35 1oja h GLU 376 N 0.00 0.00 0.00 1.13 5.08 -1.96 -1.96 114.58 116.87 1oja h GLU 376 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1oja h GLU 376 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1oja h GLU 376 CO 0.00 0.11 0.00 0.00 -1.00 0.00 0.00 179.01 178.12 1oja h ALA 377 N 1.89 1.00 -0.05 3.43 0.00 -1.80 -2.31 119.26 121.41 1oja h ALA 377 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1oja h ALA 377 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1oja h ALA 377 CO 0.01 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.54 1oja n LEU 378 N -2.85 0.78 -2.94 0.00 4.77 -0.74 -4.34 117.00 111.68 1oja n LEU 378 Ca -0.01 -0.30 -0.27 0.00 -0.03 0.00 0.00 56.01 55.40 1oja n LEU 378 Cb 0.15 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 1oja n LEU 378 CO 0.20 0.15 0.13 -0.62 -1.33 0.00 0.00 177.39 175.93 1oja n GLU 379 N -0.31 3.16 -2.10 3.23 -0.58 -0.87 -5.06 120.64 118.11 1oja n GLU 379 Ca 0.17 -4.80 -0.36 0.00 -0.42 0.00 0.00 57.16 51.75 1oja n GLU 379 Cb 0.21 -2.22 0.02 0.00 -0.57 0.00 0.00 31.44 28.88 1oja n GLU 379 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1oja s PRO 380 N -3.44 3.21 -0.01 3.49 0.04 -1.26 -4.69 135.00 132.34 1oja s PRO 380 Ca 0.49 1.80 0.17 0.00 0.04 0.00 0.00 61.00 63.49 1oja s PRO 380 Cb 0.28 -2.05 -0.23 0.00 0.04 0.00 0.00 34.50 32.54 1oja s PRO 380 CO -0.14 -1.01 0.54 1.33 0.04 0.00 0.00 177.00 177.76 1oja n VAL 381 N -1.29 0.00 -3.59 -0.36 0.24 0.19 -4.99 118.33 108.54 1oja n VAL 381 Ca 0.12 -0.26 -0.07 0.00 -2.04 0.00 0.00 64.34 62.09 1oja n VAL 381 Cb 0.49 0.52 -0.02 0.00 -1.47 0.00 0.00 33.84 33.36 1oja n VAL 381 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1oja s HIS 382 N -2.92 -0.29 -0.14 6.34 5.65 -1.23 -5.01 115.29 117.69 1oja s HIS 382 Ca -0.00 0.08 -0.10 0.00 0.25 0.00 0.00 55.06 55.29 1oja s HIS 382 Cb 0.12 0.58 0.05 0.00 -1.18 0.00 0.00 32.58 32.14 1oja s HIS 382 CO 0.71 -0.68 0.36 -0.47 -0.65 0.00 0.00 174.74 174.01 1oja s TYR 383 N -3.24 -0.46 0.03 3.88 5.04 -1.26 -1.13 117.35 120.21 1oja s TYR 383 Ca 0.07 1.05 0.04 0.00 -2.44 0.00 0.00 57.07 55.79 1oja s TYR 383 Cb -0.01 0.17 -0.02 0.00 0.35 0.00 0.00 41.96 42.45 1oja s TYR 383 CO -0.05 -0.25 -0.12 -1.21 -1.34 0.00 0.00 175.55 172.58 1oja s GLU 384 N 0.78 0.79 0.09 4.97 0.41 -0.50 -5.02 118.70 120.23 1oja s GLU 384 Ca -0.05 -0.66 -0.14 0.00 -0.41 0.00 0.00 54.97 53.72 1oja s GLU 384 Cb -0.06 -0.75 0.02 0.00 -1.78 0.00 0.00 34.13 31.56 1oja s GLU 384 CO -0.06 0.19 0.33 -1.83 -0.49 0.00 0.00 175.26 173.40 1oja s GLU 385 N -1.01 0.94 -0.11 1.61 -1.05 -1.26 -0.04 118.70 117.77 1oja s GLU 385 Ca -0.00 -0.68 -0.05 0.00 -0.15 0.00 0.00 54.97 54.09 1oja s GLU 385 Cb -0.07 0.40 0.05 0.00 -0.44 0.00 0.00 34.13 34.08 1oja s GLU 385 CO 0.01 -0.33 0.23 0.21 0.95 0.00 0.00 175.26 176.33 1oja s LYS 386 N -3.37 0.14 -0.51 -4.83 2.47 -0.29 -5.00 119.74 108.36 1oja s LYS 386 Ca 0.01 0.62 -0.18 0.00 -1.56 0.00 0.00 55.97 54.85 1oja s LYS 386 Cb 0.02 -0.11 0.07 0.00 -1.46 0.00 0.00 37.83 36.34 1oja s LYS 386 CO -0.09 -0.24 0.59 1.21 0.16 0.00 0.00 175.35 176.98 1oja s ASN 387 N 1.94 6.21 0.18 1.43 3.84 -1.26 -1.32 114.94 125.95 1oja s ASN 387 Ca -0.03 -1.04 0.21 0.00 0.21 0.00 0.00 52.86 52.22 1oja s ASN 387 Cb -0.11 -2.27 0.88 0.00 -0.55 0.00 0.00 41.25 39.19 1oja s ASN 387 CO -0.08 -0.87 1.65 0.79 -2.79 0.00 0.00 177.10 175.80 1oja n TRP 388 N 6.01 0.58 0.30 0.43 7.02 -0.81 -2.83 117.44 128.13 1oja n TRP 388 Ca -0.08 0.22 0.18 0.00 -1.02 0.00 0.00 57.50 56.80 1oja n TRP 388 Cb 0.45 -0.86 0.78 0.00 -2.42 0.00 0.00 31.31 29.26 1oja n TRP 388 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1oja n GLU 390 N -3.01 1.23 -2.78 0.00 0.28 -1.13 -4.73 120.64 110.50 1oja n GLU 390 Ca -0.00 -0.71 -0.43 0.00 -0.16 0.00 0.00 57.16 55.86 1oja n GLU 390 Cb 0.25 -1.49 -0.04 0.00 1.43 0.00 0.00 31.44 31.59 1oja n GLU 390 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1oja s GLU 391 N -2.26 3.59 0.32 3.44 0.41 -1.07 -4.92 118.70 118.22 1oja s GLU 391 Ca 0.31 0.27 0.04 0.00 -0.41 0.00 0.00 54.97 55.18 1oja s GLU 391 Cb 0.20 -3.91 0.64 0.00 -1.78 0.00 0.00 