#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1req n THR 3 N 0.00 4.88 -2.95 6.66 -2.24 -1.26 -4.86 114.28 114.51 1req n THR 3 Ca 0.00 -5.82 -0.13 0.00 -2.27 0.00 0.00 64.05 55.83 1req n THR 3 Cb 0.00 -1.52 0.01 0.00 -2.10 0.00 0.00 70.33 66.72 1req n THR 3 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1req n LEU 4 N -0.06 -7.17 -4.76 3.22 7.94 -1.26 -4.90 117.00 109.99 1req n LEU 4 Ca 0.40 0.43 -0.41 0.00 -1.11 0.00 0.00 56.01 55.32 1req n LEU 4 Cb 0.31 -3.15 -0.01 0.00 0.53 0.00 0.00 43.42 41.11 1req n LEU 4 CO 0.46 -2.02 1.17 -2.16 -1.11 0.00 0.00 177.39 173.72 1req s PRO 5 N -2.59 4.14 -0.23 1.96 0.04 -1.26 -5.02 135.00 132.04 1req s PRO 5 Ca 0.27 2.53 -0.03 0.00 0.04 0.00 0.00 61.00 63.81 1req s PRO 5 Cb -0.07 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1req s PRO 5 CO 0.79 -0.54 -0.05 1.03 0.04 0.00 0.00 177.00 178.27 1req s ARG 6 N -1.30 3.18 -0.00 4.56 1.81 -1.26 -5.05 118.95 120.88 1req s ARG 6 Ca 0.57 -0.76 0.02 0.00 -1.72 0.00 0.00 55.73 53.85 1req s ARG 6 Cb -0.46 -3.00 0.07 0.00 -0.45 0.00 0.00 34.95 31.10 1req s ARG 6 CO 0.55 -0.28 0.99 1.19 -0.68 0.00 0.00 175.30 177.07 1req n PHE 7 N 4.76 0.12 1.96 -0.53 3.72 -1.26 -4.31 117.46 121.91 1req n PHE 7 Ca -0.18 -0.05 0.06 0.00 -0.05 0.00 0.00 57.45 57.23 1req n PHE 7 Cb 0.49 -0.02 0.34 0.00 -0.94 0.00 0.00 39.48 39.36 1req n PHE 7 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1req n ASP 8 N -0.23 0.08 0.00 4.37 5.75 -1.26 -2.95 116.55 122.32 1req n ASP 8 Ca 0.03 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 1req n ASP 8 Cb 0.11 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1req n ASP 8 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1req n SER 9 N -0.63 3.34 -4.71 -1.12 3.41 -1.26 -5.05 113.62 107.59 1req n SER 9 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.28 1req n SER 9 Cb 0.05 0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 1req n SER 9 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1req s VAL 10 N -1.52 3.23 0.45 -3.33 1.01 -1.15 -5.02 120.40 114.07 1req s VAL 10 Ca 0.00 0.84 -0.20 0.00 0.00 0.00 0.00 61.98 62.62 1req s VAL 10 Cb 0.00 -3.54 -0.10 0.00 0.00 0.00 0.00 36.38 32.74 1req s VAL 10 CO 0.00 0.05 0.96 -1.81 0.00 0.00 0.00 175.10 174.30 1req s ASP 11 N 1.37 6.84 0.06 3.32 1.01 -1.26 -4.97 116.67 123.03 1req s ASP 11 Ca 0.66 1.67 -0.15 0.00 0.71 0.00 0.00 52.55 55.44 1req s ASP 11 Cb -0.37 -2.53 -0.21 0.00 1.01 0.00 0.00 42.92 40.81 1req s ASP 11 CO 0.30 -0.43 1.20 0.25 0.21 0.00 0.00 175.17 176.69 1req h LEU 12 N 1.65 0.81 0.00 1.23 5.85 -1.97 -3.49 115.31 119.39 1req h LEU 12 Ca -0.48 -0.71 0.00 0.00 0.84 0.00 0.00 57.88 57.52 1req h LEU 12 Cb 1.18 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1req h LEU 12 CO 0.61 1.41 0.00 0.61 -0.34 0.00 0.00 178.44 180.73 1req n GLY 13 N 0.97 -1.76 2.82 3.75 0.00 -1.26 -4.73 105.19 104.98 1req n GLY 13 Ca -0.10 -2.02 -0.28 0.00 0.00 0.00 0.00 46.02 43.62 1req n GLY 13 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1req n ASN 14 N 0.02 2.88 0.00 1.61 5.03 -1.26 -5.05 115.26 118.49 1req n ASN 14 Ca 0.00 -3.19 0.00 0.00 0.87 0.00 0.00 54.58 52.26 1req n ASN 14 Cb 0.00 -0.74 0.00 0.00 -1.02 0.00 0.00 39.78 38.02 1req n ASN 14 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1req n ALA 15 N 1.89 -0.03 -0.34 5.41 0.00 -1.26 -4.90 120.51 121.28 1req n ALA 15 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1req