#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ung n LYS 3 N 0.00 1.42 -4.41 3.69 4.76 -1.26 -5.01 118.16 117.35 1ung n LYS 3 Ca 0.00 0.54 -0.25 0.00 -2.87 0.00 0.00 58.31 55.73 1ung n LYS 3 Cb 0.00 -2.56 -0.10 0.00 -1.84 0.00 0.00 35.03 30.52 1ung n LYS 3 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1ung s TYR 4 N -1.33 2.39 -0.23 2.13 2.02 -1.26 -5.12 117.35 115.94 1ung s TYR 4 Ca 0.77 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 57.17 1ung s TYR 4 Cb -0.40 -1.10 0.04 0.00 -0.40 0.00 0.00 41.96 40.11 1ung s TYR 4 CO 0.45 0.62 -0.13 -2.00 -1.57 0.00 0.00 175.55 172.92 1ung s GLU 5 N -3.20 2.58 0.46 -0.62 2.12 -1.26 -5.11 118.70 113.67 1ung s GLU 5 Ca 0.27 -1.12 -0.24 0.00 0.36 0.00 0.00 54.97 54.24 1ung s GLU 5 Cb -0.07 -2.82 -0.09 0.00 0.26 0.00 0.00 34.13 31.42 1ung s GLU 5 CO 0.14 -0.43 1.21 1.63 -0.54 0.00 0.00 175.26 177.27 1ung n LYS 6 N 4.54 1.71 -0.01 4.30 5.02 -1.26 -4.20 118.16 128.25 1ung n LYS 6 Ca -0.17 0.61 -0.03 0.00 -2.02 0.00 0.00 58.31 56.71 1ung n LYS 6 Cb 0.45 -2.34 -0.01 0.00 -0.02 0.00 0.00 35.03 33.12 1ung n LYS 6 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ung n LEU 7 N -0.02 0.22 -3.72 -0.35 4.77 -1.26 -4.87 117.00 111.76 1ung n LEU 7 Ca 0.08 0.04 -0.02 0.00 -0.03 0.00 0.00 56.01 56.08 1ung n LEU 7 Cb 0.41 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.40 1ung n LEU 7 CO 0.57 0.05 0.83 -1.83 -1.33 0.00 0.00 177.39 175.68 1ung s GLU 8 N -2.05 0.95 0.42 3.23 -1.05 -1.26 -4.99 118.70 113.95 1ung s GLU 8 Ca -0.04 -0.53 0.01 0.00 -0.15 0.00 0.00 54.97 54.26 1ung s GLU 8 Cb 0.02 0.32 -0.00 0.00 -0.44 0.00 0.00 34.13 34.02 1ung s GLU 8 CO 0.05 -0.44 0.03 1.17 0.95 0.00 0.00 175.26 177.02 1ung n LYS 9 N -0.49 0.86 0.00 -4.83 3.00 -1.26 -2.27 118.16 113.18 1ung n LYS 9 Ca -0.07 -3.16 0.00 0.00 -0.00 0.00 0.00 58.31 55.08 1ung n LYS 9 Cb 0.61 1.04 0.00 0.00 0.00 0.00 0.00 35.03 36.68 1ung n LYS 9 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1ung n THR 17 N -1.03 0.00 -4.31 3.15 5.66 -1.26 -4.75 114.28 111.74 1ung n THR 17 Ca -0.15 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.65 1ung n THR 17 Cb 0.55 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.20 1ung n THR 17 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1ung s VAL 18 N 0.00 1.21 -0.02 1.08 1.01 -1.26 -0.88 120.40 121.53 1ung s VAL 18 Ca 0.00 -1.16 -0.08 0.00 0.00 0.00 0.00 61.98 60.73 1ung s VAL 18 Cb 0.00 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.28 1ung s VAL 18 CO 0.00 -0.06 0.19 -0.36 0.00 0.00 0.00 175.10 174.86 1ung s PHE 19 N -1.01 -0.08 -0.39 5.22 0.40 -0.48 -4.99 117.98 116.65 1ung s PHE 19 Ca 0.01 0.14 -0.02 0.00 -0.60 0.00 0.00 56.93 56.46 1ung s PHE 19 Cb -0.09 0.01 0.19 0.00 0.51 0.00 0.00 43.02 43.65 1ung s PHE 19 CO 0.02 -0.25 2.23 1.17 0.70 0.00 0.00 175.22 179.09 1ung n LYS 20 N 1.89 2.05 0.00 0.44 4.81 -0.96 -0.99 118.16 125.41 1ung n LYS 20 Ca -0.19 -1.95 0.00 0.00 -0.87 0.00 0.00 58.31 55.30 1ung n LYS 20 Cb 0.57 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.79 1ung n LYS 20 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ung n ALA 21 N 0.38 0.00 -3.12 3.14 0.00 -1.26 -4.43 120.51 115.21 1ung n ALA 21 Ca 0.38 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.46 1ung n ALA 21 Cb 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.90 1ung n ALA 21 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1ung s ILE 29 N -2.09 4.14 0.28 0.00 2.07 -1.26 -4.80 121.20 119.54 1ung s ILE 29 Ca 0.00 -0.37 0.01 0.00 -1.41 0.00 0.00 60.65 58.88 1ung s ILE 29 Cb 0.00 -3.00 -0.03 0.00 0.13 0.00 0.00 42.46 39.57 1ung s ILE 29 CO 0.00 0.25 0.28 0.68 -1.91 0.00 0.00 174.94 174.25 1ung s VAL 30 N 1.57 0.00 -0.24 4.00 -7.23 -1.26 -4.30 120.40 112.94 1ung s VAL 30 Ca 0.05 -1.87 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 1ung s VAL 30 Cb -0.16 -2.50 -0.01 0.00 0.56 0.00 0.00 36.38 34.27 1ung s VAL 30 CO 0.03 0.00 0.01 0.00 -0.31 0.00 0.00 175.10 174.82 1ung s ALA 31 N -3.66 2.95 0.35 1.32 0.00 0.11 -4.44 121.76 118.40 1ung s ALA 31 Ca 0.37 -1.21 -0.07 0.00 0.00 0.00 0.00 51.96 51.05 1ung s ALA 31 Cb 0.03 -1.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.22 1ung s ALA 31 CO 0.19 -0.53 0.65 -0.51 0.00 0.00 0.00 175.76 175.57 1ung s LEU 32 N 1.52 3.93 -0.04 0.00 1.43 -0.16 0.11 118.68 125.48 1ung s LEU 32 Ca 0.05 0.87 -0.01 0.00 -1.03 0.00 0.00 54.13 54.01 1ung s LEU 32 Cb -0.15 -3.73 0.03 0.00 0.03 0.00 0.00 46.19 42.38 1ung s LEU 32 CO -0.00 -0.31 0.06 -0.75 0.23 0.00 0.00 176.35 175.58 1ung s LYS 33 N -3.82 -0.03 0.11 1.70 2.20 0.15 -1.38 119.74 118.66 1ung s LYS 33 Ca 0.47 0.31 0.08 0.00 -0.36 0.00 0.00 55.97 56.47 1ung s LYS 33 Cb -0.10 -0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 35.84 1ung s LYS 33 CO 0.32 -0.24 -0.14 1.03 -0.36 0.00 0.00 175.35 175.96 1ung s ARG 34 N 1.59 1.97 -0.07 4.03 0.52 -0.06 0.34 118.95 127.27 1ung s ARG 34 Ca -0.03 -1.09 -0.03 0.00 -0.52 0.00 0.00 55.73 54.06 1ung s ARG 34 Cb -0.12 -2.21 0.04 0.00 0.52 0.00 0.00 34.95 33.17 1ung s ARG 34 CO -0.04 0.50 0.06 0.08 0.02 0.00 0.00 175.30 175.92 1ung s VAL 35 N -1.17 -0.04 0.43 3.52 1.01 -1.26 -4.87 120.40 118.03 1ung s VAL 35 Ca 0.19 0.26 -0.21 0.00 0.00 0.00 0.00 61.98 62.23 1ung s VAL 35 Cb -0.11 -0.29 -0.11 0.00 0.00 0.00 0.00 36.38 35.88 1ung s VAL 35 CO 0.12 0.09 0.96 -0.13 0.00 0.00 0.00 175.10 176.14 1ung s ARG 36 N 2.14 4.19 -0.61 2.72 1.81 -1.26 -2.20 118.95 125.73 1ung s ARG 36 Ca 0.04 1.16 -0.09 0.00 -1.72 0.00 0.00 55.73 55.12 1ung s ARG 36 Cb -0.13 -2.20 0.16 0.00 -0.45 0.00 0.00 34.95 32.33 1ung s ARG 36 CO -0.04 -0.07 0.49 -0.51 -0.68 0.00 0.00 175.30 174.49 1ung s LEU 37 N -3.17 5.90 0.00 2.53 1.43 -1.22 -4.60 118.68 119.55 1ung s LEU 37 Ca 0.62 -2.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.36 1ung s LEU 37 Cb -0.10 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.08 1ung s LEU 37 CO 0.14 -0.59 0.00 -0.90 0.23 0.00 0.00 176.35 175.24 1ung n ASP 38 N 4.30 0.00 -0.24 2.29 5.75 -1.26 -5.09 116.55 122.30 1ung n ASP 38 Ca 0.02 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.77 1ung n ASP 38 Cb 0.42 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1ung n ASP 38 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ung n GLY 43 N 0.00 0.32 0.00 6.12 0.00 -1.26 -5.00 105.19 105.37 1ung n GLY 43 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1ung n GLY 43 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ung n VAL 44 N -3.82 0.00 0.22 1.61 0.31 -1.26 -5.04 118.33 110.34 1ung n VAL 44 Ca -0.03 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.41 1ung n VAL 44 Cb 0.45 0.00 0.36 0.00 -0.91 0.00 0.00 33.84 33.74 1ung n VAL 44 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1ung h PRO 45 N 0.00 0.00 -0.91 5.55 0.11 -1.95 -2.72 132.00 132.08 1ung h PRO 45 Ca 0.00 0.00 0.33 0.00 0.11 0.00 0.00 66.00 66.44 1ung h PRO 45 Cb 0.00 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 30.94 1ung h PRO 45 CO 0.00 0.18 0.31 0.43 -0.21 0.00 0.00 178.00 178.70 1ung n SER 46 N -3.23 0.15 0.02 -2.05 7.64 -1.26 -2.10 113.62 112.79 1ung n SER 46 Ca 0.01 1.52 -0.19 0.00 1.01 0.00 0.00 58.87 61.23 1ung n SER 46 Cb 0.48 -0.67 -0.14 0.00 -1.01 0.00 0.00 64.21 62.87 1ung n SER 46 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1ung h SER 47 N 0.00 0.36 -0.35 6.43 0.02 -1.82 -3.18 113.55 115.01 1ung h SER 47 Ca 0.69 -0.94 -0.04 0.00 -0.84 0.00 0.00 61.79 60.66 1ung h SER 47 Cb 1.69 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 64.09 1ung h SER 47 CO -0.76 1.35 0.09 0.00 -1.14 0.00 0.00 176.83 176.37 1ung h ALA 48 N 0.03 1.38 -0.11 3.77 0.00 -1.64 -0.08 119.26 122.60 1ung h ALA 48 Ca -0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ung h ALA 48 Cb 1.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1ung h ALA 48 CO 0.10 0.45 0.07 -0.07 0.00 0.00 0.00 179.25 179.79 1ung h LEU 49 N 0.61 0.11 -0.48 0.00 3.38 -1.50 -0.93 115.31 116.51 1ung h LEU 49 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ung h LEU 49 Cb 0.25 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1ung h LEU 49 CO -0.00 0.08 0.31 -0.09 0.09 0.00 0.00 178.44 178.83 1ung h ARG 50 N 0.14 0.63 -0.55 1.13 2.43 -1.47 -2.29 114.38 114.40 1ung h ARG 50 Ca 0.04 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1ung h ARG 50 Cb -0.01 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 1ung h ARG 50 CO -0.02 0.43 0.25 1.49 -1.51 0.00 0.00 179.97 180.61 1ung h GLU 51 N 0.64 0.46 0.40 0.20 4.81 -0.72 -1.54 114.58 118.83 1ung h GLU 51 Ca 0.17 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1ung h GLU 51 Cb -0.06 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1ung h GLU 51 CO -0.04 0.30 -0.19 0.82 -0.73 0.00 0.00 179.01 179.18 1ung h ILE 52 N 0.47 0.61 -0.64 2.32 2.04 -1.03 0.28 117.51 121.56 1ung h ILE 52 Ca 0.26 -0.04 0.13 0.00 1.00 0.00 0.00 64.86 66.20 1ung h ILE 52 Cb 0.22 0.63 -0.12 0.00 -0.74 0.00 0.00 36.82 36.81 1ung h ILE 52 CO -0.21 0.01 -0.17 0.00 0.00 0.00 0.00 178.15 177.78 1ung h LEU 54 N -0.01 -0.21 -1.17 0.00 3.38 -1.04 -3.20 115.31 113.06 1ung h LEU 54 Ca 0.31 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1ung