34.13 29.28 1oja s GLU 391 CO 0.43 -1.23 1.90 0.37 -0.49 0.00 0.00 175.26 176.23 1oja h GLN 392 N 9.06 0.86 -0.64 1.61 4.15 -1.91 0.00 115.11 128.25 1oja h GLN 392 Ca -0.24 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.13 1oja h GLN 392 Cb 1.07 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.57 1oja h GLN 392 CO 1.04 0.57 0.00 0.66 -1.93 0.00 0.00 178.83 179.17 1oja n TYR 393 N -4.52 1.54 0.00 3.99 4.02 -1.26 -4.25 117.16 116.67 1oja n TYR 393 Ca 0.15 -0.63 0.00 0.00 -0.01 0.00 0.00 57.90 57.41 1oja n TYR 393 Cb 0.29 -0.27 0.00 0.00 -0.02 0.00 0.00 39.34 39.35 1oja n TYR 393 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1oja n SER 394 N 1.07 0.40 0.00 7.72 7.64 -1.00 -4.93 113.62 124.52 1oja n SER 394 Ca 0.26 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.14 1oja n SER 394 Cb 0.92 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.12 1oja n SER 394 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oja n GLY 395 N 3.02 1.41 0.00 0.23 0.00 -0.05 -4.88 105.19 104.93 1oja n GLY 395 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1oja n GLY 395 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oja n GLY 396 N -2.00 0.07 3.43 -0.02 0.00 -1.20 -4.45 105.19 101.01 1oja n GLY 396 Ca 0.00 -1.62 -0.11 0.00 0.00 0.00 0.00 46.02 44.29 1oja n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oja h TYR 398 N 2.10 0.19 -3.31 0.00 0.05 -1.86 -3.04 116.97 111.11 1oja h TYR 398 Ca -0.33 -0.10 -0.11 0.00 0.05 0.00 0.00 58.73 58.24 1oja h TYR 398 Cb 1.29 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.99 1oja h TYR 398 CO 0.27 0.86 0.12 -2.37 -1.05 0.00 0.00 178.16 175.99 1oja n THR 399 N -3.69 0.00 -2.58 -2.88 5.66 -1.26 -4.95 114.28 104.58 1oja n THR 399 Ca -0.02 -1.23 -0.41 0.00 -3.05 0.00 0.00 64.05 59.34 1oja n THR 399 Cb 0.74 0.99 -0.04 0.00 -1.55 0.00 0.00 70.33 70.48 1oja n THR 399 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1oja s THR 400 N -2.37 4.13 0.24 1.09 2.01 -1.26 -1.78 115.64 117.70 1oja s THR 400 Ca 0.20 1.76 0.10 0.00 0.31 0.00 0.00 61.69 64.05 1oja s THR 400 Cb -0.03 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1oja s THR 400 CO 0.15 0.26 -0.08 -0.72 -0.69 0.00 0.00 174.62 173.53 1oja s TYR 401 N 0.07 2.57 -0.25 4.92 -0.85 0.37 -4.95 117.35 119.23 1oja s TYR 401 Ca 0.50 -0.25 -0.05 0.00 -0.52 0.00 0.00 57.07 56.75 1oja s TYR 401 Cb -0.27 -1.18 0.00 0.00 0.38 0.00 0.00 41.96 40.89 1oja s TYR 401 CO 0.32 0.60 0.00 -0.06 -1.52 0.00 0.00 175.55 174.90 1oja s PHE 402 N -2.15 3.05 1.00 -3.49 0.40 -1.26 -3.71 117.98 111.82 1oja s PHE 402 Ca 0.29 -1.00 -0.12 0.00 -0.60 0.00 0.00 56.93 55.50 1oja s PHE 402 Cb -0.07 -2.16 0.19 0.00 0.51 0.00 0.00 43.02 41.50 1oja s PHE 402 CO 0.17 -0.57 1.08 -2.14 0.70 0.00 0.00 175.22 174.46 1oja s PRO 403 N 1.47 0.39 0.26 0.24 0.02 -1.26 -0.69 135.00 135.43 1oja s PRO 403 Ca 0.04 0.85 -0.31 0.00 0.02 0.00 0.00 61.00 61.60 1oja s PRO 403 Cb -0.16 -1.71 -0.13 0.00 0.02 0.00 0.00 34.50 32.53 1oja s PRO 403 CO -0.01 -2.84 1.44 -0.35 -0.33 0.00 0.00 177.00 174.91 1oja n PRO 404 N -4.30 2.19 0.00 5.54 -0.04 -1.26 -2.68 135.00 134.45 1oja n PRO 404 Ca 0.06 0.78 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 1oja n PRO 404 Cb 0.55 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 1oja n PRO 404 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1oja n GLY 405 N 2.07 1.31 0.13 0.55 0.00 0.17 -4.92 105.19 104.49 1oja n GLY 405 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 1oja n GLY 405 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1oja h ILE 406 N 0.00 0.97 -0.87 -0.61 1.08 -1.79 -3.23 117.51 113.05 1oja h ILE 406 Ca 0.00 -2.39 -0.02 0.00 -0.39 0.00 0.00 64.86 62.06 1oja h ILE 406 Cb 0.00 2.66 -0.04 0.00 -3.07 0.00 0.00 36.82 36.37 1oja h ILE 406 CO 0.00 0.72 0.47 0.25 -0.69 0.00 0.00 178.15 178.90 1oja h LEU 407 N -0.27 1.10 -0.47 1.44 5.85 -1.92 0.21 115.31 121.26 1oja h LEU 407 Ca -0.32 -0.11 -0.17 0.00 0.84 0.00 0.00 57.88 58.12 1oja h LEU 407 Cb 1.79 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 1oja h LEU 407 CO 0.06 0.89 -0.70 0.71 -0.34 0.00 