n ALA 15 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1req n ALA 15 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1req n PRO 16 N 0.03 0.00 -2.21 0.00 -0.02 -1.26 -4.99 135.00 126.55 1req n PRO 16 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.45 1req n PRO 16 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1req n PRO 16 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1req n VAL 17 N 0.00 -7.19 -0.58 -1.45 0.31 -1.26 -5.03 118.33 103.12 1req n VAL 17 Ca 0.00 0.68 -0.31 0.00 -0.01 0.00 0.00 64.34 64.70 1req n VAL 17 Cb 0.00 -5.75 0.28 0.00 -0.91 0.00 0.00 33.84 27.46 1req n VAL 17 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1req s PRO 18 N -1.54 -2.70 0.07 5.55 0.04 -1.26 -4.96 135.00 130.20 1req s PRO 18 Ca 0.09 -0.03 0.23 0.00 0.04 0.00 0.00 61.00 61.32 1req s PRO 18 Cb -0.02 -1.42 0.01 0.00 0.04 0.00 0.00 34.50 33.10 1req s PRO 18 CO 0.43 -4.69 0.98 0.00 0.04 0.00 0.00 177.00 173.76 1req n ALA 19 N -5.46 3.16 1.02 8.56 0.00 -1.26 -3.25 120.51 123.28 1req n ALA 19 Ca 0.14 -0.38 0.13 0.00 0.00 0.00 0.00 53.44 53.33 1req n ALA 19 Cb 0.60 -0.98 0.43 0.00 0.00 0.00 0.00 19.45 19.50 1req n ALA 19 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1req n ASP 20 N -2.13 0.29 -0.05 0.00 5.75 -1.26 -4.50 116.55 114.66 1req n ASP 20 Ca 0.01 0.04 -0.02 0.00 -0.01 0.00 0.00 54.79 54.81 1req n ASP 20 Cb 0.47 -0.09 -0.02 0.00 -1.03 0.00 0.00 41.12 40.46 1req n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1req h ALA 21 N 3.04 -0.28 -0.88 2.12 0.00 -1.92 -1.02 119.26 120.31 1req h ALA 21 Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1req h ALA 21 Cb 0.49 0.89 -0.11 0.00 0.00 0.00 0.00 17.79 19.06 1req h ALA 21 CO 0.00 -0.35 -0.49 0.00 0.00 0.00 0.00 179.25 178.42 1req n ALA 22 N -2.88 -0.48 0.45 0.00 0.00 -1.26 -0.05 120.51 116.29 1req n ALA 22 Ca -0.00 0.77 0.13 0.00 0.00 0.00 0.00 53.44 54.34 1req n ALA 22 Cb 0.06 -0.17 0.29 0.00 0.00 0.00 0.00 19.45 19.63 1req n ALA 22 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1req h ARG 23 N 0.00 0.00 -0.48 0.00 0.11 -1.83 -1.64 114.38 110.54 1req h ARG 23 Ca 0.17 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.13 1req h ARG 23 Cb 0.39 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1req h ARG 23 CO -0.84 0.00 -0.18 0.00 0.10 0.00 0.00 179.97 179.05 1req h ARG 24 N 0.00 0.95 0.13 0.08 3.08 -0.06 -0.57 114.38 117.99 1req h ARG 24 Ca 0.00 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.66 1req h ARG 24 Cb 0.85 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1req h ARG 24 CO 0.00 1.05 -0.06 0.35 -1.07 0.00 0.00 179.97 180.23 1req h PHE 25 N 0.83 -0.16 -0.57 3.04 3.57 -0.28 -2.12 116.94 121.25 1req h PHE 25 Ca 0.12 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.72 1req h PHE 25 Cb 0.74 0.05 -0.08 0.00 2.79 0.00 0.00 35.95 39.45 1req h PHE 25 CO 0.05 0.10 0.11 1.49 -2.23 0.00 0.00 178.31 177.83 1req h GLU 26 N -0.41 0.24 -0.53 1.11 4.57 -1.09 0.77 114.58 119.23 1req h GLU 26 Ca -0.02 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1req h GLU 26 Cb 0.33 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 1req h GLU 26 CO 0.03 0.16 0.23 0.93 -1.18 0.00 0.00 179.01 179.18 1req h GLU 27 N 0.25 0.75 -0.86 1.92 3.07 -1.12 0.10 114.58 118.68 1req h GLU 27 Ca 0.30 -0.10 0.02 0.00 -0.50 0.00 0.00 59.36 59.08 1req h GLU 27 Cb 0.43 -0.14 -0.05 0.00 -0.84 0.00 0.00 28.75 28.15 1req h GLU 27 CO -0.39 0.60 0.57 -0.07 -1.40 0.00 0.00 179.01 178.31 1req h LEU 28 N 0.74 0.96 -0.53 1.33 3.38 -0.42 0.42 115.31 121.19 1req h LEU 28 Ca 0.18 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.98 1req h LEU 28 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1req h LEU 28 CO -0.02 0.68 -0.49 0.00 0.09 0.00 0.00 178.44 178.69 1req h ALA 29 N 1.34 0.71 -0.27 1.53 0.00 -0.60 0.31 119.26 122.28 1req h ALA 29 Ca 0.33 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1req h ALA 29 Cb -0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1req h ALA 29 CO -0.09 0.68 -0.48 0.00 0.00 0.00 0.00 179.25 179.36 1req h ALA 30 N 0.97 0.64 -0.31 0.00 0.00 -0.74 -2.66 119.26 117.16 1req h ALA 30 Ca 0.02 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1req h ALA 30 Cb 1.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1req h ALA 30 CO 0.10 0.68 0.10 1.57 0.00 0.00 0.00 179.25 181.70 1req h LYS 31 N 0.58 0.48 0.00 0.00 2.10 0.22 -3.02 116.57 116.93 1req h LYS 31 Ca 0.03 -0.10 -0.01 0.00 -2.00 0.00 0.00 60.65 58.57 1req h LYS 31 Cb 1.04 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 32.30 1req h LYS 31 CO 0.10 0.51 -0.04 0.00 -2.00 0.00 0.00 179.45 178.03 1req h ALA 32 N 0.94 1.21 0.00 0.07 0.00 -0.41 -3.47 119.26 117.60 1req h ALA 32 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1req h ALA 32 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1req h ALA 32 CO -0.00 0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1req n GLY 33 N -0.87 1.03 3.44 0.00 0.00 -1.12 -5.04 105.19 102.63 1req n GLY 33 Ca -0.02 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.43 1req n GLY 33 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1req n THR 34 N -0.92 0.13 -0.23 2.61 -1.04 -1.02 -4.94 114.28 108.87 1req n THR 34 Ca 0.00 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1req n THR 34 Cb 0.00 -1.07 0.00 0.00 -1.82 0.00 0.00 70.33 67.44 1req n THR 34 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1req n GLY 35 N 6.33 1.26 3.86 3.41 0.00 -1.26 -4.90 105.19 113.88 1req n GLY 35 Ca 0.43 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 1req n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1req s GLU 36 N 1.53 0.65 0.55 1.61 0.41 -1.26 -5.01 118.70 117.18 1req s GLU 36 Ca 0.00 -0.20 -0.20 0.00 -0.41 0.00 0.00 54.97 54.17 1req s GLU 36 Cb 0.00 -1.83 -0.05 0.00 -1.78 0.00 0.00 34.13 30.47 1req s GLU 36 CO 0.00 -2.44 1.16 0.00 -0.49 0.00 0.00 175.26 173.49 1req s ALA 37 N -3.64 2.69 0.09 5.21 0.00 -1.26 -4.97 121.76 119.88 1req s ALA 37 Ca 0.70 0.89 -0.31 0.00 0.00 0.00 0.00 51.96 53.25 1req s ALA 37 Cb -0.07 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1req s ALA 37 CO 0.53 -0.86 1.26 -0.46 0.00 0.00 0.00 175.76 176.23 1req s TRP 38 N -1.69 3.37 -0.49 0.00 -0.00 0.21 -4.73 118.94 115.62 1req s TRP 38 Ca 0.73 1.20 -0.17 0.00 -0.00 0.00 0.00 56.10 57.85 1req s TRP 38 Cb -0.26 -3.51 0.06 0.00 -0.00 0.00 0.00 33.47 29.76 1req s TRP 38 CO 0.30 -1.63 0.51 -1.21 -0.00 0.00 0.00 176.95 174.92 1req s GLU 39 N 0.95 3.06 1.05 5.86 0.41 -1.26 0.07 118.70 128.84 1req s GLU 39 Ca 0.60 -1.08 -0.12 0.00 -0.41 0.00 0.00 54.97 53.95 1req s GLU 39 Cb -0.32 -4.11 0.22 0.00 -1.78 0.00 0.00 34.13 28.14 1req s GLU 39 CO 0.30 -1.12 1.07 0.95 -0.49 0.00 0.00 175.26 175.98 1req s THR 40 N 2.17 2.10 0.50 3.63 -4.23 -0.97 -4.91 115.64 113.94 1req s THR 40 Ca 0.10 0.03 0.38 0.00 -1.18 0.00 0.00 61.69 61.02 1req s THR 40 Cb -0.21 -2.35 0.40 0.00 1.34 0.00 0.00 72.50 71.68 1req s THR 40 CO 0.10 -0.04 2.23 0.00 -0.54 0.00 0.00 174.62 176.36 1req h ALA 41 N -2.15 1.11 0.00 3.99 0.00 -1.97 0.92 119.26 121.16 1req h ALA 41 Ca -0.57 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1req h ALA 41 Cb 1.