h LEU 54 Cb 0.47 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1ung h LEU 54 CO -0.66 0.17 0.19 -0.07 0.09 0.00 0.00 178.44 178.16 1ung h LEU 55 N -0.62 0.71 -1.06 1.67 3.38 -0.61 0.76 115.31 119.54 1ung h LEU 55 Ca -0.03 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1ung h LEU 55 Cb 0.46 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1ung h LEU 55 CO 0.04 0.65 0.07 0.29 0.09 0.00 0.00 178.44 179.58 1ung n LYS 56 N -4.33 0.10 -0.03 1.13 5.02 0.54 -1.52 118.16 119.07 1ung n LYS 56 Ca 0.04 0.59 0.02 0.00 -2.02 0.00 0.00 58.31 56.94 1ung n LYS 56 Cb 0.17 -1.91 0.04 0.00 -0.02 0.00 0.00 35.03 33.30 1ung n LYS 56 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ung n GLU 57 N -2.07 1.64 -3.86 1.97 -0.58 0.20 -4.90 120.64 113.05 1ung n GLU 57 Ca -0.01 -1.31 -0.29 0.00 -0.42 0.00 0.00 57.16 55.13 1ung n GLU 57 Cb 0.10 -1.08 -0.13 0.00 -0.57 0.00 0.00 31.44 29.76 1ung n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ung s LEU 58 N -0.73 4.11 -0.36 -4.62 1.43 -0.57 -5.04 118.68 112.89 1ung s LEU 58 Ca 0.06 -3.29 -0.02 0.00 -1.03 0.00 0.00 54.13 49.85 1ung s LEU 58 Cb 0.03 -1.48 0.09 0.00 0.03 0.00 0.00 46.19 44.86 1ung s LEU 58 CO 0.05 -0.18 0.12 -0.54 0.23 0.00 0.00 176.35 176.03 1ung s LYS 59 N -0.63 2.13 0.04 1.70 -0.14 -1.26 -4.84 119.74 116.74 1ung s LYS 59 Ca 0.21 -1.61 -0.07 0.00 -1.36 0.00 0.00 55.97 53.14 1ung s LYS 59 Cb -0.16 -3.41 -0.00 0.00 -1.68 0.00 0.00 37.83 32.58 1ung s LYS 59 CO -0.08 -0.89 0.14 -1.58 -0.76 0.00 0.00 175.35 172.19 1ung s HIS 60 N 1.17 0.14 -0.44 3.18 2.46 -1.26 -5.02 115.29 115.52 1ung s HIS 60 Ca 0.03 -0.40 0.25 0.00 0.47 0.00 0.00 55.06 55.41 1ung s HIS 60 Cb -0.21 -0.09 1.01 0.00 -0.13 0.00 0.00 32.58 33.15 1ung s HIS 60 CO -0.03 -0.39 1.75 1.57 -2.47 0.00 0.00 174.74 175.16 1ung h LYS 61 N 3.57 0.00 -0.53 2.88 2.10 -1.99 -2.08 116.57 120.53 1ung h LYS 61 Ca -0.32 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.12 1ung h LYS 61 Cb 1.19 0.00 -0.12 0.00 -0.90 0.00 0.00 32.23 32.39 1ung h LYS 61 CO 0.49 0.00 0.14 0.09 -2.00 0.00 0.00 179.45 178.17 1ung n ASN 62 N -2.34 3.50 -3.83 7.07 5.03 -1.26 -4.83 115.26 118.59 1ung n ASN 62 Ca 0.02 -3.47 -0.26 0.00 0.87 0.00 0.00 54.58 51.74 1ung n ASN 62 Cb 0.26 -0.68 -0.17 0.00 -1.02 0.00 0.00 39.78 38.17 1ung n ASN 62 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ung s ILE 63 N -3.12 0.75 -0.45 2.41 1.01 -0.78 -1.60 121.20 119.43 1ung s ILE 63 Ca 0.48 -0.27 -0.40 0.00 0.00 0.00 0.00 60.65 60.46 1ung s ILE 63 Cb 0.41 -0.93 -0.17 0.00 0.01 0.00 0.00 42.46 41.78 1ung s ILE 63 CO 0.07 0.19 1.77 0.55 0.00 0.00 0.00 174.94 177.52 1ung n VAL 64 N 5.01 0.00 -2.23 2.92 3.14 -0.11 -4.54 118.33 122.53 1ung n VAL 64 Ca -0.10 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.86 1ung n VAL 64 Cb 0.49 -0.45 -0.03 0.00 -1.06 0.00 0.00 33.84 32.80 1ung n VAL 64 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 1ung s ARG 65 N 4.61 4.31 -0.19 1.45 3.52 -1.26 -4.93 118.95 126.45 1ung s ARG 65 Ca 1.03 1.98 -0.21 0.00 -0.13 0.00 0.00 55.73 58.41 1ung s ARG 65 Cb -1.34 -3.43 -0.03 0.00 -1.56 0.00 0.00 34.95 28.59 1ung s ARG 65 CO 0.63 -0.49 0.62 -1.17 -0.81 0.00 0.00 175.30 174.08 1ung s LEU 66 N 1.78 4.15 -0.13 -0.88 2.96 -1.26 -1.58 118.68 123.73 1ung s LEU 66 Ca 0.63 0.83 0.06 0.00 -0.22 0.00 0.00 54.13 55.44 1ung s LEU 66 Cb -0.33 -2.88 -0.24 0.00 0.50 0.00 0.00 46.19 43.24 1ung s LEU 66 CO 0.28 -0.26 0.34 1.41 -1.32 0.00 0.00 176.35 176.80 1ung n HIS 67 N 4.97 0.76 -3.63 5.38 8.25 -0.38 -4.96 115.22 125.62 1ung n HIS 67 Ca -0.02 0.22 -0.09 0.00 -0.26 0.00 0.00 57.72 57.57 1ung n HIS 67 Cb 0.50 -1.12 -0.02 0.00 1.12 0.00 0.00 29.99 30.47 1ung n HIS 67 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1ung s ASP 68 N -6.34 -0.39 -0.20 0.41 3.68 -1.17 -5.03 116.67 107.64 1ung s ASP 68 Ca -0.15 -0.27 -0.04 0.00 2.13 0.00 0.00 52.55 54.21 1ung s ASP 68 Cb 0.07 0.61 0.07 0.00 -1.45 0.00 0.00 42.92 42.22 1ung s ASP 68 CO 0.78 -1.07 0.09 -0.69 0.13 0.00 0.00 175.17 174.40 1ung s VAL 69 N -3.70 0.06 0.07 1.11 1.01 -1.26 -1.36 120.40 116.33 1ung s VAL 69 Ca 0.06 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.74 1ung s VAL 69 Cb -0.03 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1ung s VAL 69 CO -0.04 -0.34 -0.06 -0.76 0.00 0.00 0.00 175.10 173.90 1ung s LEU 70 N 2.07 3.19 -0.30 3.92 1.43 -0.00 -5.02 118.68 123.97 1ung s LEU 70 Ca 0.03 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1ung s LEU 70 Cb -0.16 -1.93 0.09 0.00 0.03 0.00 0.00 46.19 44.22 1ung s LEU 70 CO -0.13 0.21 0.05 -2.28 0.23 0.00 0.00 176.35 174.42 1ung s HIS 71 N -1.17 2.46 -0.06 0.29 5.65 -1.26 -1.84 115.29 119.36 1ung s HIS 71 Ca 0.21 -2.10 -0.05 0.00 0.25 0.00 0.00 55.06 53.38 1ung s HIS 71 Cb -0.11 -2.03 0.02 0.00 -1.18 0.00 0.00 32.58 29.28 1ung s HIS 71 CO 0.13 -0.87 0.15 -1.54 -0.65 0.00 0.00 174.74 171.96 1ung s SER 72 N 1.36 -0.15 -0.92 9.88 1.04 -1.22 -5.00 113.70 118.69 1ung s SER 72 Ca 0.06 0.30 -0.09 0.00 0.48 0.00 0.00 55.95 56.71 1ung s SER 72 Cb -0.18 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.23 1ung s SER 72 CO -0.15 -0.07 0.64 0.47 0.98 0.00 0.00 173.24 175.11 1ung n ASP 73 N 3.22 -5.04 0.00 7.02 8.00 -1.26 -1.69 116.55 126.81 1ung n ASP 73 Ca -0.15 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1ung n ASP 73 Cb 0.58 -2.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.51 1ung n ASP 73 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ung n LYS 74 N -3.17 -0.80 -4.43 -1.24 5.02 -1.26 -4.96 118.16 107.32 1ung n LYS 74 Ca -0.23 0.20 -0.26 0.00 -2.02 0.00 0.00 58.31 56.00 1ung n LYS 74 Cb 0.64 -4.25 -0.09 0.00 -0.02 0.00 0.00 35.03 31.31 1ung n LYS 74 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ung s LYS 75 N -1.14 2.00 -0.42 1.97 -0.14 -0.68 -3.43 119.74 117.90 1ung s LYS 75 Ca 0.00 -1.90 0.11 0.00 -1.36 0.00 0.00 55.97 52.82 1ung s LYS 75 Cb 0.00 -1.81 0.38 0.00 -1.68 0.00 0.00 37.83 34.72 1ung s LYS 75 CO 0.00 0.06 0.86 -0.11 -0.76 0.00 0.00 175.35 175.40 1ung n LEU 76 N -0.95 2.24 -4.38 3.17 7.94 -0.94 -3.38 117.00 120.70 1ung n LEU 76 Ca -0.04 -4.95 -0.52 0.00 -1.11 0.00 0.00 56.01 49.39 1ung n LEU 76 Cb 0.64 0.23 -0.09 0.00 0.53 0.00 0.00 43.42 44.73 1ung n LEU 76 CO 0.45 2.16 1.83 0.41 -1.11 0.00 0.00 177.39 181.13 1ung n THR 77 N 0.01 0.09 -3.05 1.96 -1.04 -0.76 -4.37 114.28 107.11 1ung n THR 77 Ca 0.25 -0.17 -0.38 0.00 -2.04 0.00 0.00 64.05 61.71 1ung n THR 77 Cb 0.62 -1.18 -0.06 0.00 -1.82 0.00 0.00 70.33 67.90 1ung n THR 77 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1ung s LEU 78 N 7.22 4.47 -0.19 -4.42 1.43 0.15 -0.82 118.68 126.52 1ung s LEU 78 Ca 1.15 1.52 0.01 0.00 -1.03 0.00 0.00 54.13 55.79 1ung s LEU 78 Cb -1.10 -3.42 0.03 0.00 0.03 0.00 0.00 46.19 41.73 1ung s LEU 78 CO 0.54 0.13 -0.17 -0.69 0.23 0.00 0.00 176.35 176.39 1ung s VAL 79 N -1.33 1.98 0.27 -1.59 1.01 -0.46 0.33 120.40 120.61 1ung s VAL 79 Ca 0.39 -1.02 0.11 0.00 0.00 0.00 0.00 61.98 61.46 1ung s VAL 79 Cb -0.20 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 1ung s VAL 79 CO 0.23 0.41 -0.09 -0.36 0.00 0.00 0.00 175.10 175.28 1ung s PHE 80 N 1.29 2.51 0.44 5.22 0.40 0.31 -1.25 117.98 126.90 1ung s PHE 80 Ca 0.02 -0.27 -0.25 0.00 -0.60 0.00 0.00 56.93 55.83 1ung s PHE 80 Cb -0.14 -1.10 -0.09 0.00 0.51 0.00 0.00 43.02 42.19 1ung s PHE 80 CO -0.11 0.66 1.24 -0.85 0.70 0.00 0.00 175.22 176.86 1ung n GLU 81 N -0.75 1.81 -3.07 0.44 0.28 -0.61 -0.71 120.64 118.02 1ung n GLU 81 Ca -0.06 0.65 -0.39 0.00 -0.16 0.00 0.00 57.16 57.20 1ung n GLU 81 Cb 0.59 -2.36 -0.06 0.00 1.43 0.00 0.00 31.44 31.05 1ung n GLU 81 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1ung s PHE 82 N -1.23 3.79 0.01 -1.84 2.19 -1.26 -4.19 117.98 115.46 1ung s PHE 82 Ca 0.63 1.43 0.06 0.00 0.33 0.00 0.00 56.93 59.39 1ung s PHE 82 Cb -0.50 -2.71 -0.03 0.00 -1.31 0.00 0.00 43.02 38.47 1ung s PHE 82 CO 0.57 0.41 -0.18 0.00 1.83 0.00 0.00 175.22 177.85 1ung h ASP 84 N 4.82 0.05 -5.29 0.00 3.45 -1.94 -3.47 116.42 114.04 1ung h ASP 84 Ca -0.47 -0.17 -0.08 0.00 0.43 0.00 0.00 57.03 56.74 1ung h ASP 84 Cb 1.15 -0.01 -0.10 0.00 -0.56 0.00 0.00 39.33 39.81 1ung h ASP 84 CO 0.48 0.21 -0.19 0.00 -1.57 0.00 0.00 179.24 178.17 1ung s GLN 85 N -5.51 1.48 0.54 3.56 -2.07 -0.93 -5.03 119.66 111.71 1ung s GLN 85 Ca -0.14 -1.29 0.04 0.00 -1.82 0.00 0.00 55.36 52.15 1ung s GLN 85 Cb 0.05 0.44 0.05 0.00 -1.09 0.00 0.00 33.01 32.46 1ung s GLN 85 CO 0.67 -0.60 0.75 0.16 -1.32 0.00 0.00 175.29 174.96 1ung s ASP 86 N -3.03 5.21 0.46 12.60 1.47 -1.26 -0.50 116.67 131.61 1ung s ASP 86 Ca 0.24 -0.31 0.18 0.00 1.18 0.00 0.00 52.55 53.84 1ung s ASP 86 Cb 0.00 -0.50 1.08 0.00 -0.34 0.00 0.00 42.92 43.16 1ung s ASP 86 CO 0.09 -1.18 1.99 0.25 0.68 0.00 0.00 175.17 177.00 1ung h LEU 87 N 0.15 0.00 0.25 2.11 5.85 -0.97 -0.68 115.31 122.03 1ung h LEU 87 Ca -0.39 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1ung h LEU 87 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1ung h LEU 87 CO 0.47 0.20 -0.12 0.50 -0.34 0.00 0.00 178.44 179.14 1ung h LYS 88 N 0.00 -0.33 0.00 1.25 1.63 -1.85 0.16 116.57 117.43 1ung