0.00 178.44 179.05 1oja h THR 408 N 1.22 1.39 0.08 1.05 1.35 -1.93 0.21 112.91 116.28 1oja h THR 408 Ca 0.31 -2.14 -0.26 0.00 -0.55 0.00 0.00 66.41 63.77 1oja h THR 408 Cb 0.04 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.57 1oja h THR 408 CO -0.05 0.64 -1.20 1.56 -0.25 0.00 0.00 175.52 176.22 1oja h GLN 409 N 0.23 0.16 0.00 4.72 1.08 -1.43 -3.40 115.11 116.47 1oja h GLN 409 Ca -0.02 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 1oja h GLN 409 Cb 1.26 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 1oja h GLN 409 CO 0.12 1.10 0.00 0.66 -0.95 0.00 0.00 178.83 179.76 1oja n TYR 410 N -3.44 0.00 -0.19 2.96 4.02 0.67 -4.81 117.16 116.36 1oja n TYR 410 Ca -0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.86 1oja n TYR 410 Cb 1.00 0.00 0.30 0.00 -0.02 0.00 0.00 39.34 40.62 1oja n TYR 410 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1oja h GLY 411 N 0.00 1.01 1.20 2.72 0.00 -0.98 -2.15 103.07 104.87 1oja h GLY 411 Ca 0.00 -0.35 0.11 0.00 0.00 0.00 0.00 47.33 47.09 1oja h GLY 411 CO 0.00 0.30 0.30 3.21 0.00 0.00 0.00 176.54 180.35 1oja h ARG 412 N 0.88 0.00 -0.02 4.80 3.08 -1.87 -2.25 114.38 119.01 1oja h ARG 412 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1oja h ARG 412 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1oja h ARG 412 CO -0.08 0.00 -0.06 1.33 -1.07 0.00 0.00 179.97 180.09 1oja n VAL 413 N -4.18 0.00 -0.22 2.04 0.24 -0.81 -4.35 118.33 111.05 1oja n VAL 413 Ca 0.06 -0.32 0.02 0.00 -2.04 0.00 0.00 64.34 62.06 1oja n VAL 413 Cb 0.48 0.86 0.14 0.00 -1.47 0.00 0.00 33.84 33.85 1oja n VAL 413 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1oja h LEU 414 N 3.00 0.17 -3.05 1.34 5.85 -1.53 -2.52 115.31 118.58 1oja h LEU 414 Ca 0.00 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1oja h LEU 414 Cb 0.68 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 1oja h LEU 414 CO 0.00 0.08 -0.02 -2.11 -0.34 0.00 0.00 178.44 176.05 1oja n ARG 415 N -5.04 1.58 -2.34 1.25 1.85 -1.26 -4.90 116.66 107.80 1oja n ARG 415 Ca 0.11 -2.66 -0.42 0.00 -1.00 0.00 0.00 57.85 53.87 1oja n ARG 415 Cb 0.35 -1.57 -0.03 0.00 -1.05 0.00 0.00 32.46 30.16 1oja n ARG 415 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 1oja s GLN 416 N -2.89 4.29 0.59 2.89 0.74 -0.95 -4.63 119.66 119.69 1oja s GLN 416 Ca 0.34 1.80 -0.20 0.00 0.05 0.00 0.00 55.36 57.35 1oja s GLN 416 Cb 0.30 -3.64 -0.04 0.00 1.10 0.00 0.00 33.01 30.73 1oja s GLN 416 CO 0.04 -0.58 1.26 -2.30 -0.55 0.00 0.00 175.29 173.16 1oja n PRO 417 N 5.72 1.36 -3.84 1.67 -0.02 -1.26 -4.86 135.00 133.78 1oja n PRO 417 Ca 0.13 0.51 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 1oja n PRO 417 Cb 0.45 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.33 1oja n PRO 417 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1oja s VAL 418 N -1.35 3.07 0.00 -1.45 1.01 -0.30 -4.98 120.40 116.40 1oja s VAL 418 Ca 0.76 -2.52 0.00 0.00 0.00 0.00 0.00 61.98 60.21 1oja s VAL 418 Cb -0.41 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1oja s VAL 418 CO 0.46 -0.73 0.00 -0.67 0.00 0.00 0.00 175.10 174.16 1oja n ASP 419 N 4.03 0.00 -0.85 3.32 -0.08 -1.26 -1.09 116.55 120.62 1oja n ASP 419 Ca 0.03 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.38 1oja n ASP 419 Cb 0.39 0.00 0.21 0.00 2.34 0.00 0.00 41.12 44.07 1oja n ASP 419 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1oja n ARG 420 N 0.00 2.99 -3.68 -0.67 1.74 -1.26 -4.91 116.66 110.87 1oja n ARG 420 Ca 0.00 -2.41 -0.36 0.00 -0.77 0.00 0.00 57.85 54.31 1oja n ARG 420 Cb 0.00 -1.53 -0.10 0.00 -1.02 0.00 0.00 32.46 29.82 1oja n ARG 420 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1oja s ILE 421 N -1.65 5.29 0.19 0.55 1.01 -0.25 -1.36 121.20 124.99 1oja s ILE 421 Ca 0.33 0.16 0.08 0.00 0.00 0.00 0.00 60.65 61.22 1oja s ILE 421 Cb 0.22 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 1oja s ILE 421 CO 0.15 0.35 -0.02 -0.31 0.00 0.00 0.00 174.94 175.11 1oja s TYR 422 N 1.04 2.77 -0.20 3.97 1.51 0.02 -1.15 117.35 125.31 1oja s TYR 422 Ca 0.07 -0.17 -0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1oja s TYR 422 Cb -0.13 -1.32 0.02 0.00 -0.11 0.00 0.00 41.96 40.41 1oja s TYR 422 CO 0.04 0.53 -0.15 -0.06 -1.11 0.00 0.00 175.55 174.81 1oja s PHE 423 N -1.84 2.88 0.00 2.71 0.40 -1.26 -0.41 117.98 120.46 1oja s PHE 423 Ca 0.28 -1.