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1req h ALA 41 CO 0.54 0.03 0.00 0.93 0.00 0.00 0.00 179.25 180.75 1req h GLU 42 N 0.00 0.00 -1.34 0.00 3.07 -1.97 -3.47 114.58 110.87 1req h GLU 42 Ca -0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1req h GLU 42 Cb 0.17 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.08 1req h GLU 42 CO 0.00 0.00 -0.03 1.04 -1.40 0.00 0.00 179.01 178.63 1req n GLN 43 N -3.09 -0.28 -3.95 2.33 6.02 0.32 -4.99 117.38 113.73 1req n GLN 43 Ca 0.02 0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.70 1req n GLN 43 Cb 0.42 -2.62 -0.14 0.00 1.02 0.00 0.00 30.24 28.92 1req n GLN 43 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1req s ILE 44 N -3.01 2.76 -0.04 5.09 1.01 -1.26 -4.95 121.20 120.80 1req s ILE 44 Ca 0.02 -1.48 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 1req s ILE 44 Cb -0.01 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 1req s ILE 44 CO 0.03 -0.11 1.25 -2.16 0.00 0.00 0.00 174.94 173.95 1req s PRO 45 N 1.20 4.33 -0.30 2.79 0.04 -1.26 -2.29 135.00 139.51 1req s PRO 45 Ca -0.06 1.75 0.01 0.00 0.04 0.00 0.00 61.00 62.74 1req s PRO 45 Cb -0.20 -3.56 0.07 0.00 0.04 0.00 0.00 34.50 30.85 1req s PRO 45 CO -0.02 -0.48 -0.01 0.08 0.04 0.00 0.00 177.00 176.61 1req s VAL 46 N 2.25 2.56 0.41 -0.36 1.01 0.11 -4.90 120.40 121.49 1req s VAL 46 Ca 0.58 -1.74 -0.07 0.00 0.00 0.00 0.00 61.98 60.75 1req s VAL 46 Cb -0.26 -2.60 0.09 0.00 0.00 0.00 0.00 36.38 33.62 1req s VAL 46 CO 0.23 -0.23 0.56 0.61 0.00 0.00 0.00 175.10 176.28 1req n GLY 47 N 4.47 -1.21 0.02 4.51 0.00 -1.26 -0.62 105.19 111.11 1req n GLY 47 Ca -0.09 -1.70 0.14 0.00 0.00 0.00 0.00 46.02 44.37 1req n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1req n THR 48 N -2.75 0.00 -3.65 2.61 -2.24 -1.26 -4.88 114.28 102.10 1req n THR 48 Ca 0.07 -0.01 -0.13 0.00 -2.27 0.00 0.00 64.05 61.71 1req n THR 48 Cb 0.25 -0.30 -0.08 0.00 -2.10 0.00 0.00 70.33 68.10 1req n THR 48 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1req s LEU 49 N -2.85 -0.55 -0.08 3.22 2.96 -1.26 -5.14 118.68 114.98 1req s LEU 49 Ca 0.18 1.34 0.05 0.00 -0.22 0.00 0.00 54.13 55.47 1req s LEU 49 Cb 0.19 2.26 -0.00 0.00 0.50 0.00 0.00 46.19 49.14 1req s LEU 49 CO 0.54 -0.23 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.76 1req s PHE 50 N 0.46 2.30 0.00 5.38 0.40 -1.26 -5.06 117.98 120.19 1req s PHE 50 Ca -0.01 -0.83 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 1req s PHE 50 Cb -0.05 -1.54 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1req s PHE 50 CO -0.01 -0.31 0.00 0.09 0.70 0.00 0.00 175.22 175.69 1req n ASN 51 N 3.33 1.68 0.22 1.36 4.13 -1.26 -4.72 115.26 120.00 1req n ASN 51 Ca -0.19 -0.89 0.15 0.00 1.68 0.00 0.00 54.58 55.33 1req n ASN 51 Cb 0.53 0.00 0.80 0.00 -1.54 0.00 0.00 39.78 39.56 1req n ASN 51 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1req h GLU 52 N 0.00 0.00 0.00 3.52 3.07 -1.99 -2.77 114.58 116.41 1req h GLU 52 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1req h GLU 52 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1req h GLU 52 CO 0.00 0.00 0.00 