h LYS 88 Ca -0.00 0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.76 1ung h LYS 88 Cb 0.38 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.08 1ung h LYS 88 CO 0.03 -0.09 -0.28 -0.22 -3.45 0.00 0.00 179.45 175.44 1ung h LYS 89 N -0.52 0.00 -0.33 1.90 3.64 -1.90 -2.95 116.57 116.40 1ung h LYS 89 Ca -0.03 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1ung h LYS 89 Cb 0.39 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1ung h LYS 89 CO 0.06 0.28 0.14 -0.92 -2.27 0.00 0.00 179.45 176.74 1ung h TYR 90 N 0.00 0.50 -0.59 1.91 3.20 -0.64 -1.21 116.97 120.14 1ung h TYR 90 Ca -0.00 -0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.95 1ung h TYR 90 Cb 0.49 -0.15 -0.11 0.00 1.54 0.00 0.00 36.73 38.50 1ung h TYR 90 CO 0.00 0.46 -0.14 0.74 -1.64 0.00 0.00 178.16 177.57 1ung h PHE 91 N 0.40 -0.31 0.00 -3.82 0.05 -0.81 -2.48 116.94 109.96 1ung h PHE 91 Ca 0.11 0.05 -0.04 0.00 3.82 0.00 0.00 57.97 61.92 1ung h PHE 91 Cb 0.16 0.23 -0.01 0.00 2.00 0.00 0.00 35.95 38.33 1ung h PHE 91 CO -0.01 -0.25 -0.19 -0.44 -0.18 0.00 0.00 178.31 177.24 1ung h ASP 92 N 0.00 0.00 0.97 2.17 3.45 -1.34 0.24 116.42 121.91 1ung h ASP 92 Ca 0.28 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.73 1ung h ASP 92 Cb 0.43 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 1ung h ASP 92 CO -0.60 0.19 -0.04 0.28 -1.57 0.00 0.00 179.24 177.49 1ung h SER 93 N 0.00 0.00 0.00 6.45 0.02 -0.75 -3.34 113.55 115.93 1ung h SER 93 Ca -0.00 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 1ung h SER 93 Cb 0.36 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 62.58 1ung h SER 93 CO 0.02 0.04 -0.94 0.00 -1.14 0.00 0.00 176.83 174.82 1ung n ASN 95 N 0.31 -5.16 -1.34 0.00 4.05 -1.12 -0.21 115.26 111.79 1ung n ASN 95 Ca 0.07 0.02 -0.17 0.00 0.45 0.00 0.00 54.58 54.94 1ung n ASN 95 Cb 1.07 -4.24 -0.07 0.00 1.23 0.00 0.00 39.78 37.76 1ung n ASN 95 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1ung n GLY 96 N -1.00 1.66 3.04 8.20 0.00 0.83 -4.93 105.19 112.99 1ung n GLY 96 Ca -0.21 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1ung n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ung s ASP 97 N -2.65 4.88 0.05 1.61 -1.08 0.70 -3.34 116.67 116.84 1ung s ASP 97 Ca 0.00 -2.76 -0.17 0.00 -0.52 0.00 0.00 52.55 49.10 1ung s ASP 97 Cb 0.00 -1.76 -0.06 0.00 -1.46 0.00 0.00 42.92 39.64 1ung s ASP 97 CO 0.00 -0.34 0.51 -0.76 0.52 0.00 0.00 175.17 175.10 1ung s LEU 98 N 0.07 4.49 0.27 -1.34 1.43 -1.26 -4.95 118.68 117.40 1ung s LEU 98 Ca 0.15 1.14 -0.30 0.00 -1.03 0.00 0.00 54.13 54.09 1ung s LEU 98 Cb -0.22 -2.82 -0.13 0.00 0.03 0.00 0.00 46.19 43.05 1ung s LEU 98 CO -0.03 0.28 1.39 -0.67 0.23 0.00 0.00 176.35 177.55 1ung n ASP 99 N 1.66 2.86 0.11 2.29 -0.08 -1.26 -4.85 116.55 117.29 1ung n ASP 99 Ca -0.11 1.16 0.20 0.00 -1.51 0.00 0.00 54.79 54.53 1ung n ASP 99 Cb 0.51 -1.46 0.73 0.00 2.34 0.00 0.00 41.12 43.24 1ung n ASP 99 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1ung h PRO 100 N 3.81 0.00 0.00 -0.67 0.11 -1.97 0.37 132.00 133.66 1ung h PRO 100 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ung h PRO 100 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1ung h PRO 100 CO 0.72 0.00 -0.28 1.49 -0.21 0.00 0.00 178.00 179.72 1ung h GLU 101 N 0.00 0.00 0.05 1.05 4.57 -1.97 -3.17 114.58 115.11 1ung h GLU 101 Ca 0.18 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 58.11 1ung h GLU 101 Cb 1.15 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1ung h GLU 101 CO -0.00 0.00 -1.06 0.82 -1.18 0.00 0.00 179.01 177.59 1ung h ILE 102 N 0.00 1.38 -0.10 2.32 1.08 -0.62 -2.64 117.51 118.94 1ung h ILE 102 Ca 0.00 -2.53 0.03 0.00 -0.39 0.00 0.00 64.86 61.96 1ung h ILE 102 Cb 0.86 2.56 -0.03 0.00 -3.07 0.00 0.00 36.82 37.13 1ung h ILE 102 CO 0.00 0.76 -0.07 0.58 -0.69 0.00 0.00 178.15 178.73 1ung h VAL 103 N 0.23 0.80 -0.93 1.67 2.07 -1.45 -0.15 116.25 118.49 1ung h VAL 103 Ca -0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1ung h VAL 103 Cb 1.72 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.24 1ung h VAL 103 CO 0.19 0.00 0.59 0.50 0.02 0.00 0.00 177.57 178.87 1ung h LYS 104 N -0.07 1.24 -0.17 1.57 3.64 -1.61 0.03 116.57 121.20 1ung h LYS 104 Ca 0.06 -0.09 -0.19 0.00 -1.27 0.00 0.00 60.65 59.16 1ung h LYS 104 Cb 0.16 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1ung h LYS 104 CO -0.14 0.84 -0.65 1.03 -2.27 0.00 0.00 179.45 178.26 1ung h SER 105 N 1.27 0.72 -0.30 4.20 0.87 -1.14 0.85 113.55 120.02 1ung h SER 105 Ca 0.34 -0.43 -0.17 0.00 -1.23 0.00 0.00 61.79 60.30 1ung h SER 105 Cb -0.10 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.64 1ung h SER 105 CO -0.07 1.19 -0.46 -0.26 -0.53 0.00 0.00 176.83 176.70 1ung h PHE 106 N 0.46 1.04 -0.38 2.24 -1.00 -0.50 -2.17 116.94 116.63 1ung h PHE 106 Ca -0.02 -0.35 -0.11 0.00 2.81 0.00 0.00 57.97 60.31 1ung h PHE 106 Cb 1.24 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 40.58 1ung h PHE 106 CO 0.06 1.16 -0.18 1.25 -1.61 0.00 0.00 178.31 179.00 1ung h LEU 107 N 0.62 0.82 -0.26 1.54 5.85 -0.95 -1.11 115.31 121.82 1ung h LEU 107 Ca 0.03 -0.40 0.05 0.00 0.84 0.00 0.00 57.88 58.39 1ung h LEU 107 Cb 1.06 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.82 1ung h LEU 107 CO 0.11 1.04 -0.04 0.15 -0.34 0.00 0.00 178.44 179.36 1ung h PHE 108 N 0.60 -0.09 -0.14 1.25 3.57 -0.82 0.25 116.94 121.56 1ung h PHE 108 Ca 0.09 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.46 1ung h PHE 108 Cb 0.73 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 1ung h PHE 108 CO 0.06 -0.08 -0.55 1.96 -2.23 0.00 0.00 178.31 177.46 1ung h GLN 109 N 0.03 0.41 -0.26 1.11 4.20 -1.33 -1.46 115.11 117.82 1ung h GLN 109 Ca 0.12 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 1ung h GLN 109 Cb 0.18 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1ung h GLN 109 CO -0.24 0.86 0.15 1.25 -0.67 0.00 0.00 178.83 180.17 1ung h LEU 110 N 0.32 0.32 -1.17 1.46 5.85 -0.72 -1.86 115.31 119.51 1ung h LEU 110 Ca 0.00 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1ung h LEU 110 Cb 1.07 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 1ung h LEU 110 CO 0.10 0.29 0.27 -0.07 -0.34 0.00 0.00 178.44 178.69 1ung h LEU 111 N 0.32 0.77 -0.50 2.25 3.38 -0.18 0.24 115.31 121.59 1ung h LEU 111 Ca 0.09 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1ung h LEU 111 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1ung h LEU 111 CO -0.02 0.67 -0.06 0.11 0.09 0.00 0.00 178.44 179.23 1ung h LYS 112 N 0.85 0.93 -0.26 1.13 1.57 -1.17 1.01 116.57 120.63 1ung h LYS 112 Ca 0.21 -0.33 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 1ung h LYS 112 Cb 0.12 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1ung h LYS 112 CO -0.02 0.99 -0.46 0.78 -0.57 0.00 0.00 179.45 180.16 1ung h GLY 113 N 0.79 0.74 0.74 3.86 0.00 -1.06 -1.89 103.07 106.26 1ung h GLY 113 Ca 0.13 -0.79 -0.09 0.00 0.00 0.00 0.00 47.33 46.58 1ung h GLY 113 CO 0.04 0.71 -0.29 1.41 0.00 0.00 0.00 176.54 178.41 1ung h LEU 114 N 0.54 0.44 -0.73 3.11 3.38 -0.85 -2.29 115.31 118.92 1ung h LEU 114 Ca 0.03 -0.59 0.13 0.00 0.09 0.00 0.00 57.88 57.55 1ung h LEU 114 Cb 1.01 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.54 1ung h LEU 114 CO 0.09 0.95 0.28 1.23 0.09 0.00 0.00 178.44 181.08 1ung h GLY 115 N -0.04 1.08 0.71 0.83 0.00 0.10 -1.03 103.07 104.72 1ung h GLY 115 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1ung h GLY 115 CO 0.06 -0.09 -0.00 -2.75 0.00 0.00 0.00 176.54 173.76 1ung h PHE 116 N 0.42 0.09 -0.57 5.60 3.57 -1.26 -2.08 116.94 122.72 1ung h PHE 116 Ca 0.40 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.99 1ung h PHE 116 Cb 0.59 -0.02 -0.11 0.00 2.79 0.00 0.00 35.95 39.20 1ung h PHE 116 CO -0.17 0.38 -0.15 0.00 -2.23 0.00 0.00 178.31 176.14 1ung h HIS 118 N -0.00 0.85 0.00 0.00 3.86 -1.12 -0.05 115.15 118.69 1ung h HIS 118 Ca 0.27 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 1ung h HIS 118 Cb 0.42 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1ung h HIS 118 CO -0.48 0.82 0.00 0.66 0.86 0.00 0.00 177.93 179.79 1ung h SER 119 N 0.73 0.00 -0.46 2.45 4.64 -0.75 -2.66 113.55 117.50 1ung h SER 119 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1ung h SER 119 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1ung h SER 119 CO 0.03 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.53 1ung n ARG 120 N -2.60 3.27 -3.33 4.77 5.12 -0.87 -4.97 116.66 118.04 1ung n ARG 120 Ca 0.03 -2.63 -0.18 0.00 -1.93 0.00 0.00 57.85 53.14 1ung n ARG 120 Cb 0.34 -1.69 0.06 0.00 -1.16 0.00 0.00 32.46 30.01 1ung n ARG 120 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1ung n ASN 121 N 0.54 -5.37 -4.05 0.55 3.02 -1.00 -5.01 115.26 103.93 1ung n ASN 121 Ca 0.20 -0.41 -0.25 0.00 -0.03 0.00 0.00 54.58 54.10 1ung n ASN 121 Cb 0.75 -3.98 -0.16 0.00 -0.61 0.00 0.00 39.78 35.78 1ung n ASN 121 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ung s VAL 122 N -3.24 1.20 -0.16 2.41 1.01 -0.09 -1.52 120.40 120.02 1ung s VAL 122 Ca 0.45 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.81 1ung s VAL 122 Cb -0.20 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 