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.08 1oja s PHE 423 Cb -0.09 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.47 1oja s PHE 423 CO 0.18 -0.75 0.00 0.00 0.70 0.00 0.00 175.22 175.35 1oja n ALA 424 N 4.65 0.00 0.00 5.36 0.00 0.10 -4.72 120.51 125.90 1oja n ALA 424 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1oja n ALA 424 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1oja n ALA 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oja n GLY 425 N 5.00 -0.80 0.26 0.00 0.00 -1.26 -4.51 105.19 103.89 1oja n GLY 425 Ca 0.00 -1.39 0.10 0.00 0.00 0.00 0.00 46.02 44.73 1oja n GLY 425 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oja h THR 426 N 0.00 0.84 -0.02 2.61 1.03 -1.85 -0.93 112.91 114.60 1oja h THR 426 Ca 0.00 -0.18 0.01 0.00 -0.01 0.00 0.00 66.41 66.23 1oja h THR 426 Cb 0.00 1.10 -0.00 0.00 -1.07 0.00 0.00 68.15 68.18 1oja h THR 426 CO 0.00 0.05 0.08 -0.33 -0.01 0.00 0.00 175.52 175.31 1oja h GLU 427 N 0.00 0.00 -0.03 0.00 3.07 -1.89 -1.55 114.58 114.18 1oja h GLU 427 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1oja h GLU 427 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1oja h GLU 427 CO 0.01 0.00 0.00 0.25 -1.40 0.00 0.00 179.01 177.87 1oja n THR 428 N -3.26 0.00 -1.42 1.13 -2.24 -0.35 -4.93 114.28 103.21 1oja n THR 428 Ca -0.02 -0.40 -0.31 0.00 -2.27 0.00 0.00 64.05 61.05 1oja n THR 428 Cb 0.15 1.11 0.09 0.00 -2.10 0.00 0.00 70.33 69.58 1oja n THR 428 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oja s ALA 429 N -2.00 2.27 -1.05 6.98 0.00 -0.59 -4.89 121.76 122.49 1oja s ALA 429 Ca 0.32 0.05 0.10 0.00 0.00 0.00 0.00 51.96 52.43 1oja s ALA 429 Cb 0.20 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 20.16 1oja s ALA 429 CO 0.31 -1.68 0.70 0.25 0.00 0.00 0.00 175.76 175.34 1oja n THR 430 N -3.44 0.00 -3.68 0.00 -2.24 -1.26 -4.53 114.28 99.13 1oja n THR 430 Ca 0.08 -0.42 -0.16 0.00 -2.27 0.00 0.00 64.05 61.28 1oja n THR 430 Cb 0.54 1.15 -0.15 0.00 -2.10 0.00 0.00 70.33 69.77 1oja n THR 430 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1oja s HIS 431 N -1.24 -0.23 -1.47 4.78 5.65 -1.26 -4.73 115.29 116.78 1oja s HIS 431 Ca 0.10 0.68 -0.11 0.00 0.25 0.00 0.00 55.06 55.97 1oja s HIS 431 Cb 0.08 -0.18 0.06 0.00 -1.18 0.00 0.00 32.58 31.36 1oja s HIS 431 CO 0.22 -0.27 0.84 0.91 -0.65 0.00 0.00 174.74 175.79 1oja n TRP 432 N 5.15 -2.20 -1.72 3.88 7.02 -0.41 -3.98 117.44 125.18 1oja n TRP 432 Ca -0.08 0.76 -0.42 0.00 -1.02 0.00 0.00 57.50 56.73 1oja n TRP 432 Cb 0.50 -3.96 -0.01 0.00 -2.42 0.00 0.00 31.31 25.43 1oja n TRP 432 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1oja n SER 433 N -2.68 3.12 0.00 -0.99 2.88 -1.26 -1.83 113.62 112.86 1oja n SER 433 Ca 0.00 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 1oja n SER 433 Cb 0.55 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1oja n SER 433 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1oja n GLY 434 N 1.02 2.18 3.70 0.46 0.00 -1.22 -4.95 105.19 106.39 1oja n GLY 434 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1oja n GLY 434 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oja s TYR 435 N -2.57 2.53 0.29 1.61 1.51 -0.76 -4.67 117.35 115.29 1oja s TYR 435 Ca 0.00 -0.64 -0.02 0.00 -1.01 0.00 0.00 57.07 55.40 1oja s TYR 435 Cb 0.00 -1.88 0.43 0.00 -0.11 0.00 0.00 41.96 40.40 1oja s TYR 435 CO 0.00 0.28 1.94 0.52 -1.11 0.00 0.00 175.55 177.17 1oja h MET 436 N 1.54 1.12 -0.32 -0.62 2.86 -1.90 -1.28 114.93 116.33 1oja h MET 436 Ca -0.43 -0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.21 1oja h MET 436 Cb 1.25 -0.25 -0.06 0.00 0.06 0.00 0.00 31.60 32.60 1oja h MET 436 CO 0.74 0.74 -0.09 1.49 1.06 0.00 0.00 176.91 180.85 1oja h GLU 437 N 1.15 -0.01 -0.35 1.72 4.57 -1.93 -1.76 114.58 117.98 1oja h GLU 437 Ca 0.35 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.50 1oja h GLU 437 