0.38 -1.40 0.00 0.00 179.01 177.99 1req h ASP 53 N 0.00 0.00 0.98 1.42 2.03 -2.01 -3.00 116.42 115.84 1req h ASP 53 Ca 0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 1req h ASP 53 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 1req h ASP 53 CO 0.00 0.00 -0.25 -0.37 -1.03 0.00 0.00 179.24 177.59 1req h VAL 54 N 0.00 0.59 0.00 4.15 -1.51 -1.87 -3.32 116.25 114.29 1req h VAL 54 Ca 0.00 -1.23 -0.01 0.00 -1.23 0.00 0.00 66.70 64.23 1req h VAL 54 Cb 0.54 1.83 -0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1req h VAL 54 CO 0.00 0.25 -0.06 1.88 -1.23 0.00 0.00 177.57 178.41 1req h TYR 55 N 0.00 0.00 -0.64 5.19 0.05 -1.77 -3.38 116.97 116.41 1req h TYR 55 Ca -0.00 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.84 1req h TYR 55 Cb 0.81 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.47 1req h TYR 55 CO 0.00 0.06 -0.38 1.63 -1.05 0.00 0.00 178.16 178.42 1req n LYS 56 N -3.23 -0.28 -0.11 4.88 4.01 -1.25 -1.77 118.16 120.41 1req n LYS 56 Ca -0.00 1.28 0.07 0.00 -0.51 0.00 0.00 58.31 59.15 1req n LYS 56 Cb 0.29 -1.89 0.25 0.00 -0.51 0.00 0.00 35.03 33.16 1req n LYS 56 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1req n ASP 57 N -4.46 1.46 -4.71 4.39 8.00 -1.26 -4.84 116.55 115.13 1req n ASP 57 Ca 0.01 -1.85 -0.39 0.00 0.71 0.00 0.00 54.79 53.27 1req n ASP 57 Cb 0.17 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.06 1req n ASP 57 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1req s MET 58 N -1.70 4.32 0.00 -1.24 -1.94 -0.73 -4.95 119.30 113.06 1req s MET 58 Ca 0.24 0.53 0.15 0.00 -1.71 0.00 0.00 55.69 54.90 1req s MET 58 Cb 0.13 -3.47 0.41 0.00 2.01 0.00 0.00 34.83 33.91 1req s MET 58 CO 0.18 0.06 1.34 -0.40 -0.01 0.00 0.00 175.02 176.19 1req n ASP 59 N 3.97 3.25 -0.12 3.03 5.68 -1.26 -4.53 116.55 126.57 1req n ASP 59 Ca -0.05 -1.98 0.06 0.00 -0.50 0.00 0.00 54.79 52.31 1req n ASP 59 Cb 0.51 -0.31 -0.04 0.00 -1.14 0.00 0.00 41.12 40.15 1req n ASP 59 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 1req n TRP 60 N 0.93 0.00 0.04 2.11 2.14 -1.26 -4.72 117.44 116.67 1req n TRP 60 Ca 0.16 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.73 1req n TRP 60 Cb 0.49 0.00 0.02 0.00 -0.81 0.00 0.00 31.31 31.01 1req n TRP 60 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1req n LEU 61 N -0.79 0.00 -2.10 5.67 4.77 -1.26 -1.80 117.00 121.49 1req n LEU 61 Ca 0.03 0.23 -0.11 0.00 -0.03 0.00 0.00 56.01 56.13 1req n LEU 61 Cb 0.21 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.12 1req n LEU 61 CO 0.19 -0.22 0.13 -0.67 -1.33 0.00 0.00 177.39 175.49 1req n ASP 62 N -1.23 3.27 -4.91 -1.43 2.03 -1.26 -4.96 116.55 108.05 1req n ASP 62 Ca 0.00 -3.10 -0.21 0.00 0.52 0.00 0.00 54.79 52.00 1req n ASP 62 Cb 0.01 -0.40 -0.01 0.00 -0.72 0.00 0.00 41.12 39.99 1req n ASP 62 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1req s THR 63 N -3.91 2.44 0.07 5.18 -4.23 -0.74 -5.14 115.64 109.32 1req s THR 63 Ca 0.41 -1.31 0.09 0.00 -1.18 0.00 0.00 61.69 59.70 1req s THR 63 Cb 0.38 -2.76 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 1req s THR 63 CO -0.01 0.00 -0.25 -0.31 -0.54 0.00 0.00 174.62 173.51 1req s TYR 64 N -2.54 2.37 0.54 3.99 2.02 -1.26 -4.99 117.35 117.48 1req s TYR 64 Ca 0.47 -0.37 -0.20 0.00 -0.37 0.00 0.00 57.07 56.60 1req s TYR 64 Cb -0.04 -1.37 -0.05 0.00 -0.40 0.00 0.00 41.96 40.10 1req s TYR 64 CO 0.28 0.22 1.18 0.00 -1.57 0.00 0.00 175.55 175.65 