1ung s VAL 122 CO 0.55 0.36 0.13 -0.76 0.00 0.00 0.00 175.10 175.39 1ung s LEU 123 N 0.47 4.26 -0.14 3.92 1.43 -0.67 -3.70 118.68 124.26 1ung s LEU 123 Ca -0.11 0.34 -0.28 0.00 -1.03 0.00 0.00 54.13 53.04 1ung s LEU 123 Cb -0.14 -2.07 -0.25 0.00 0.03 0.00 0.00 46.19 43.76 1ung s LEU 123 CO 0.03 0.29 0.77 -0.74 0.23 0.00 0.00 176.35 176.94 1ung h HIS 124 N 5.82 -0.00 -0.13 0.29 -0.00 -1.92 -2.02 115.15 117.20 1ung h HIS 124 Ca -0.48 -0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 59.83 1ung h HIS 124 Cb 1.19 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.58 1ung h HIS 124 CO 0.67 0.96 -0.05 0.54 -0.00 0.00 0.00 177.93 180.04 1ung n ARG 125 N -4.62 -1.68 -2.58 5.26 1.74 -1.26 -3.02 116.66 110.49 1ung n ARG 125 Ca -0.10 0.55 -0.00 0.00 -0.77 0.00 0.00 57.85 57.53 1ung n ARG 125 Cb 0.46 -4.86 0.06 0.00 -1.02 0.00 0.00 32.46 27.10 1ung n ARG 125 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ung n ASP 126 N -0.89 0.62 -4.67 0.55 4.64 -1.26 -1.59 116.55 113.94 1ung n ASP 126 Ca -0.03 -2.07 -0.42 0.00 -1.38 0.00 0.00 54.79 50.89 1ung n ASP 126 Cb 0.46 -0.13 -0.03 0.00 -1.04 0.00 0.00 41.12 40.39 1ung n ASP 126 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 1ung s LEU 127 N -3.34 4.28 0.13 -2.67 2.96 -1.26 -4.82 118.68 113.96 1ung s LEU 127 Ca 0.22 2.03 -0.25 0.00 -0.22 0.00 0.00 54.13 55.91 1ung s LEU 127 Cb 0.35 -3.55 0.07 0.00 0.50 0.00 0.00 46.19 43.56 1ung s LEU 127 CO -0.07 -0.79 0.77 -1.59 -1.32 0.00 0.00 176.35 173.35 1ung s LYS 128 N 3.18 1.23 0.42 1.98 -2.85 -1.26 -4.82 119.74 117.62 1ung s LYS 128 Ca 0.64 -0.56 0.10 0.00 -1.00 0.00 0.00 55.97 55.15 1ung s LYS 128 Cb -0.29 0.50 0.90 0.00 -2.06 0.00 0.00 37.83 36.88 1ung s LYS 128 CO 0.24 -0.55 2.01 -1.35 0.10 0.00 0.00 175.35 175.80 1ung h PRO 129 N 2.00 0.28 -0.00 1.78 0.11 -1.94 -1.89 132.00 132.34 1ung h PRO 129 Ca -0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1ung h PRO 129 Cb 1.26 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ung h PRO 129 CO 0.31 0.30 0.01 1.96 -0.21 0.00 0.00 178.00 180.36 1ung h GLN 130 N 0.28 0.00 -0.49 1.05 7.50 -1.96 -1.81 115.11 119.68 1ung h GLN 130 Ca 0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.22 1ung h GLN 130 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.69 1ung h GLN 130 CO 0.00 0.00 0.00 0.09 -1.50 0.00 0.00 178.83 177.42 1ung n ASN 131 N -3.26 3.51 -4.42 1.46 5.03 -0.71 -4.80 115.26 112.07 1ung n ASN 131 Ca -0.03 -1.97 -0.37 0.00 0.87 0.00 0.00 54.58 53.08 1ung n ASN 131 Cb 0.08 -0.32 -0.12 0.00 -1.02 0.00 0.00 39.78 38.40 1ung n ASN 131 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1ung s LEU 132 N -1.22 3.71 -0.12 3.41 1.02 -0.70 -1.33 118.68 123.46 1ung s LEU 132 Ca 0.39 -0.41 -0.06 0.00 0.02 0.00 0.00 54.13 54.07 1ung s LEU 132 Cb 0.22 -1.93 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 1ung s LEU 132 CO 0.29 -0.11 0.12 -0.76 0.02 0.00 0.00 176.35 175.91 1ung s LEU 133 N 1.59 4.25 -0.07 1.79 1.43 0.66 -1.16 118.68 127.16 1ung s LEU 133 Ca 0.05 0.41 0.04 0.00 -1.03 0.00 0.00 54.13 53.59 1ung s LEU 133 Cb -0.16 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1ung s LEU 133 CO 0.04 0.39 -0.19 -0.63 0.23 0.00 0.00 176.35 176.20 1ung s ILE 134 N -0.94 1.62 0.27 -0.59 1.09 0.34 0.64 121.20 123.64 1ung s ILE 134 Ca 0.14 -0.78 -0.00 0.00 -1.10 0.00 0.00 60.65 58.91 1ung s ILE 134 Cb -0.12 -1.42 -0.04 0.00 -1.06 0.00 0.00 42.46 39.83 1ung s ILE 134 CO 0.03 0.46 0.46 0.20 -0.10 0.00 0.00 174.94 176.00 1ung s ASN 135 N 0.35 6.35 0.29 3.58 0.01 -0.30 -2.20 114.94 123.02 1ung s ASN 135 Ca -0.13 0.42 -0.01 0.00 -0.71 0.00 0.00 52.86 52.42 1ung s ASN 135 Cb -0.16 -2.02 0.45 0.00 0.41 0.00 0.00 41.25 39.94 1ung s ASN 135 CO 0.05 -0.16 1.93 -0.09 -1.51 0.00 0.00 177.10 177.33 1ung h ARG 136 N 1.41 1.09 0.00 -0.60 2.43 -1.99 0.62 114.38 117.33 1ung h ARG 136 Ca -0.49 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 1ung h ARG 136 Cb 1.21 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1ung h ARG 136 CO 0.64 0.72 0.00 -2.95 -1.51 0.00 0.00 179.97 176.87 1ung h ASN 137 N 1.12 0.00 0.00 -3.80 7.08 -2.06 -3.46 115.58 114.46 1ung h ASN 137 Ca 0.36 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.58 1ung h ASN 137 Cb 0.03 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 1ung h ASN 137 CO -0.11 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.85 1ung n GLY 138 N -1.06 1.07 3.68 9.14 0.00 0.22 -5.07 105.19 113.17 1ung n GLY 138 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1ung n GLY 138 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ung s GLU 139 N -0.12 4.35 -0.17 1.61 2.02 -1.25 -4.83 118.70 120.32 1ung s GLU 139 Ca 0.00 1.42 -0.14 0.00 0.02 0.00 0.00 54.97 56.27 1ung s GLU 139 Cb 0.00 -3.59 -0.05 0.00 0.10 0.00 0.00 34.13 30.59 1ung s GLU 139 CO 0.00 -0.46 0.29 -1.17 0.02 0.00 0.00 175.26 173.95 1ung s LEU 140 N 2.52 4.23 0.06 1.80 0.20 -1.26 -1.15 118.68 125.09 1ung s LEU 140 Ca 0.48 0.49 0.07 0.00 0.69 0.00 0.00 54.13 55.86 1ung s LEU 140 Cb -0.18 -2.37 -0.03 0.00 -0.43 0.00 0.00 46.19 43.18 1ung s LEU 140 CO 0.14 0.09 -0.20 -0.54 -0.29 0.00 0.00 176.35 175.55 1ung s LYS 141 N 0.54 1.24 0.01 1.98 1.02 0.21 -4.70 119.74 120.04 1ung s LYS 141 Ca 0.16 -0.97 -0.19 0.00 0.02 0.00 0.00 55.97 55.00 1ung s LYS 141 Cb -0.13 -1.38 -0.06 0.00 -0.52 0.00 0.00 37.83 35.74 1ung s LYS 141 CO 0.04 0.34 0.53 -1.17 -0.92 0.00 0.00 175.35 174.17 1ung s LEU 142 N -1.36 4.45 0.30 3.17 0.20 -0.63 -0.25 118.68 124.56 1ung s LEU 142 Ca 0.06 1.11 0.03 0.00 0.69 0.00 0.00 54.13 56.02 1ung s LEU 142 Cb -0.09 -2.82 -0.04 0.00 -0.43 0.00 0.00 46.19 42.82 1ung s LEU 142 CO 0.02 0.19 0.16 0.00 -0.29 0.00 0.00 176.35 176.43 1ung s ALA 143 N -0.57 1.91 -0.48 5.97 0.00 -0.44 -0.93 121.76 127.21 1ung s ALA 143 Ca 0.28 -1.77 -0.13 0.00 0.00 0.00 0.00 51.96 50.35 1ung s ALA 143 Cb -0.18 1.16 0.02 0.00 0.00 0.00 0.00 23.12 24.12 1ung s ALA 143 CO 0.16 -0.51 0.61 -1.71 0.00 0.00 0.00 175.76 174.31 1ung n ASN 144 N -0.89 -7.80 -1.62 0.00 2.85 -1.26 -4.86 115.26 101.68 1ung n ASN 144 Ca 0.01 0.41 0.03 0.00 -0.11 0.00 0.00 54.58 54.92 1ung n ASN 144 Cb 0.65 -5.29 0.32 0.00 1.24 0.00 0.00 39.78 36.70 1ung n ASN 144 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1ung n PHE 145 N -0.59 1.85 0.22 1.20 3.01 -1.26 -4.46 117.46 117.43 1ung n PHE 145 Ca 0.09 -0.97 0.05 0.00 1.01 0.00 0.00 57.45 57.63 1ung n PHE 145 Cb 0.46 -0.52 0.48 0.00 -0.01 0.00 0.00 39.48 39.89 1ung n PHE 145 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1ung h GLY 146 N 2.82 0.00 0.11 1.37 0.00 -1.92 -2.41 103.07 103.04 1ung h GLY 146 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1ung h GLY 146 CO 0.50 0.00 -0.74 1.04 0.00 0.00 0.00 176.54 177.33 1ung n LEU 147 N -4.17 1.04 -4.70 3.11 4.32 -1.26 -4.84 117.00 110.50 1ung n LEU 147 Ca -0.02 -0.40 -0.34 0.00 -0.02 0.00 0.00 56.01 55.23 1ung n LEU 147 Cb 0.30 -0.07 0.12 0.00 -1.62 0.00 0.00 43.42 42.14 1ung n LEU 147 CO 0.36 0.24 0.78 0.00 -1.22 0.00 0.00 177.39 177.55 1ung s ALA 148 N -2.88 1.92 0.14 -1.18 0.00 -0.91 -4.78 121.76 114.08 1ung s ALA 148 Ca 0.12 0.87 -0.13 0.00 0.00 0.00 0.00 51.96 52.81 1ung s ALA 148 Cb 0.17 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.81 1ung s ALA 148 CO 0.76 -2.17 0.36 -0.98 0.00 0.00 0.00 175.76 173.73 1ung s ARG 149 N -4.06 1.12 0.24 0.00 1.70 -0.76 -4.91 118.95 112.29 1ung s ARG 149 Ca 0.74 -0.90 -0.29 0.00 -0.47 0.00 0.00 55.73 54.81 1ung s ARG 149 Cb -0.29 0.44 -0.09 0.00 -0.57 0.00 0.00 34.95 34.43 1ung s ARG 149 CO 0.49 -0.43 0.92 0.00 -1.08 0.00 0.00 175.30 175.20 1ung s ALA 150 N -3.87 3.33 0.25 7.88 0.00 -1.26 -1.67 121.76 126.42 1ung s ALA 150 Ca 0.08 0.56 0.12 0.00 0.00 0.00 0.00 51.96 52.72 1ung s ALA 150 Cb 0.02 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 1ung s ALA 150 CO -0.07 0.22 -0.21 -0.59 0.00 0.00 0.00 175.76 175.11 1ung s PHE 151 N -1.26 2.26 0.00 0.00 -0.71 -0.57 -4.93 117.98 112.77 1ung s PHE 151 Ca 0.42 -0.35 0.00 0.00 -1.04 0.00 0.00 56.93 55.96 1ung s PHE 151 Cb -0.24 -1.03 0.00 0.00 -1.21 0.00 0.00 43.02 40.54 1ung s PHE 151 CO 0.30 0.63 0.00 0.41 -1.34 0.00 0.00 175.22 175.22 1ung n GLY 152 N -0.32 -0.08 3.67 1.99 0.00 -1.26 -4.77 105.19 104.42 1ung n GLY 152 Ca -0.08 0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1ung n GLY 152 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ung s ILE 153 N 0.00 3.06 -0.72 -0.61 -4.36 -1.26 -4.82 121.20 112.49 1ung s ILE 153 Ca 0.00 0.26 -0.35 0.00 -0.26 0.00 0.00 60.65 60.30 1ung s ILE 153 Cb 0.00 -3.17 -0.19 0.00 1.25 0.00 0.00 42.46 40.35 1ung s ILE 153 CO 0.00 -0.02 2.28 -2.65 0.24 0.00 0.00 174.94 174.80 1ung n PRO 154 N 6.80 0.00 -3.75 0.37 -0.02 -1.26 -4.92 135.00 132.22 1ung n PRO 154 Ca 0.18 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.46 1ung n PRO 154 Cb 0.41 -1.40 -0.01 0.00 -0.02 0.00 0.00 33.50 32.47 1ung n PRO 154 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ung s VAL 155 N 7.12 4.75 0.13 -1.45 -7.23 -1.26 -5.01 120.40 117.44 1ung s VAL 155 Ca 1.20 -0.99 -0.09 0.00 -1.81 0.00 0.00 61.98 60.28 1ung s VAL 155 Cb -1.28 -3.66 -0.11 0.00 0.56 