Cb -0.02 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1oja h GLU 437 CO -0.10 -0.01 0.07 0.78 -1.18 0.00 0.00 179.01 178.57 1oja h GLY 438 N -0.01 0.55 1.00 1.92 0.00 -0.76 -1.62 103.07 104.15 1oja h GLY 438 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1oja h GLY 438 CO -0.33 0.27 0.30 0.00 0.00 0.00 0.00 176.54 176.78 1oja h ALA 439 N 1.58 0.60 -0.02 3.60 0.00 -0.46 -0.56 119.26 124.00 1oja h ALA 439 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1oja h ALA 439 Cb 0.22 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1oja h ALA 439 CO -0.00 0.07 0.01 0.28 0.00 0.00 0.00 179.25 179.60 1oja h VAL 440 N 0.64 1.14 -0.33 0.00 2.07 -0.83 -0.90 116.25 118.04 1oja h VAL 440 Ca 0.17 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.35 1oja h VAL 440 Cb -0.05 1.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1oja h VAL 440 CO -0.04 0.11 -0.09 -0.08 0.02 0.00 0.00 177.57 177.49 1oja h GLU 441 N -0.13 -0.02 -0.33 1.57 4.81 -1.12 -1.34 114.58 118.03 1oja h GLU 441 Ca 0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 1oja h GLU 441 Cb 0.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1oja h GLU 441 CO -0.00 -0.01 -0.40 0.00 -0.73 0.00 0.00 179.01 177.87 1oja h ALA 442 N 1.31 0.67 -0.37 2.92 0.00 -1.02 -0.17 119.26 122.60 1oja h ALA 442 Ca 0.16 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1oja h ALA 442 Cb 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1oja h ALA 442 CO -0.35 0.67 0.01 0.78 0.00 0.00 0.00 179.25 180.36 1oja h GLY 443 N 0.88 0.70 1.10 0.00 0.00 -0.93 -0.26 103.07 104.56 1oja h GLY 443 Ca 0.05 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 1oja h GLY 443 CO 0.09 0.47 -0.32 0.83 0.00 0.00 0.00 176.54 177.61 1oja h GLU 444 N 0.47 0.93 -0.45 4.80 5.08 -1.17 -1.04 114.58 123.19 1oja h GLU 444 Ca 0.11 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 1oja h GLU 444 Cb 0.44 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1oja h GLU 444 CO 0.02 1.12 0.26 -0.09 -1.00 0.00 0.00 179.01 179.32 1oja h ARG 445 N 0.76 0.63 -0.72 2.33 1.12 -0.95 -0.74 114.38 116.81 1oja h ARG 445 Ca 0.08 -0.07 -0.05 0.00 -1.11 0.00 0.00 59.98 58.83 1oja h ARG 445 Cb 0.91 -0.13 -0.03 0.00 -0.01 0.00 0.00 29.97 30.71 1oja h ARG 445 CO 0.08 0.48 0.25 0.00 -3.11 0.00 0.00 179.97 177.68 1oja h ALA 446 N 1.11 0.94 -0.39 2.80 0.00 -0.96 0.78 119.26 123.54 1oja h ALA 446 Ca 0.16 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1oja h ALA 446 Cb 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1oja h ALA 446 CO -0.03 0.60 0.21 0.00 0.00 0.00 0.00 179.25 180.03 1oja h ALA 447 N 1.12 0.49 0.00 0.00 0.00 -0.97 -2.67 119.26 117.24 1oja h ALA 447 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1oja h ALA 447 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1oja h ALA 447 CO -0.01 -0.13 -0.38 0.00 0.00 0.00 0.00 179.25 178.72 1oja h ARG 448 N 0.43 0.00 -0.79 0.00 3.08 -0.68 -0.78 114.38 115.65 1oja h ARG 448 Ca 0.16 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.25 1oja h ARG 448 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 1oja h ARG 448 CO -0.09 0.38 0.49 0.93 -1.07 0.00 0.00 179.97 180.61 1oja h GLU 449 N 0.00 0.92 -0.30 0.04 5.08 -0.55 0.49 114.58 120.26 1oja h GLU 449 Ca -0.00 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 1oja h GLU 449 Cb 0.70 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1oja h GLU 449 CO 0.05 0.61 -0.17 0.82 -1.00 0.00 0.00 179.01 179.32 1oja h ILE 450 N 0.95 1.30 -0.94 3.13 2.04 -1.08 0.24 117.51 123.16 1oja h ILE 450 Ca 0.32 -1.28 0.06 0.00 1.00 0.00 0.00 64.86 64.96 1oja h ILE 450 Cb 0.04 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.54 1oja h ILE 450 CO -0.12 0.41 0.60 -0.07 0.00 0.00 0.00 178.15 178.96 1oja h LEU 451 N 0.40 0.95 -0.32 1.44 3.38 -0.88 0.22 115.31 120.50 1oja h LEU 451 Ca 0.06 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1oja h LEU 451 Cb 0.70 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1oja h LEU 451 CO 0.05 0.61 0.06 -0.74 0.09 0.00 0.00 178.44 178.50 1oja h HIS 452 N 1.08 0.55 -0.41 1.13 2.76 -0.69 -0.05 115.15 119.53 