1req s ALA 65 N -0.91 2.71 -0.60 3.71 0.00 -1.26 -3.14 121.76 122.26 1req s ALA 65 Ca 0.13 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1req s ALA 65 Cb -0.10 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1req s ALA 65 CO 0.04 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1req n GLY 66 N 0.37 0.79 2.93 0.00 0.00 -0.81 -3.99 105.19 104.49 1req n GLY 66 Ca 0.11 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 1req n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1req s ILE 67 N -2.08 0.28 0.27 -0.61 1.01 -1.19 -4.68 121.20 114.21 1req s ILE 67 Ca 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.20 1req s ILE 67 Cb 0.00 -0.24 -0.14 0.00 0.01 0.00 0.00 42.46 42.09 1req s ILE 67 CO 0.00 0.08 1.13 -2.65 0.00 0.00 0.00 174.94 173.49 1req n PRO 68 N 2.99 1.52 -0.40 2.79 -0.02 -1.26 -1.06 135.00 139.55 1req n PRO 68 Ca -0.13 0.53 -0.01 0.00 -2.02 0.00 0.00 63.50 61.88 1req n PRO 68 Cb 0.59 -1.99 0.14 0.00 -0.02 0.00 0.00 33.50 32.21 1req n PRO 68 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1req n PRO 69 N 1.04 2.27 -3.99 0.52 -0.04 -1.26 -4.94 135.00 128.60 1req n PRO 69 Ca 0.10 -1.25 -0.28 0.00 -0.04 0.00 0.00 63.50 62.02 1req n PRO 69 Cb 0.31 -1.71 -0.01 0.00 -0.04 0.00 0.00 33.50 32.05 1req n PRO 69 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1req n PHE 70 N 0.13 -1.81 -0.10 0.54 3.72 -0.22 -3.56 117.46 116.16 1req n PHE 70 Ca 0.15 0.80 -0.12 0.00 -0.05 0.00 0.00 57.45 58.22 1req n PHE 70 Cb 0.73 -3.66 -0.04 0.00 -0.94 0.00 0.00 39.48 35.57 1req n PHE 70 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 1req h VAL 71 N -1.80 1.30 0.00 -4.37 3.04 -1.86 -2.14 116.25 110.42 1req h VAL 71 Ca -0.61 -1.29 -0.02 0.00 -1.01 0.00 0.00 66.70 63.77 1req h VAL 71 Cb 1.38 1.52 -0.00 0.00 -2.01 0.00 0.00 31.29 32.17 1req h VAL 71 CO 0.66 0.41 -0.08 0.45 -1.01 0.00 0.00 177.57 178.00 1req h HIS 72 N 0.36 0.00 0.00 3.17 3.86 -1.91 -3.43 115.15 117.20 1req h HIS 72 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1req h HIS 72 Cb 0.70 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.17 1req h HIS 72 CO 0.06 0.08 0.00 0.41 0.86 0.00 0.00 177.93 179.34 1req n GLY 73 N 0.01 3.04 0.21 2.45 0.00 -0.80 -4.38 105.19 105.72 1req n GLY 73 Ca 0.00 -1.27 -0.01 0.00 0.00 0.00 0.00 46.02 44.74 1req n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1req h PRO 74 N 0.00 0.27 -6.35 1.61 0.13 -1.84 -2.14 132.00 123.68 1req h PRO 74 Ca 0.00 -0.11 -0.67 0.00 -0.87 0.00 0.00 66.00 64.35 1req h PRO 74 Cb 0.00 -0.01 -0.16 0.00 0.13 0.00 0.00 31.00 30.96 1req h PRO 74 CO 0.00 0.57 -0.70 0.71 -0.23 0.00 0.00 178.00 178.35 1req s TYR 75 N -4.32 2.89 0.27 1.56 2.02 -1.26 -4.05 117.35 114.46 1req s TYR 75 Ca -0.05 -0.05 -0.04 0.00 -0.37 0.00 0.00 57.07 56.56 1req s TYR 75 Cb 0.14 -1.56 0.35 0.00 -0.40 0.00 0.00 41.96 40.49 1req s TYR 75 CO 0.77 0.41 1.93 0.00 -1.57 0.00 0.00 175.55 177.09 1req h ALA 76 N 4.12 1.35 0.00 3.71 0.00 -1.84 -3.11 119.26 123.49 1req h ALA 76 Ca -0.48 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1req h ALA 76 Cb 1.17 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1req h ALA 76 CO 0.55 0.58 -0.89 0.25 0.00 0.00 0.00 179.25 179.74 1req n THR 77 N -4.41 0.00 -1.86 0.00 -2.24 -1.26 -4.61 114.28 99.89 1req n THR 77 Ca 0.12 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1req n THR 77 Cb 0.05 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1req