0.00 0.00 36.38 31.89 1ung s VAL 155 CO 0.53 -0.26 1.39 0.03 -0.31 0.00 0.00 175.10 176.48 1ung h ARG 156 N 1.05 0.74 0.00 4.82 2.47 -1.98 -3.49 114.38 117.99 1ung h ARG 156 Ca -0.49 -0.53 0.00 0.00 -1.26 0.00 0.00 59.98 57.70 1ung h ARG 156 Cb 1.24 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.65 1ung h ARG 156 CO 0.57 1.15 0.00 0.00 0.56 0.00 0.00 179.97 182.26 1ung s TYR 158 N -2.00 1.85 0.40 0.00 4.12 -0.33 -5.05 117.35 116.35 1ung s TYR 158 Ca 0.00 -1.13 -0.17 0.00 0.02 0.00 0.00 57.07 55.79 1ung s TYR 158 Cb 0.00 -1.35 -0.09 0.00 -1.52 0.00 0.00 41.96 39.00 1ung s TYR 158 CO 0.00 -0.07 0.86 0.45 0.02 0.00 0.00 175.55 176.81 1ung s SER 159 N -3.70 6.80 0.00 2.29 0.15 -1.26 -4.57 113.70 113.41 1ung s SER 159 Ca 0.18 1.47 0.28 0.00 0.70 0.00 0.00 55.95 58.58 1ung s SER 159 Cb 0.03 -2.45 1.07 0.00 -1.71 0.00 0.00 66.02 62.96 1ung s SER 159 CO 0.11 -0.34 1.76 0.00 1.20 0.00 0.00 173.24 175.96 1ung n ALA 160 N -0.73 2.73 -1.70 5.45 0.00 -1.26 -4.54 120.51 120.46 1ung n ALA 160 Ca 0.05 -0.39 -0.33 0.00 0.00 0.00 0.00 53.44 52.77 1ung n ALA 160 Cb 0.54 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 18.74 1ung n ALA 160 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ung n GLU 161 N -0.26 3.47 -4.07 0.00 1.02 -1.26 -4.90 120.64 114.63 1ung n GLU 161 Ca 0.17 -2.82 -0.13 0.00 -0.02 0.00 0.00 57.16 54.37 1ung n GLU 161 Cb 0.32 -2.39 -0.11 0.00 -0.02 0.00 0.00 31.44 29.25 1ung n GLU 161 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1ung s VAL 162 N -1.49 0.56 0.15 2.62 -7.23 -1.26 -5.08 120.40 108.66 1ung s VAL 162 Ca 0.57 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 1ung s VAL 162 Cb 0.28 -0.74 0.00 0.00 0.56 0.00 0.00 36.38 36.48 1ung s VAL 162 CO -0.15 -0.44 0.00 0.52 -0.31 0.00 0.00 175.10 174.72 1ung n VAL 163 N 1.28 -2.50 -2.15 1.32 0.31 -0.62 -4.92 118.33 111.04 1ung n VAL 163 Ca -0.21 0.83 -0.39 0.00 -0.01 0.00 0.00 64.34 64.56 1ung n VAL 163 Cb 0.55 -1.49 -0.01 0.00 -0.91 0.00 0.00 33.84 31.98 1ung n VAL 163 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1ung s THR 164 N -1.83 2.84 0.16 2.52 2.01 -1.26 -4.75 115.64 115.33 1ung s THR 164 Ca 0.00 0.74 -0.11 0.00 0.31 0.00 0.00 61.69 62.63 1ung s THR 164 Cb 0.00 -3.43 0.18 0.00 0.01 0.00 0.00 72.50 69.26 1ung s THR 164 CO 0.00 0.10 1.07 -0.11 -0.69 0.00 0.00 174.62 174.99 1ung n LEU 165 N 0.19 -0.42 0.26 4.42 7.94 -1.26 -0.98 117.00 127.14 1ung n LEU 165 Ca 0.03 1.20 0.17 0.00 -1.11 0.00 0.00 56.01 56.30 1ung n LEU 165 Cb 0.44 -0.28 0.81 0.00 0.53 0.00 0.00 43.42 44.92 1ung n LEU 165 CO 0.54 -1.08 1.01 -0.50 -1.11 0.00 0.00 177.39 176.25 1ung h TRP 166 N 0.00 0.00 -0.11 1.96 6.55 -1.91 -1.82 115.95 120.62 1ung h TRP 166 Ca 0.25 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.09 1ung h TRP 166 Cb 0.42 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.72 1ung h TRP 166 CO -0.59 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 177.46 1ung n TYR 167 N -2.84 0.14 -2.77 0.49 4.01 -0.16 -4.64 117.16 111.39 1ung n TYR 167 Ca -0.01 -0.20 -0.42 0.00 -0.16 0.00 0.00 57.90 57.12 1ung n TYR 167 Cb 0.18 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 1ung n TYR 167 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1ung s ARG 168 N -0.83 4.45 0.56 -0.72 3.52 -0.69 -4.03 118.95 121.21 1ung s ARG 168 Ca 0.13 1.27 -0.17 0.00 -0.13 0.00 0.00 55.73 56.83 1ung s ARG 168 Cb 0.08 -3.51 -0.05 0.00 -1.56 0.00 0.00 34.95 29.91 1ung s ARG 168 CO 0.11 -0.18 1.06 -1.25 -0.81 0.00 0.00 175.30 174.23 1ung s PRO 169 N 1.56 3.42 0.41 5.12 0.04 -1.26 -4.80 135.00 139.49 1ung s PRO 169 Ca 0.46 1.30 0.15 0.00 0.04 0.00 0.00 61.00 62.96 1ung s PRO 169 Cb -0.19 -2.04 1.02 0.00 0.04 0.00 0.00 34.50 33.33 1ung s PRO 169 CO 0.20 -0.74 1.88 -1.00 0.04 0.00 0.00 177.00 177.38 1ung h PRO 170 N 0.81 0.46 -0.56 0.56 0.13 -1.93 -1.43 132.00 130.03 1ung h PRO 170 Ca -0.48 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.53 1ung h PRO 170 Cb 1.23 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1ung h PRO 170 CO 0.58 0.30 -0.02 0.38 -0.23 0.00 0.00 178.00 179.01 1ung h ASP 171 N 0.47 0.95 0.17 1.44 -0.00 -1.93 -0.19 116.42 117.33 1ung h ASP 171 Ca 0.43 -0.27 -0.21 0.00 -0.00 0.00 0.00 57.03 56.98 1ung h ASP 171 Cb 0.97 -0.26 0.00 0.00 -0.00 0.00 0.00 39.33 40.05 1ung h ASP 171 CO -0.17 1.02 -0.83 0.58 -0.00 0.00 0.00 179.24 179.85 1ung h VAL 172 N 0.89 1.35 -0.31 4.15 2.07 -1.65 0.57 116.25 123.33 1ung h VAL 172 Ca 0.16 -2.20 0.03 0.00 0.82 0.00 0.00 66.70 65.51 1ung h VAL 172 Cb 0.55 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 1ung h VAL 172 CO 0.03 0.67 0.21 -0.07 0.02 0.00 0.00 177.57 178.43 1ung h LEU 173 N 0.33 0.24 -0.81 2.57 3.38 -0.91 0.39 115.31 120.49 1ung h LEU 173 Ca -0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ung h LEU 173 Cb 1.44 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1ung h LEU 173 CO 0.15 0.17 0.00 0.49 0.09 0.00 0.00 178.44 179.34 1ung n PHE 174 N -4.49 0.26 -0.68 1.13 0.99 -0.12 -4.91 117.46 109.64 1ung n PHE 174 Ca 0.03 -0.11 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1ung n PHE 174 Cb 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 39.48 38.60 1ung n PHE 174 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ung n GLY 175 N 0.56 0.64 3.70 1.37 0.00 0.14 -0.70 105.19 110.89 1ung n GLY 175 Ca 0.05 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1ung n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ung n ALA 176 N 0.03 1.36 -0.00 4.61 0.00 0.16 -4.51 120.51 122.16 1ung n ALA 176 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1ung n ALA 176 Cb 0.00 -2.27 0.01 0.00 0.00 0.00 0.00 19.45 17.18 1ung n ALA 176 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ung n LYS 177 N 0.91 2.68 -1.33 0.00 5.02 -1.26 -4.20 118.16 119.98 1ung n LYS 177 Ca 0.06 -1.44 0.02 0.00 -2.02 0.00 0.00 58.31 54.93 1ung n LYS 177 Cb 0.35 -1.01 0.09 0.00 -0.02 0.00 0.00 35.03 34.45 1ung n LYS 177 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ung n LEU 178 N -0.42 1.98 -4.91 -0.35 7.94 -1.26 -1.18 117.00 118.79 1ung n LEU 178 Ca 0.00 -3.01 -0.29 0.00 -1.11 0.00 0.00 56.01 51.61 1ung n LEU 178 Cb 0.24 -0.18 0.12 0.00 0.53 0.00 0.00 43.42 44.13 1ung n LEU 178 CO 0.00 1.01 0.80 -0.72 -1.11 0.00 0.00 177.39 177.37 1ung s TYR 179 N -1.82 2.52 0.00 1.96 -0.85 -1.26 -5.06 117.35 112.83 1ung s TYR 179 Ca 0.36 0.58 0.00 0.00 -0.52 0.00 0.00 57.07 57.50 1ung s TYR 179 Cb 0.38 -3.66 0.00 0.00 0.38 0.00 0.00 41.96 39.06 1ung s TYR 179 CO -0.11 -2.02 0.00 0.45 -1.52 0.00 0.00 175.55 172.36 1ung n SER 180 N -3.42 0.39 0.07 -0.18 2.88 -1.26 -5.01 113.62 107.09 1ung n SER 180 Ca 0.10 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.83 1ung n SER 180 Cb 0.60 0.00 0.72 0.00 -0.75 0.00 0.00 64.21 64.79 1ung n SER 180 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1ung h THR 181 N 0.00 0.65 -0.01 2.46 1.35 -1.99 -1.83 112.91 113.54 1ung h THR 181 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1ung h THR 181 Cb 0.00 0.76 -0.00 0.00 -1.73 0.00 0.00 68.15 67.18 1ung h THR 181 CO 0.00 0.00 0.24 0.77 -0.25 0.00 0.00 175.52 176.28 1ung h SER 182 N 0.00 0.00 -0.40 5.36 4.64 -1.94 -1.94 113.55 119.27 1ung h SER 182 Ca 0.20 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.48 1ung h SER 182 Cb 0.86 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.93 1ung h SER 182 CO -0.00 0.00 0.13 -0.29 -0.87 0.00 0.00 176.83 175.80 1ung h ILE 183 N 0.00 1.20 0.00 0.95 2.10 -1.71 -2.12 117.51 117.93 1ung h ILE 183 Ca 0.01 -0.69 -0.15 0.00 1.08 0.00 0.00 64.86 65.11 1ung h ILE 183 Cb 0.49 0.71 -0.02 0.00 -1.09 0.00 0.00 36.82 36.90 1ung h ILE 183 CO -0.00 0.26 -0.74 0.44 -1.08 0.00 0.00 178.15 177.03 1ung h ASP 184 N 0.68 0.00 0.15 2.19 3.32 -1.59 -3.23 116.42 117.94 1ung h ASP 184 Ca 0.16 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1ung h ASP 184 Cb 0.