1oja h HIS 452 Ca 0.40 -0.07 0.08 0.00 -2.20 0.00 0.00 60.37 58.59 1oja h HIS 452 Cb 0.16 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.95 1oja h HIS 452 CO -0.02 0.59 0.28 0.00 -1.30 0.00 0.00 177.93 177.49 1oja h ALA 453 N 0.89 2.15 -0.00 5.26 0.00 -0.25 0.13 119.26 127.43 1oja h ALA 453 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1oja h ALA 453 Cb 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1oja h ALA 453 CO 0.00 -0.25 -0.01 -1.33 0.00 0.00 0.00 179.25 177.66 1oja n MET 454 N -4.46 1.14 -1.29 0.00 2.00 0.00 -4.91 117.12 109.60 1oja n MET 454 Ca 0.06 -0.32 -0.09 0.00 0.00 0.00 0.00 57.70 57.36 1oja n MET 454 Cb 0.36 -1.49 -0.04 0.00 0.00 0.00 0.00 33.22 32.05 1oja n MET 454 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1oja n GLY 455 N 1.10 1.01 0.11 3.03 0.00 0.45 -4.93 105.19 105.96 1oja n GLY 455 Ca 0.21 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.62 1oja n GLY 455 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oja h LYS 456 N 0.00 0.00 -4.27 1.61 1.57 -1.20 -3.47 116.57 110.81 1oja h LYS 456 Ca -0.18 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.42 1oja h LYS 456 Cb 0.59 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.72 1oja h LYS 456 CO 0.26 0.32 -0.70 0.96 -0.57 0.00 0.00 179.45 179.72 1oja s ILE 457 N -2.99 0.31 0.74 1.86 -4.36 -1.22 -4.98 121.20 110.56 1oja s ILE 457 Ca -0.00 -1.37 -0.11 0.00 -0.26 0.00 0.00 60.65 58.91 1oja s ILE 457 Cb 0.08 -0.92 0.04 0.00 1.25 0.00 0.00 42.46 42.91 1oja s ILE 457 CO 0.78 -0.68 1.08 -2.16 0.24 0.00 0.00 174.94 174.20 1oja s PRO 458 N -2.58 2.55 0.29 0.37 0.04 -1.26 -4.35 135.00 130.07 1oja s PRO 458 Ca -0.04 0.80 0.03 0.00 0.04 0.00 0.00 61.00 61.83 1oja s PRO 458 Cb -0.02 -1.96 0.60 0.00 0.04 0.00 0.00 34.50 33.16 1oja s PRO 458 CO -0.04 -1.33 1.84 1.49 0.04 0.00 0.00 177.00 179.00 1oja h GLU 459 N -0.88 0.92 0.00 4.56 4.81 -1.98 -1.72 114.58 120.28 1oja h GLU 459 Ca -0.45 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1oja h GLU 459 Cb 1.24 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1oja h GLU 459 CO 0.58 0.61 0.00 -0.40 -0.73 0.00 0.00 179.01 179.07 1oja n ASP 460 N -4.61 0.00 -0.95 1.04 3.85 -1.26 -2.16 116.55 112.46 1oja n ASP 460 Ca 0.19 -0.12 0.12 0.00 -0.71 0.00 0.00 54.79 54.26 1oja n ASP 460 Cb 0.37 -0.19 0.11 0.00 -1.35 0.00 0.00 41.12 40.06 1oja n ASP 460 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1oja n GLU 461 N -1.19 2.24 0.01 0.11 1.02 -0.65 -4.45 120.64 117.73 1oja n GLU 461 Ca 0.09 -1.92 -0.12 0.00 -0.02 0.00 0.00 57.16 55.18 1oja n GLU 461 Cb 0.10 -1.45 -0.08 0.00 -0.02 0.00 0.00 31.44 29.99 1oja n GLU 461 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1oja h ILE 462 N 4.52 1.16 -3.80 -3.67 2.04 -1.56 -3.40 117.51 112.81 1oja h ILE 462 Ca 0.00 -0.49 -0.64 0.00 1.00 0.00 0.00 64.86 64.73 1oja h ILE 462 Cb 0.97 1.45 -0.19 0.00 -0.74 0.00 0.00 36.82 38.31 1oja h ILE 462 CO 0.00 0.13 -0.56 0.26 0.00 0.00 0.00 178.15 177.99 1oja s TRP 463 N -5.39 3.18 -0.08 1.37 0.52 -1.26 -4.60 118.94 112.68 1oja s TRP 463 Ca -0.14 -0.06 0.04 0.00 0.02 0.00 0.00 56.10 55.96 1oja s TRP 463 Cb 0.05 -2.33 0.00 0.00 -1.15 0.00 0.00 33.47 30.04 1oja s TRP 463 CO 0.67 -0.22 -0.21 -1.14 0.02 0.00 0.00 176.95 176.07 1oja s GLN 464 N 1.69 2.57 0.84 4.98 0.74 -1.26 -5.02 119.66 124.19 1oja s GLN 464 Ca 0.07 -0.76 -0.11 0.00 0.05 0.00 0.00 55.36 54.61 1oja s GLN 464 Cb -0.16 -2.01 0.10 0.00 1.10 0.00 0.00 33.01 32.04 1oja s GLN 464 CO 0.08 0.18 1.09 -1.54 -0.55 0.00 0.00 175.29 174.56 1oja s SER 465 N 0.32 3.90 -0.11 6.67 1.04 -1.26 -5.06 113.70 119.20 1oja s SER 465 Ca -0.15 1.72 0.02 0.00 0.48 0.00 0.00 55.95 58.03 1oja s SER 465 Cb -0.16 -2.39 0.01 0.00 0.10 0.00 0.00 66.02 63.58 1oja s SER 465 CO 0.07 -2.40 -0.19 -0.70 0.98 0.00 0.00 173.24 170.99 1oja s GLU 466 N -4.88 2.61 0.48 4.02 2.56 -1.26 -5.12 118.70 117.11 1oja s GLU 466 Ca 0.63 -0.71 -0.24 0.00 0.00 0.00 0.00 54.97 54.64 1oja s GLU 466 Cb -0.18 -2.12 -0.07 0.00 2.00 0.00 0.00 34.13 33.76 1oja s GLU 466 CO 0.57 0.01 1.42 -2.14 -0.56 0.00 0.00 175.26 174.55 1oja s PRO 467 N 0.78 