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1ung h ASP 184 CO -0.01 0.67 -0.36 0.24 -1.72 0.00 0.00 179.24 178.06 1ung h MET 185 N 0.00 0.30 -0.10 3.56 2.86 -1.40 -0.21 114.93 119.94 1ung h MET 185 Ca -0.02 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1ung h MET 185 Cb 1.53 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 33.18 1ung h MET 185 CO 0.08 0.63 0.00 2.35 1.06 0.00 0.00 176.91 181.03 1ung h TRP 186 N 0.26 0.18 -0.81 -0.22 2.91 -1.53 -2.20 115.95 114.54 1ung h TRP 186 Ca 0.03 -0.03 0.15 0.00 1.13 0.00 0.00 58.89 60.17 1ung h TRP 186 Cb 0.76 -0.05 -0.10 0.00 -0.51 0.00 0.00 29.16 29.27 1ung h TRP 186 CO 0.02 0.41 0.37 0.77 -1.03 0.00 0.00 178.44 178.98 1ung h SER 187 N -0.10 0.40 -0.17 2.65 0.02 -1.51 -1.29 113.55 113.54 1ung h SER 187 Ca 0.03 0.11 0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1ung h SER 187 Cb 0.34 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1ung h SER 187 CO 0.00 0.14 -0.01 0.00 -1.14 0.00 0.00 176.83 175.82 1ung h ALA 188 N 1.57 0.14 -0.84 3.77 0.00 -0.86 -0.51 119.26 122.52 1ung h ALA 188 Ca 0.45 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.45 1ung h ALA 188 Cb 0.69 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 1ung h ALA 188 CO -0.40 -0.45 0.54 0.78 0.00 0.00 0.00 179.25 179.72 1ung h GLY 189 N 0.04 1.23 0.84 0.00 0.00 -0.85 -0.11 103.07 104.21 1ung h GLY 189 Ca 0.08 -0.41 0.04 0.00 0.00 0.00 0.00 47.33 47.04 1ung h GLY 189 CO -0.15 0.35 0.46 0.00 0.00 0.00 0.00 176.54 177.20 1ung h ILE 191 N 0.89 1.31 -1.02 0.00 2.04 -0.52 -2.49 117.51 117.72 1ung h ILE 191 Ca 0.30 -1.37 0.24 0.00 1.00 0.00 0.00 64.86 65.03 1ung h ILE 191 Cb 0.05 1.59 -0.11 0.00 -0.74 0.00 0.00 36.82 37.61 1ung h ILE 191 CO -0.12 0.43 0.62 0.15 0.00 0.00 0.00 178.15 179.23 1ung h PHE 192 N 0.36 0.91 -0.17 1.37 3.57 -0.83 -0.31 116.94 121.84 1ung h PHE 192 Ca 0.05 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.48 1ung h PHE 192 Cb 0.78 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1ung h PHE 192 CO 0.07 0.09 -0.31 0.00 -2.23 0.00 0.00 178.31 175.92 1ung h ALA 193 N 1.69 1.15 -0.09 2.41 0.00 -0.81 -0.95 119.26 122.66 1ung h ALA 193 Ca 0.62 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1ung h ALA 193 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ung h ALA 193 CO -0.41 0.55 -0.25 0.93 0.00 0.00 0.00 179.25 180.07 1ung h GLU 194 N 0.29 0.33 -0.57 0.00 5.08 -0.96 -2.79 114.58 115.96 1ung h GLU 194 Ca 0.04 -0.23 0.11 0.00 -1.00 0.00 0.00 59.36 58.28 1ung h GLU 194 Cb 0.70 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.88 1ung h GLU 194 CO 0.05 0.84 -0.22 -0.07 -1.00 0.00 0.00 179.01 178.61 1ung h LEU 195 N -0.14 -0.79 -0.83 1.33 4.07 -0.93 0.51 115.31 118.54 1ung h LEU 195 Ca -0.01 0.20 0.00 0.00 0.08 0.00 0.00 57.88 58.15 1ung h LEU 195 Cb 0.86 0.45 0.00 0.00 1.08 0.00 0.00 40.66 43.04 1ung h LEU 195 CO 0.05 -0.25 0.00 0.00 -1.08 0.00 0.00 178.44 177.16 1ung n ALA 196 N -3.06 2.54 -2.00 1.53 0.00 -0.38 -4.65 120.51 114.49 1ung n ALA 196 Ca 0.06 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1ung n ALA 196 Cb 0.33 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1ung n ALA 196 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ung n ASN 197 N 0.05 0.00 -1.13 0.00 4.05 -1.05 -2.04 115.26 115.13 1ung n ASN 197 Ca 0.15 0.00 0.02 0.00 0.45 0.00 0.00 54.58 55.21 1ung n ASN 197 Cb 0.26 0.00 0.01 0.00 1.23 0.00 0.00 39.78 41.28 1ung n ASN 197 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ung n ALA 198 N -3.00 2.23 -1.28 5.20 0.00 -1.24 -4.84 120.51 117.58 1ung n ALA 198 Ca 0.00 -1.84 -0.05 0.00 0.00 0.00 0.00 53.44 51.55 1ung n ALA 198 Cb 0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 1ung n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ung n GLY 199 N 0.31 0.68 3.74 0.00 0.00 0.15 -4.48 105.19 105.59 1ung n GLY 199 Ca 0.04 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.91 1ung n GLY 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ung s ARG 200 N -2.69 2.99 0.23 1.61 1.81 -1.26 -4.97 118.95 116.67 1ung s ARG 200 Ca 0.00 -0.48 -0.31 0.00 -1.72 0.00 0.00 55.73 53.22 1ung s ARG 200 Cb 0.00 -2.81 -0.14 0.00 -0.45 0.00 0.00 34.95 31.55 1ung s ARG 200 CO 0.00 0.66 1.31 -2.30 -0.68 0.00 0.00 175.30 174.30 1ung n PRO 201 N 1.53 1.75 -0.07 3.54 -0.02 -1.26 -4.44 135.00 136.04 1ung n PRO 201 Ca -0.15 0.62 -0.09 0.00 -2.02 0.00 0.00 63.50 61.86 1ung n PRO 201 Cb 0.53 -2.22 0.06 0.00 -0.02 0.00 0.00 33.50 31.85 1ung n PRO 201 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1ung h LEU 202 N 3.80 0.78 -6.36 2.45 5.85 -1.92 -3.39 115.31 116.54 1ung h LEU 202 Ca -0.44 -0.33 -0.59 0.00 0.84 0.00 0.00 57.88 57.35 1ung h LEU 202 Cb 1.30 -0.22 -0.41 0.00 0.37 0.00 0.00 40.66 41.70 1ung h LEU 202 CO 0.73 1.06 -0.77 0.49 -0.34 0.00 0.00 178.44 179.61 1ung n PHE 203 N -4.06 1.92 -1.67 1.25 3.72 -1.26 -5.03 117.46 112.33 1ung n PHE 203 Ca -0.01 -3.92 -0.42 0.00 -0.05 0.00 0.00 57.45 53.04 1ung n PHE 203 Cb 0.51 -0.41 -0.01 0.00 -0.94 0.00 0.00 39.48 38.63 1ung n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1ung n PRO 204 N 1.50 2.60 -2.19 -1.08 -0.04 -1.26 -4.58 135.00 129.94 1ung n PRO 204 Ca 0.26 -2.49 -0.36 0.00 -0.04 0.00 0.00 63.50 60.87 1ung n PRO 204 Cb 0.44 -3.24 0.01 0.00 -0.04 0.00 0.00 33.50 30.67 1ung n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ung s GLY 205 N 3.64 2.69 0.34 0.55 0.00 -1.26 -4.96 107.32 108.32 1ung s GLY 205 Ca 0.50 0.90 0.18 0.00 0.00 0.00 0.00 44.72 46.30 1ung s GLY 205 CO -0.04 1.28 1.57 3.43 0.00 0.00 0.00 173.10 179.35 1ung h ASN 206 N 1.25 0.00 -2.42 1.64 2.35 -1.94 -3.46 115.58 113.00 1ung h ASN 206 Ca -0.50 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.38 1ung h ASN 206 Cb 1.27 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.62 1ung h ASN 206 CO 0.57 0.39 0.52 -0.90 -1.65 0.00 0.00 177.43 176.36 1ung n ASP 207 N -3.28 -1.63 0.07 5.81 5.68 -1.26 -5.01 116.55 116.92 1ung n ASP 207 Ca 0.01 -1.88 -0.12 0.00 -0.50 0.00 0.00 54.79 52.31 1ung n ASP 207 Cb 0.63 2.66 -0.05 0.00 -1.14 0.00 0.00 41.12 43.22 1ung n ASP 207 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1ung h VAL 208 N 1.91 0.67 -0.83 2.12 2.07 -1.97 0.59 116.25 120.81 1ung h VAL 208 Ca -0.25 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1ung h VAL 208 Cb 1.10 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1ung h VAL 208 CO 0.34 0.00 0.54 -0.78 0.02 0.00 0.00 177.57 177.69 1ung h ASP 209 N -0.25 0.90 0.11 0.57 1.82 -1.97 -2.09 116.42 115.51 1ung h ASP 209 Ca 0.04 -0.01 -0.18 0.00 -0.39 0.00 0.00 57.03 56.49 1ung h ASP 209 Cb 0.29 -0.20 -0.00 0.00 0.68 0.00 0.00 39.33 40.09 1ung h ASP 209 CO -0.11 0.62 -0.66 -0.78 -1.61 0.00 0.00 179.24 176.70 1ung h ASP 210 N 1.05 0.59 -0.19 2.28 3.58 -1.87 -1.91 116.42 119.96 1ung h ASP 210 Ca 0.33 -0.36 0.04 0.00 0.42 0.00 0.00 57.03 57.46 1ung h ASP 210 Cb -0.01 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 1ung h ASP 210 CO -0.11 1.09 -0.10 -0.61 -2.88 0.00 0.00 179.24 176.64 1ung h GLN 211 N 0.37 -0.08 -0.66 0.28 5.75 -0.57 -1.68 115.11 118.52 1ung h GLN 211 Ca -0.02 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1ung h GLN 211 Cb 1.23 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.76 1ung h GLN 211 CO 0.12 -0.05 0.42 -0.07 -2.65 0.00 0.00 178.83 176.60 1ung h LEU 212 N -0.08 0.70 -0.50 -2.39 3.38 -1.17 -1.55 115.31 113.70 1ung h LEU 212 Ca 0.10 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1ung h LEU 212 Cb 0.23 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1ung h LEU 212 CO -0.24 0.49 0.22 0.11 0.09 0.00 0.00 178.44 179.11 1ung h LYS 213 N 0.83 0.42 -0.35 1.13 1.57 -1.08 -1.05 116.57 118.03 1ung h LYS 213 Ca 0.26 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1ung h LYS 213 Cb -0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1ung h LYS 213 CO -0.09 0.28 -0.28 0.00 -0.57 0.00 0.00 179.45 178.79 1ung h ARG 214 N 0.43 0.72 -0.28 3.15 3.08 -1.12 0.56 114.38 120.93 1ung h ARG 214 Ca 0.23 -0.31 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1ung h ARG 214 Cb 0.19 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1ung h ARG 214 CO -0.19 0.91 0.01 0.82 -1.07 0.00 0.00 179.97 180.45 1ung h ILE 215 N 0.62 1.25 -0.01 2.04 2.04 -1.01 -3.00 117.51 119.44 1ung h ILE 215 Ca 0.08 -0.90 -0.15 0.00 1.00 0.00 0.00 64.86 64.89 1ung h ILE 215 Cb 0.78 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1ung h ILE 215 CO 0.06 0.29 -0.71 -0.26 0.00 0.00 0.00 178.15 177.53 1ung h PHE 216 N 0.27 0.07 -0.84 1.37 0.04 -0.73 -1.54 116.94 115.59 1ung h PHE 216 Ca 0.08 -0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.88 1ung h PHE 216 Cb 0.41 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.49 1ung h PHE 216 CO 0.03 0.74 0.55 0.00 -0.60 0.00 0.00 178.31 179.03 1ung h ARG 217 N 0.03 0.88 0.08 1.51 3.08 0.15 0.52 114.38 120.63 1ung h ARG 217 Ca -0.01 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.82 1ung h ARG 217 Cb 1.26 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1ung h ARG 217 CO 0.10 0.58 -0.83 1.25 -1.07 0.00 0.00 179.97 180.00 1ung h LEU 218 N 0.90 0.26 0.00 3.04 5.85 -1.35 -3.40 115.31 120.61 1ung h LEU 218 Ca 0.36 -0.88 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1ung h LEU 218 Cb 0.25 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1ung h LEU 218 CO -0.13 1.37 -1.38 0.18 -0.34 0.00 0.00 178.44 178.13 1ung n LEU 219 N -4.24 0.52 0.00 2.25 4.32 -0.61 -3.40 117.00 115.85 1ung n LEU 219 Ca -0.18 0.19 0.00 0.00 -0.02 0.00 0.00 56.01 56.00 1ung n LEU 219 Cb 0.74 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 42.50 1ung n LEU 219 CO 0.39 -0.11 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 1ung n GLY 220 N 1.22 0.24 3.69 -0.72 0.00 0.18 -4.59 105.19 105.21 1ung n GLY 220 Ca -0.01 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 1ung n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ung s THR 221 N -1.85 3.67 0.20 2.61 2.01 -0.74 -4.68 115.64 116.86 1ung s THR 221 Ca 0.00 1.07 -0.31 0.00 0.31 0.00 0.00 61.69 62.76 1ung s THR 221 Cb 0.00 -3.69 -0.10 0.00 0.01 0.00 0.00 72.50 68.72 1ung s THR 221 CO 0.00 0.00 1.55 -2.84 -0.69 0.00 0.00 174.62 172.65 1ung s PRO 222 N 2.35 4.21 0.62 4.92 0.02 -1.26 -4.86 135.00 141.00 1ung s PRO 222 Ca 0.64 2.39 -0.10 0.00 0.02 0.00 0.00 61.00 63.96 1ung s PRO 222 Cb -0.32 -3.12 -0.01 0.00 0.02 0.00 0.00 34.50 