3.52 0.29 4.30 0.02 -1.26 -4.93 135.00 137.71 1oja s PRO 467 Ca -0.10 2.39 -0.29 0.00 0.02 0.00 0.00 61.00 63.01 1oja s PRO 467 Cb -0.16 -2.54 -0.11 0.00 0.02 0.00 0.00 34.50 31.72 1oja s PRO 467 CO 0.01 -0.94 1.48 -2.00 -0.33 0.00 0.00 177.00 175.22 1oja s GLU 468 N -2.59 4.20 0.23 5.54 2.12 -1.26 -4.88 118.70 122.07 1oja s GLU 468 Ca 0.64 2.43 -0.32 0.00 0.36 0.00 0.00 54.97 58.08 1oja s GLU 468 Cb -0.43 -3.05 -0.13 0.00 0.26 0.00 0.00 34.13 30.78 1oja s GLU 468 CO 0.54 -0.48 1.57 0.45 -0.54 0.00 0.00 175.26 176.80 1oja n SER 469 N 1.78 3.43 0.19 -1.70 2.88 -1.26 -4.91 113.62 114.04 1oja n SER 469 Ca 0.05 1.11 0.07 0.00 -1.33 0.00 0.00 58.87 58.78 1oja n SER 469 Cb 0.39 -1.51 0.21 0.00 -0.75 0.00 0.00 64.21 62.55 1oja n SER 469 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1oja h VAL 470 N 3.42 0.54 0.00 2.46 -1.51 -2.01 -3.31 116.25 115.85 1oja h VAL 470 Ca -0.45 -1.55 -0.16 0.00 -1.23 0.00 0.00 66.70 63.31 1oja h VAL 470 Cb 1.24 2.10 -0.03 0.00 -2.13 0.00 0.00 31.29 32.47 1oja h VAL 470 CO 0.84 0.28 -1.08 0.44 -1.23 0.00 0.00 177.57 176.82 1oja h ASP 471 N 0.00 0.00 -2.17 4.19 5.19 -2.02 -3.40 116.42 118.22 1oja h ASP 471 Ca -0.00 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.83 1oja h ASP 471 Cb 1.08 0.00 -0.40 0.00 0.18 0.00 0.00 39.33 40.19 1oja h ASP 471 CO 0.04 0.62 -0.90 0.52 -3.12 0.00 0.00 179.24 176.40 1oja n VAL 472 N -3.06 0.34 -2.29 -1.35 0.31 -1.24 -5.11 118.33 105.93 1oja n VAL 472 Ca -0.05 -4.38 -0.37 0.00 -0.01 0.00 0.00 64.34 59.54 1oja n VAL 472 Cb 0.83 -1.98 -0.01 0.00 -0.91 0.00 0.00 33.84 31.76 1oja n VAL 472 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1oja s PRO 473 N -1.47 3.72 -0.17 5.55 0.04 -1.25 -4.48 135.00 136.94 1oja s PRO 473 Ca 0.36 1.71 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 1oja s PRO 473 Cb 0.14 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1oja s PRO 473 CO -0.09 -0.57 0.36 0.00 0.04 0.00 0.00 177.00 176.73 1oja s ALA 474 N -1.61 3.56 0.15 8.56 0.00 -1.26 -4.80 121.76 126.36 1oja s ALA 474 Ca 0.65 -0.45 -0.22 0.00 0.00 0.00 0.00 51.96 51.93 1oja s ALA 474 Cb -0.27 -2.52 -0.08 0.00 0.00 0.00 0.00 23.12 20.25 1oja s ALA 474 CO 0.32 -0.08 0.70 -0.65 0.00 0.00 0.00 175.76 176.05 1oja s GLN 475 N 0.84 4.39 0.71 0.00 -1.52 -1.26 -5.06 119.66 117.75 1oja s GLN 475 Ca 0.19 0.96 -0.15 0.00 -1.95 0.00 0.00 55.36 54.41 1oja s GLN 475 Cb -0.14 -3.17 0.03 0.00 -0.22 0.00 0.00 33.01 29.51 1oja s GLN 475 CO 0.06 0.56 1.17 -1.25 -0.25 0.00 0.00 175.29 175.58 1oja s PRO 476 N -1.32 2.34 -0.18 2.91 0.04 -1.26 -4.99 135.00 132.54 1oja s PRO 476 Ca 0.35 1.63 -0.19 0.00 0.04 0.00 0.00 61.00 62.83 1oja s PRO 476 Cb -0.21 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1oja s PRO 476 CO 0.23 -1.66 0.55 0.42 0.04 0.00 0.00 177.00 176.58 1oja s ILE 477 N -2.11 5.09 0.28 0.56 -1.09 -1.26 -5.07 121.20 117.59 1oja s ILE 477 Ca 0.72 1.05 0.12 0.00 -2.23 0.00 0.00 60.65 60.30 1oja s ILE 477 Cb -0.26 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 36.69 1oja s ILE 477 CO 0.44 0.19 -0.17 0.42 -1.23 0.00 0.00 174.94 174.59 1oja s THR 478 N 1.49 2.64 0.17 2.92 -4.23 -1.26 -5.15 115.64 112.22 1oja s THR 478 Ca 0.26 -2.33 0.08 0.00 -1.18 0.00 0.00 61.69 58.53 1oja s THR 478 Cb -0.16 -2.39 -0.04 0.00 1.34 0.00 0.00 72.50 71.25 1oja s THR 478 CO 0.10 -0.39 -0.17 0.42 -0.54 0.00 0.00 174.62 174.04 1oja s THR 479 N -2.48 1.80 0.55 3.99 -4.23 -1.26 -5.16 115.64 108.86 1oja s THR 479 Ca 0.30 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 58.85 1oja s THR 479 Cb -0.05 -1.88 0.04 0.00 1.34 0.00 0.00 72.50 71.94 1oja s THR 479 CO 0.16 -0.38 0.77 0.42 -0.54 0.00 0.00 174.62 175.05 1oja s THR 480 N -2.25 2.64 0.15 3.99 -4.23 -1.26 -4.97 115.64 109.71 1oja s THR 480 Ca 0.17 -0.70 -0.17 0.00 -1.18 0.00 0.00 61.69 59.81 1oja s THR 480 Cb -0.05 -2.94 -0.00 0.00 1.34 0.00 0.00 72.50 70.86 1oja s THR 480 CO 0.07 0.00 1.81 0.15 -0.54 0.00 0.00 174.62 176.10 1oja h PHE 481 N 0.08 0.46 -0.36 3.99 3.57 -2.01 -1.58 116.94 121.10 1oja h PHE 481 Ca -0.41 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.08 1oja h PHE 481 Cb 1.29 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.86 1oja h PHE 481 CO 0.33 0.29 0.15 -0.07 -2.23 0.00 0.00 178.31 176.78 1oja h LEU 482 N 0.50 0.49 -0.98 0.59 3.38 -1.96 -1.41 115.31 115.90 1oja h LEU 482 Ca 0.13 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1oja h LEU 482 Cb -0.05 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1oja h LEU 482 CO -0.03 0.51 0.64 -0.33 0.09 0.00 0.00 178.44 179.33 1oja h GLU 483 N 0.43 1.21 -0.09 1.13 5.08 -1.92 0.13 114.58 120.56 1oja h GLU 483 Ca 0.12 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 1oja h GLU 483 Cb 0.18 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1oja h GLU 483 CO -0.01 0.80 -0.49 0.00 -1.00 0.00 0.00 179.01 178.31 1oja h ARG 484 N 1.25 0.22 0.00 2.33 3.08 -0.99 -3.38 114.38 116.89 1oja h ARG 484 Ca 0.39 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1oja h ARG 484 Cb -0.01 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1oja h ARG 484 CO -0.12 0.67 -0.32 0.72 -1.07 0.00 0.00 179.97 179.85 1oja n HIS 485 N -3.96 0.00 -1.72 3.04 8.25 -0.56 -5.00 115.22 115.27 1oja n HIS 485 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 1oja n HIS 485 Cb 0.54 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.63 1oja n HIS 485 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1oja n LEU 486 N -1.16 3.97 -4.79 2.41 4.77 0.41 -4.95 117.00 117.66 1oja n LEU 486 Ca 0.00 1.21 -0.32 0.00 -0.03 0.00 0.00 56.01 56.87 1oja n LEU 486 Cb 0.02 -1.53 0.05 0.00 -2.33 0.00 0.00 43.42 39.63 1oja n LEU 486 CO 0.02 -0.23 0.72 -2.16 -1.33 0.00 0.00 177.39 174.41 1oja s PRO 487 N -1.74 2.86 1.14 3.23 0.04 -1.26 -4.92 135.00 134.35 1oja s PRO 487 Ca 0.56 1.20 -0.17 0.00 0.04 0.00 0.00 61.00 62.64 1oja s PRO 487 Cb -0.54 -1.97 0.26 0.00 0.04 0.00 0.00 34.50 32.29 1oja s PRO 487 CO 0.61 -1.18 1.10 -1.54 0.04 0.00 0.00 177.00 176.03 1oja s SER 488 N -3.05 1.42 0.07 6.66 1.04 -1.26 -4.77 113.70 113.80 1oja s SER 488 Ca 0.63 0.82 -0.25 0.00 0.48 0.00 0.00 55.95 57.63 1oja s SER 488 Cb -0.17 -1.22 -0.16 0.00 0.10 0.00 0.00 66.02 64.57 1oja s SER 488 CO 0.46 -3.84 1.66 0.58 0.98 0.00 0.00 173.24 173.08 1oja h VAL 489 N -2.38 0.90 -0.27 5.02 2.07 -1.89 -1.23 116.25 118.46 1oja h VAL 489 Ca -0.49 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 1oja h VAL 489 Cb 1.31 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1oja h VAL 489 CO 0.42 0.03 0.16 1.55 0.02 0.00 0.00 177.57 179.75 1oja h PRO 490 N -0.23 0.36 -0.64 1.57 0.13 -1.96 -0.43 132.00 130.80 1oja h PRO 490 Ca -0.02 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1oja h PRO 490 Cb 0.18 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.20 1oja h PRO 490 CO 0.03 0.26 0.37 0.78 -0.23 0.00 0.00 178.00 179.22 1oja h GLY 491 N 0.42 0.95 2.00 1.56 0.00 -1.84 0.44 103.07 106.59 1oja h GLY 491 Ca 0.10 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 1oja h GLY 491 CO -0.02 0.40 -0.49 -2.00 0.00 0.00 0.00 176.54 174.42 1oja h LEU 492 N 0.88 0.00 -0.48 3.11 5.85 -0.73 -2.37 115.31 121.56 1oja h LEU 492 Ca 0.23 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.78 1oja h LEU 492 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1oja h LEU 492 CO -0.04 0.49 -0.66 -0.07 -0.34 0.00 0.00 178.44 177.83 1oja h LEU 493 N 0.00 0.47 -1.11 2.25 3.38 -0.57 -3.06 115.31 116.67 1oja h LEU 493 Ca -0.00 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1oja h LEU 493 Cb 1.04 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1oja h LEU 493 CO 0.06 1.00 0.00 0.03 0.09 0.00 0.00 178.44 179.63 1oja h ARG 494 N 0.29 0.00 -0.50 1.13 3.08 0.07 -1.18 114.38 117.29 1oja h ARG 494 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1oja h ARG 494 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1oja h ARG 494 CO 0.11 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.29 1oja n LEU 495 N -2.82 2.25 0.00 3.04 4.32 -0.91 -5.08 117.00 117.80 1oja n LEU 495 Ca 0.01 -1.13 0.00 0.00 -0.02 0.00 0.00 56.01 54.87 1oja n LEU 495 Cb 0.30 -0.35 0.00 0.00 -1.62 0.00 0.00 43.42 41.76 1oja n LEU 495 CO 0.26 0.44 0.00 -0.38 -1.22 0.00 0.00 177.39 176.49