31.06 1ung s PRO 222 CO 0.27 -0.58 1.00 0.95 -0.33 0.00 0.00 177.00 178.31 1ung s THR 223 N 0.78 4.19 -0.05 0.99 -4.23 -1.26 -4.88 115.64 111.18 1ung s THR 223 Ca 0.67 0.53 0.27 0.00 -1.18 0.00 0.00 61.69 61.98 1ung s THR 223 Cb -0.44 -3.68 0.27 0.00 1.34 0.00 0.00 72.50 69.99 1ung s THR 223 CO 0.36 -0.84 1.82 1.05 -0.54 0.00 0.00 174.62 176.47 1ung h GLU 224 N -0.33 0.00 0.58 3.99 9.09 -1.95 -0.33 114.58 125.63 1ung h GLU 224 Ca -0.45 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 58.93 1ung h GLU 224 Cb 1.22 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.33 1ung h GLU 224 CO 0.62 0.00 -0.28 0.93 0.05 0.00 0.00 179.01 180.33 1ung h GLU 225 N 0.00 -0.75 0.00 1.06 5.08 -1.97 -2.69 114.58 115.31 1ung h GLU 225 Ca 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1ung h GLU 225 Cb 0.05 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1ung h GLU 225 CO 0.00 -0.44 -0.04 -0.56 -1.00 0.00 0.00 179.01 176.97 1ung h GLN 226 N -1.03 0.00 -1.94 2.33 3.07 -1.86 -3.39 115.11 112.29 1ung h GLN 226 Ca -0.08 0.00 -0.55 0.00 0.09 0.00 0.00 58.65 58.11 1ung h GLN 226 Cb 0.66 0.00 -0.38 0.00 0.08 0.00 0.00 27.48 27.84 1ung h GLN 226 CO 0.13 0.00 -1.08 1.87 0.09 0.00 0.00 178.83 179.84 1ung n TRP 227 N -2.98 -0.52 0.31 0.06 -0.00 -0.16 -4.77 117.44 109.38 1ung n TRP 227 Ca 0.04 -3.47 0.20 0.00 -0.00 0.00 0.00 57.50 54.27 1ung n TRP 227 Cb 0.52 -0.24 0.98 0.00 -0.00 0.00 0.00 31.31 32.57 1ung n TRP 227 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1ung h PRO 228 N 4.08 0.00 -0.00 5.87 0.13 -1.69 -2.46 132.00 137.93 1ung h PRO 228 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1ung h PRO 228 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1ung h PRO 228 CO 0.45 0.00 -0.63 -1.13 -0.23 0.00 0.00 178.00 176.46 1ung n SER 229 N -2.98 0.64 -0.31 1.44 3.41 -1.26 -4.18 113.62 110.37 1ung n SER 229 Ca -0.02 -0.46 0.17 0.00 -0.26 0.00 0.00 58.87 58.31 1ung n SER 229 Cb 0.14 0.45 0.35 0.00 -0.26 0.00 0.00 64.21 64.89 1ung n SER 229 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ung h MET 230 N 0.02 0.21 0.00 4.33 -0.00 -1.84 -0.50 114.93 117.15 1ung h MET 230 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 1ung h MET 230 Cb 0.50 -0.05 0.00 0.00 -0.00 0.00 0.00 31.60 32.05 1ung h MET 230 CO 0.00 0.14 0.00 0.25 -0.00 0.00 0.00 176.91 177.30 1ung n THR 231 N -5.20 1.28 0.90 -0.10 -2.24 -1.26 -1.84 114.28 105.81 1ung n THR 231 Ca 0.25 0.36 0.12 0.00 -2.27 0.00 0.00 64.05 62.50 1ung n THR 231 Cb 0.79 -1.22 0.30 0.00 -2.10 0.00 0.00 70.33 68.10 1ung n THR 231 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1ung n LYS 232 N -1.65 2.08 -2.52 -0.78 0.00 -0.19 -4.91 118.16 110.20 1ung n LYS 232 Ca 0.02 -1.62 -0.35 0.00 -0.00 0.00 0.00 58.31 56.35 1ung n LYS 232 Cb 0.12 -1.45 -0.03 0.00 -0.00 0.00 0.00 35.03 33.66 1ung n LYS 232 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ung s LEU 233 N -1.64 3.99 0.36 -5.58 1.43 -0.77 -4.94 118.68 111.54 1ung s LEU 233 Ca 0.35 2.01 0.06 0.00 -1.03 0.00 0.00 54.13 55.51 1ung s LEU 233 Cb 0.20 -4.37 0.74 0.00 0.03 0.00 0.00 46.19 42.79 1ung s LEU 233 CO 0.29 -0.67 1.97 -0.65 0.23 0.00 0.00 176.35 177.52 1ung h PRO 234 N 2.01 0.73 -0.33 1.29 0.11 -1.79 -2.24 132.00 131.79 1ung h PRO 234 Ca -0.49 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.47 1ung h PRO 234 Cb 1.22 -0.17 -0.06 0.00 0.11 0.00 0.00 31.00 32.10 1ung h PRO 234 CO 0.61 0.49 -0.00 -0.25 -0.21 0.00 0.00 178.00 178.63 1ung n ASP 235 N -4.47 3.21 -4.69 -2.05 8.00 0.12 -5.02 116.55 111.65 1ung n ASP 235 Ca 0.10 -3.40 -0.44 0.00 0.71 0.00 0.00 54.79 51.76 1ung n ASP 235 Cb 0.21 -0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 40.67 1ung n ASP 235 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ung n TYR 236 N -0.84 2.47 -4.07 1.24 4.19 -0.84 -4.87 117.16 114.44 1ung n TYR 236 Ca 0.29 0.16 -0.11 0.00 3.31 0.00 0.00 57.90 61.54 1ung n TYR 236 Cb 0.99 -2.60 -0.11 0.00 0.49 0.00 0.00 39.34 38.11 1ung n TYR 236 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1ung s LYS 237 N 1.17 0.55 0.22 2.98 3.01 -1.26 -5.02 119.74 121.38 1ung s LYS 237 Ca 0.78 -0.89 -0.30 0.00 -1.01 0.00 0.00 55.97 54.55 1ung s LYS 237 Cb -0.60 -0.13 -0.10 0.00 -1.01 0.00 0.00 37.83 35.99 1ung s LYS 237 CO 0.36 -0.00 1.47 -2.14 0.51 0.00 0.00 175.35 175.55 1ung s PRO 238 N -2.24 4.26 0.20 -1.68 0.02 -1.26 -5.02 135.00 129.27 1ung s PRO 238 Ca -0.05 2.31 0.06 0.00 0.02 0.00 0.00 61.00 63.33 1ung s PRO 238 Cb -0.05 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 1ung s PRO 238 CO -0.02 -0.47 0.17 0.71 -0.33 0.00 0.00 177.00 177.06 1ung s TYR 239 N 0.32 3.16 0.40 6.54 1.51 -1.26 -5.08 117.35 122.93 1ung s TYR 239 Ca 0.62 -0.05 -0.24 0.00 -1.01 0.00 0.00 57.07 56.39 1ung s TYR 239 Cb -0.42 -1.48 -0.12 0.00 -0.11 0.00 0.00 41.96 39.83 1ung s TYR 239 CO 0.40 0.52 0.80 -2.30 -1.11 0.00 0.00 175.55 173.86 1ung n PRO 240 N -0.70 0.97 -2.80 -1.71 -0.02 -1.26 -4.87 135.00 124.61 1ung n PRO 240 Ca -0.08 0.35 -0.43 0.00 -2.02 0.00 0.00 63.50 61.32 1ung n PRO 240 Cb 0.56 -1.77 -0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1ung n PRO 240 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1ung s MET 241 N -1.77 3.84 0.02 -0.52 -1.94 -1.26 -4.71 119.30 112.96 1ung s MET 241 Ca 0.63 -1.97 -0.30 0.00 -1.71 0.00 0.00 55.69 52.33 1ung s MET 241 Cb -0.60 -5.16 -0.04 0.00 2.01 0.00 0.00 34.83 31.03 1ung s MET 241 CO 0.57 -1.94 1.11 0.71 -0.01 0.00 0.00 175.02 175.46 1ung s TYR 242 N 3.00 3.50 0.16 -0.03 1.51 -1.26 -4.89 117.35 119.33 1ung s TYR 242 Ca 0.42 1.45 -0.33 0.00 -1.01 0.00 0.00 57.07 57.60 1ung s TYR 242 Cb -0.02 -3.30 -0.16 0.00 -0.11 0.00 0.00 41.96 38.37 1ung s TYR 242 CO -0.03 -0.77 1.16 -2.30 -1.11 0.00 0.00 175.55 172.50 1ung n PRO 243 N 4.09 1.10 0.02 -1.71 -0.02 -1.26 -1.79 135.00 135.44 1ung n PRO 243 Ca 0.08 0.39 0.21 0.00 -2.02 0.00 0.00 63.50 62.16 1ung n PRO 243 Cb 0.48 -1.89 0.72 0.00 -0.02 0.00 0.00 33.50 32.79 1ung n PRO 243 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ung h ALA 244 N 3.42 2.37 -0.95 3.55 0.00 -1.91 -3.28 119.26 122.47 1ung h ALA 244 Ca -0.44 -0.02 -0.61 0.00 0.00 0.00 0.00 54.91 53.85 1ung h ALA 244 Cb 1.35 0.04 -0.30 0.00 0.00 0.00 0.00 17.79 18.88 1ung h ALA 244 CO 0.70 -0.67 0.64 0.25 0.00 0.00 0.00 179.25 180.18 1ung n THR 245 N -4.13 3.40 -2.38 0.00 -2.24 -1.26 -3.73 114.28 103.93 1ung n THR 245 Ca 0.09 -2.79 -0.39 0.00 -2.27 0.00 0.00 64.05 58.69 1ung n THR 245 Cb 0.62 -0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 67.87 1ung n THR 245 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1ung n THR 246 N -0.97 3.30 -1.47 4.28 -1.04 -1.22 -4.94 114.28 112.22 1ung n THR 246 Ca 0.59 -3.41 -0.45 0.00 -2.04 0.00 0.00 64.05 58.74 1ung n THR 246 Cb 0.94 -2.31 -0.01 0.00 -1.82 0.00 0.00 70.33 67.13 1ung n THR 246 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1ung n SER 247 N 10.08 -0.46 -1.46 8.00 7.64 -1.26 -4.84 113.62 131.32 1ung n SER 247 Ca 0.48 1.07 -0.09 0.00 1.01 0.00 0.00 58.87 61.34 1ung n SER 247 Cb 0.46 -1.09 0.07 0.00 -1.01 0.00 0.00 64.21 62.64 1ung n SER 247 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ung n LEU 248 N 1.61 4.38 0.01 -3.43 4.77 -1.26 -4.12 117.00 118.96 1ung n LEU 248 Ca 0.13 -2.28 -0.04 0.00 -0.03 0.00 0.00 56.01 53.80 1ung n LEU 248 Cb 0.32 -0.63 -0.11 0.00 -2.33 0.00 0.00 43.42 40.67 1ung n LEU 248 CO 0.57 0.70 -0.40 0.52 -1.33 0.00 0.00 177.39 177.45 1ung n VAL 249 N -0.12 1.37 0.05 4.08 0.31 -1.26 -3.73 118.33 119.04 1ung n VAL 249 Ca 0.23 -0.74 -0.07 0.00 -0.01 0.00 0.00 64.34 63.75 1ung n VAL 249 Cb 0.94 -0.87 -0.12 0.00 -0.91 0.00 0.00 33.84 32.88 1ung n VAL 249 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ung h ASN 250 N 0.00 0.00 1.40 4.52 -0.00 -1.96 -3.24 115.58 116.30 1ung h ASN 250 Ca -0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 56.30 56.03 1ung h ASN 250 Cb 1.78 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 40.09 1ung h ASN 250 CO 0.06 1.00 -0.62 -0.37 -0.00 0.00 0.00 177.43 177.50 1ung h VAL 251 N 0.00 0.30 -2.32 6.14 -1.51 -1.84 -3.38 116.25 113.64 1ung h VAL 251 Ca -0.05 -1.48 -0.59 0.00 -1.23 0.00 0.00 66.70 63.36 1ung h VAL 251 Cb 1.80 1.99 -0.39 0.00 -2.13 0.00 0.00 31.29 32.55 1ung h VAL 251 CO 0.12 0.17 -0.93 1.33 -1.23 0.00 0.00 177.57 177.04 1ung n VAL 252 N -2.99 -0.28 0.29 7.19 0.24 -1.24 -4.55 118.33 116.98 1ung n VAL 252 Ca 0.00 -4.00 0.12 0.00 -2.04 0.00 0.00 64.34 58.41 1ung n VAL 252 Cb 0.64 -1.87 0.54 0.00 -1.47 0.00 0.00 33.84 31.67 1ung n VAL 252 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1ung n PRO 253 N 2.03 0.17 0.00 7.34 -0.02 -1.22 -2.24 135.00 141.07 1ung n PRO 253 Ca 0.26 0.52 0.14 0.00 -2.02 0.00 0.00 63.50 62.39 1ung n PRO 253 Cb 0.47 -1.92 0.53 0.00 -0.02 0.00 0.00 33.50 32.56 1ung n PRO 253 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ung n LYS 254 N -2.26 0.23 -4.22 -0.52 4.81 -0.87 -4.85 118.16 110.48 1ung n LYS 254 Ca 0.01 -0.07 -0.36 0.00 -0.87 0.00 0.00 58.31 57.02 1ung n LYS 254 Cb 0.14 -1.50 -0.08 0.00 0.02 0.00 0.00 35.03 33.61 1ung n LYS 254 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1ung s LEU 255 N -2.82 3.83 0.00 3.14 1.02 -0.95 -4.90 118.68 118.00 1ung s LEU 255 Ca 0.19 0.24 -0.02 0.00 0.02 0.00 0.00 54.13 54.55 1ung s LEU 255 Cb 0.19 -1.90 0.04 0.00 0.02 0.00 0.00 46.19 44.54 1ung s LEU 255 CO 0.55 0.39 0.14 -0.46 0.02 0.00 0.00 176.35 176.99 1ung n ASN 256 N 2.10 -0.97 -0.16 2.29 2.04 -1.26 -4.76 115.26 114.53 1ung n ASN 256 Ca -0.19 -0.65 -0.09 0.00 -0.44 0.00 0.00 54.58 53.22 1ung n ASN 256 Cb 0.54 -0.12 0.00 0.00 -2.53 0.00 0.00 39.78 37.67 1ung n ASN 256 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ung h ALA 257 N -2.07 0.59 0.00 -2.53 0.00 -1.99 -1.97 119.26 111.29 1ung h ALA 257 Ca -0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1ung h ALA 257 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ung h ALA 257 CO 0.03 0.19 -0.43 1.79 0.00 0.00 0.00 179.25 180.83 1ung h THR 258 N 0.59 0.91 -0.15 0.00 1.35 -1.99 -1.88 112.91 111.74 1ung h THR 258 Ca 0.15 -1.79 -0.11 0.00 -0.55 0.00 0.00 66.41 64.11 1ung h THR 258 Cb 0.18 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1ung h THR 258 CO -0.01 0.43 -0.35 1.23 -0.25 0.00 0.00 175.52 176.57 1ung h GLY 259 N 2.48 0.55 1.22 5.82 0.00 -1.88 -2.60 103.07 108.66 1ung h GLY 259 Ca -0.00 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.60 1ung h GLY 259 CO 0.06 0.60 0.17 3.21 0.00 0.00 0.00 176.54 180.57 1ung h ARG 260 N 0.12 0.97 0.02 4.80 3.08 -1.10 -2.17 114.38 120.11 1ung h ARG 260 Ca -0.00 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.85 1ung h ARG 260 Cb 0.95 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 1ung h ARG 260 CO 0.08 0.85 -0.04 0.22 -1.07 0.00 0.00 179.97 180.01 1ung h ASP 261 N 0.93 -0.10 -0.89 7.04 1.82 -1.34 -0.82 116.42 123.06 1ung h ASP 261 Ca 0.20 0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.87 1ung h ASP 261 Cb 0.31 0.04 -0.05 0.00 0.68 0.00 0.00 39.33 40.31 1ung h ASP 261 CO -0.00 -0.06 0.59 0.25 -1.61 0.00 0.00 179.24 178.41 1ung h LEU 262 N -0.07 1.01 -0.58 2.28 5.85 -1.24 -2.26 115.31 120.31 1ung h LEU 262 Ca 0.01 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.80 1ung h LEU 262 Cb 0.08 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 1ung h LEU 262 CO -0.02 0.73 0.19 0.25 -0.34 0.00 0.00 178.44 179.25 1ung h LEU 263 N 1.20 0.16 -1.57 2.25 5.85 -0.94 -1.94 115.31 120.33 1ung h LEU 263 Ca 0.33 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 59.09 1ung h LEU 263 Cb -0.12 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1ung h LEU 263 CO -0.08 0.11 -0.20 1.56 -0.34 0.00 0.00 178.44 179.48 1ung h GLN 264 N 0.36 0.02 0.00 1.25 4.20 -0.71 0.05 115.11 120.28 1ung h GLN 264 Ca 0.29 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1ung h GLN 264 Cb 0.37 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1ung h GLN 264 CO -0.31 0.22 -0.19 -0.91 -0.67 0.00 0.00 178.83 176.97 1ung h ASN 265 N 0.02 0.00 0.11 1.46 2.35 -0.80 -3.25 115.58 115.46 1ung h ASN 265 Ca 0.00 -0.01 -0.29 0.00 -0.55 0.00 0.00 56.30 55.46 1ung h ASN 265 Cb 0.37 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 1ung h ASN 265 CO 0.03 0.00 -1.50 -0.07 -1.65 0.00 0.00 177.43 174.24 1ung h LEU 266 N 0.00 0.35 -5.09 1.61 3.38 -0.97 -1.50 115.31 113.09 1ung h LEU 266 Ca 0.00 -0.84 -0.62 0.00 0.09 0.00 0.00 57.88 56.52 1ung h LEU 266 Cb 0.97 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 41.47 1ung h LEU 266 CO 0.00 1.65 1.53 0.18 0.09 0.00 0.00 178.44 181.88 1ung n LEU 267 N -3.90 7.32 -4.74 1.67 4.77 -0.04 -4.32 117.00 117.76 1ung n LEU 267 Ca -0.27 -4.46 -0.37 0.00 -0.03 0.00 0.00 56.01 50.89 1ung n LEU 267 Cb 0.91 -1.32 -0.07 0.00 -2.33 0.00 0.00 43.42 40.61 1ung n LEU 267 CO 0.39 1.91 -0.01 -0.54 -1.33 0.00 0.00 177.39 177.81 1ung s LYS 268 N -1.15 4.18 0.13 3.23 -0.14 -1.25 -4.92 119.74 119.82 1ung s LYS 268 Ca 0.57 0.11 -0.16 0.00 -1.36 0.00 0.00 55.97 55.12 1ung s LYS 268 Cb 0.27 -3.40 -0.01 0.00 -1.68 0.00 0.00 37.83 33.02 1ung s LYS 268 CO -0.14 0.30 1.72 0.00 -0.76 0.00 0.00 175.35 176.47 1ung s ASN 270 N -5.73 6.08 0.52 0.00 3.04 -1.26 -4.51 114.94 113.08 1ung s ASN 270 Ca -0.13 1.42 0.20 0.00 0.04 0.00 0.00 52.86 54.40 1ung s ASN 270 Cb 0.10 -2.53 1.32 0.00 -1.54 0.00 0.00 41.25 38.60 1ung s ASN 270 CO 0.74 -1.53 2.06 1.55 -3.04 0.00 0.00 177.10 176.88 1ung h PRO 271 N 12.03 0.03 0.00 0.43 0.13 -1.96 -0.42 132.00 142.24 1ung h PRO 271 Ca -0.34 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1ung h PRO 271 Cb 1.16 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ung h PRO 271 CO 1.02 0.02 -0.02 0.28 -0.23 0.00 0.00 178.00 179.07 1ung h VAL 272 N 0.03 0.62 -0.01 1.56 2.07 -1.93 -2.53 116.25 116.05 1ung h VAL 272 Ca 0.14 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1ung h VAL 272 Cb 0.54 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1ung h VAL 272 CO -0.01 0.02 -0.27 0.00 0.02 0.00 0.00 177.57 177.33 1ung n GLN 273 N -3.94 1.22 -2.40 1.57 6.02 -0.17 -4.88 117.38 114.81 1ung n GLN 273 Ca -0.03 -0.87 -0.42 0.00 -0.01 0.00 0.00 57.00 55.67 1ung n GLN 273 Cb 0.10 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 1ung n GLN 273 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1ung s ARG 274 N -2.37 4.30 0.28 -1.09 0.52 -0.96 -4.85 118.95 114.78 1ung s ARG 274 Ca 0.25 1.73 -0.29 0.00 -0.52 0.00 0.00 55.73 56.90 1ung s ARG 274 Cb 0.19 -3.63 -0.14 0.00 0.52 0.00 0.00 34.95 31.89 1ung s ARG 274 CO 0.49 -0.56 1.08 1.51 0.02 0.00 0.00 175.30 177.85 1ung n ILE 275 N 4.87 1.82 -1.40 1.52 3.06 -0.56 -4.99 119.36 123.68 1ung n ILE 275 Ca 0.12 -0.46 -0.30 0.00 -2.50 0.00 0.00 62.75 59.62 1ung n ILE 275 Cb 0.45 -1.08 0.11 0.00 0.54 0.00 0.00 39.64 39.67 1ung n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1ung s SER 276 N -0.42 4.00 0.22 9.51 1.04 -1.26 -4.89 113.70 121.91 1ung s SER 276 Ca 0.60 1.37 -0.08 0.00 0.48 0.00 0.00 55.95 58.33 1ung s SER 276 Cb -0.70 -2.08 0.27 0.00 0.10 0.00 0.00 66.02 63.62 1ung s SER 276 CO 0.59 -2.29 1.84 0.00 0.98 0.00 0.00 173.24 174.36 1ung h ALA 277 N -1.31 1.04 -0.03 5.32 0.00 -1.94 -0.76 119.26 121.59 1ung h ALA 277 Ca -0.48 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1ung h ALA 277 Cb 1.28 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ung h ALA 277 CO 0.57 0.21 0.01 1.49 0.00 0.00 0.00 179.25 181.53 1ung h GLU 278 N 0.88 0.04 -0.16 0.00 4.81 -1.91 -1.93 114.58 116.30 1ung h GLU 278 Ca 0.33 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.52 1ung h GLU 278 Cb 0.13 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1ung h GLU 278 CO -0.16 0.21 -0.07 1.49 -0.73 0.00 0.00 179.01 179.75 1ung h GLU 279 N -0.14 0.24 -0.38 1.92 4.57 -1.93 -3.09 114.58 115.77 1ung h GLU 279 Ca 0.01 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 57.99 1ung h GLU 279 Cb 0.19 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1ung h GLU 279 CO -0.00 0.33 -0.36 0.00 -1.18 0.00 0.00 179.01 177.80 1ung h ALA 280 N 1.70 0.64 -0.00 2.92 0.00 -0.76 -2.67 119.26 121.09 1ung h ALA 280 Ca 0.05 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ung h ALA 280 Cb 0.28 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ung h ALA 280 CO 0.01 0.67 0.00 -0.07 0.00 0.00 0.00 179.25 179.87 1ung h LEU 281 N 0.74 0.00 -0.67 0.00 3.38 -1.28 0.12 115.31 117.59 1ung h LEU 281 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1ung h LEU 281 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1ung h LEU 281 CO 0.09 0.00 -0.24 0.00 0.09 0.00 0.00 178.44 178.38 1ung n GLN 282 N -3.79 1.06 -1.72 1.13 6.02 -1.03 -4.77 117.38 114.27 1ung n GLN 282 Ca -0.03 -0.67 -0.39 0.00 -0.01 0.00 0.00 57.00 55.90 1ung n GLN 282 Cb 0.08 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 29.89 1ung n GLN 282 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 1ung n HIS 283 N -0.38 2.08 -0.27 1.08 -0.00 0.41 -4.84 115.22 113.30 1ung n HIS 283 Ca 0.13 0.44 0.23 0.00 0.46 0.00 0.00 57.72 58.98 1ung n HIS 283 Cb 0.37 -2.33 0.55 0.00 -0.12 0.00 0.00 29.99 28.46 1ung n HIS 283 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1ung h PRO 284 N 1.38 0.32 -1.97 1.57 0.11 -1.92 -2.11 132.00 129.38 1ung h PRO 284 Ca -0.50 -0.02 0.57 0.00 0.11 0.00 0.00 66.00 66.16 1ung h PRO 284 Cb 1.31 -0.07 -0.08 0.00 0.11 0.00 0.00 31.00 32.27 1ung h PRO 284 CO 0.57 0.21 1.41 -0.92 -0.21 0.00 0.00 178.00 179.06 1ung h TYR 285 N 0.33 0.00 -0.44 0.65 3.20 -1.88 0.14 116.97 118.97 1ung h TYR 285 Ca 0.51 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.38 1ung h TYR 285 Cb 1.43 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.70 1ung h TYR 285 CO -0.00 -0.00 0.00 1.19 -1.64 0.00 0.00 178.16 177.71 1ung n PHE 286 N -3.95 1.54 -1.33 -3.82 3.72 -0.79 -5.01 117.46 107.81 1ung n PHE 286 Ca 0.44 -0.78 -0.29 0.00 -0.05 0.00 0.00 57.45 56.77 1ung n PHE 286 Cb 2.01 -0.41 0.23 0.00 -0.94 0.00 0.00 39.48 40.37 1ung n PHE 286 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ung n SER 287 N 0.16 -1.33 0.00 4.37 7.64 0.49 -5.04 113.62 119.91 1ung n SER 287 Ca 0.25 -1.26 0.00 0.00 1.01 0.00 0.00 58.87 58.86 1ung n SER 287 Cb 1.04 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1ung n SER 287 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36