n THR 77 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1req n MET 78 N -1.51 0.00 0.00 -0.78 0.00 -1.21 -2.81 117.12 110.81 1req n MET 78 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 57.70 57.85 1req n MET 78 Cb 0.33 0.00 0.48 0.00 0.00 0.00 0.00 33.22 34.04 1req n MET 78 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1req n TYR 79 N 11.52 0.00 -0.24 2.03 4.01 -1.24 -1.93 117.16 131.33 1req n TYR 79 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.81 1req n TYR 79 Cb 0.00 -0.50 0.32 0.00 -0.31 0.00 0.00 39.34 38.85 1req n TYR 79 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1req h ALA 80 N 2.78 1.66 0.03 -0.72 0.00 -1.31 -3.14 119.26 118.55 1req h ALA 80 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.53 1req h ALA 80 Cb 0.39 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1req h ALA 80 CO 0.00 0.20 -2.05 0.34 0.00 0.00 0.00 179.25 177.75 1req n PHE 81 N -4.49 0.56 -3.70 0.00 7.35 -0.89 -5.01 117.46 111.27 1req n PHE 81 Ca 0.13 0.18 -0.11 0.00 -0.76 0.00 0.00 57.45 56.89 1req n PHE 81 Cb 0.25 -1.06 -0.11 0.00 0.35 0.00 0.00 39.48 38.91 1req n PHE 81 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1req s ARG 82 N -2.48 0.34 0.84 -4.13 3.52 -0.81 -5.11 118.95 111.13 1req s ARG 82 Ca -0.32 0.75 -0.12 0.00 -0.13 0.00 0.00 55.73 55.91 1req s ARG 82 Cb 0.09 -0.03 0.09 0.00 -1.56 0.00 0.00 34.95 33.55 1req s ARG 82 CO 0.60 -0.17 1.10 -1.25 -0.81 0.00 0.00 175.30 174.77 1req s PRO 83 N 1.46 1.74 1.02 5.12 0.04 -1.26 -3.59 135.00 139.53 1req s PRO 83 Ca -0.09 0.63 -0.11 0.00 0.04 0.00 0.00 61.00 61.47 1req s PRO 83 Cb -0.09 -1.88 0.21 0.00 0.04 0.00 0.00 34.50 32.78 1req s PRO 83 CO -0.12 -1.86 1.10 -2.67 0.04 0.00 0.00 177.00 173.49 1req n TRP 84 N -3.59 0.04 -2.62 0.56 2.14 -1.26 -4.96 117.44 107.75 1req n TRP 84 Ca 0.07 0.18 -0.42 0.00 2.07 0.00 0.00 57.50 59.40 1req n TRP 84 Cb 0.56 -1.89 -0.03 0.00 -0.81 0.00 0.00 31.31 29.15 1req n TRP 84 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 1req s THR 85 N -2.55 4.62 -0.47 -1.67 2.01 -0.53 -4.94 115.64 112.12 1req s THR 85 Ca 0.68 1.91 -0.29 0.00 0.31 0.00 0.00 61.69 64.29 1req s THR 85 Cb -0.24 -4.22 0.02 0.00 0.01 0.00 0.00 72.50 68.06 1req s THR 85 CO 0.61 0.01 1.30 -0.63 -0.69 0.00 0.00 174.62 175.21 1req s ILE 86 N 2.02 4.01 -0.51 1.82 1.01 -1.26 -1.64 121.20 126.65 1req s ILE 86 Ca 0.51 1.00 0.05 0.00 0.00 0.00 0.00 60.65 62.21 1req s ILE 86 Cb -0.20 -4.42 0.18 0.00 0.01 0.00 0.00 42.46 38.03 1req s ILE 86 CO 0.20 -0.94 0.42 -1.14 0.00 0.00 0.00 174.94 173.48 1req n ARG 87 N 8.09 0.84 -2.81 2.79 0.63 -0.46 -1.44 116.66 124.29 1req n ARG 87 Ca 0.14 -3.64 -0.42 0.00 -0.92 0.00 0.00 57.85 53.01 1req n ARG 87 Cb 0.49 -1.85 -0.03 0.00 0.45 0.00 0.00 32.46 31.52 1req n ARG 87 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 1req s GLN 88 N -0.63 4.43 0.17 -0.14 -1.52 -1.26 -3.69 119.66 117.02 1req s GLN 88 Ca 0.31 1.21 -0.30 0.00 -1.95 0.00 0.00 55.36 54.63 1req s GLN 88 Cb 0.03 -3.51 -0.07 0.00 -0.22 0.00 0.00 33.01 29.24 1req s GLN 88 CO -0.17 -0.18 0.95 -0.47 -0.25 0.00 0.00 175.29 175.16 1req s TYR 89 N 1.58 3.89 0.07 0.91 5.04 -1.26 -3.90 117.35 123.68 1req s TYR 89 Ca 0.45 1.85 -0.27 0.00 -2.44 0.00 0.00 57.07 56.66 1req s TYR 89 Cb -0.18 -3.02 0.08 0.00 0.35 0.00 0.00 41.96 39.18 1req s TYR 89 CO 0.19 0.31 0.92 0.00 -1.34 0.00 0.00 175.55 175.63 1req s ALA 90 N -0.50 -1.74 0.00 3.97 0.00 -0.88 -4.96 121.76 117.65 1req s ALA 90 Ca 0.44 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.99 1req s ALA 90 Cb -0.24 0.53 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1req s ALA 90 CO 0.31 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.62 1req n GLY 91 N -0.36 4.56 3.53 0.00 0.00 -1.26 -1.76 105.19 109.90 1req n GLY 91 Ca -0.08 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.16 1req n GLY 91 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1req s PHE 92 N -0.97 -0.54 0.00 1.61 -0.71 -1.26 -3.95 117.98 112.16 1req s PHE 92 Ca 0.00 0.85 0.00 0.00 -1.04 0.00 0.00 56.93 56.74 1req s PHE 92 Cb 0.00 0.44 0.00 0.00 -1.21 0.00 0.00 43.02 42.25 1req s PHE 92 CO 0.00 -0.54 0.00 0.45 -1.34 0.00 0.00 175.22 173.79 1req n SER 93 N 0.69 0.00 -4.97 1.98 2.88 0.19 -4.06 113.62 110.32 1req n SER 93 Ca -0.15 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.17 1req n SER 93 Cb 0.58 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.06 1req n SER 93 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1req s THR 94 N 0.00 3.57 0.13 2.46 -4.23 -1.26 -1.68 115.64 114.63 1req s THR 94 Ca 0.00 -0.67 -0.18 0.00 -1.18 0.00 0.00 61.69 59.66 1req s THR 94 Cb 0.00 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.52 1req s THR 94 CO 0.00 -0.18 1.77 0.00 -0.54 0.00 0.00 174.62 175.67 1req h ALA 95 N 0.41 0.40 -0.56 3.99 0.00 -1.82 0.14 119.26 121.82 1req h ALA 95 Ca -0.44 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1req h ALA 95 Cb 1.27 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1req h ALA 95 CO 0.54 -0.11 0.37 0.87 0.00 0.00 0.00 179.25 180.91 1req h LYS 96 N 0.41 0.74 -0.46 0.00 1.57 -1.91 0.14 116.57 117.06 1req h LYS 96 Ca 0.11 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 1req h LYS 96 Cb -0.01 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1req h LYS 96 CO -0.02 0.50 -0.11 0.93 -0.57 0.00 0.00 179.45 180.18 1req h GLU 97 N 0.76 0.88 0.04 3.15 5.08 -1.79 0.54 114.58 123.23 1req h GLU 97 Ca 0.21 -0.34 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1req h GLU 97 Cb -0.07 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1req h GLU 97 CO -0.04 0.98 -0.08 0.77 -1.00 0.00 0.00 179.01 179.64 1req h SER 98 N 0.72 -0.22 -0.34 1.42 0.02 -0.73 -1.40 113.55 113.01 1req h SER 98 Ca 0.12 0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1req h SER 98 Cb 0.65 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1req h SER 98 CO 0.04 -0.12 0.10 -1.13 -1.14 0.00 0.00 176.83 174.59 1req h ASN 99 N -0.16 0.57 -0.38 3.07 -0.73 -0.63 0.30 115.58 117.63 1req h ASN 99 Ca 0.02 -0.08 -0.04 0.00 1.87 0.00 0.00 56.30 58.07 1req h ASN 99 Cb 0.18 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.60 1req h ASN 99 CO -0.06 0.57 0.10 0.00 -0.37 0.00 0.00 177.43 177.67 1req h ALA 100 N 1.51 0.50 -0.67 1.57 0.00 -0.18 -2.32 119.26 119.66 1req h ALA 100 Ca 0.14 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.96 1req h ALA 100 Cb 0.23 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1req h ALA 100 CO -0.00 0.16 0.32 0.35 0.00 0.00 0.00 179.25 180.08 1req h PHE 101 N 0.46 0.58 -0.70 0.00 3.57 -0.66 -2.05 116.94 118.14 1req h PHE 101 Ca 0.12 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.74 1req h PHE 101 Cb 0.29 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 38.81 1req h PHE 101 CO 0.02 0.21 0.35 1.88 -2.23 0.00 0.00 178.31 178.53 1req h TYR 102 N 0.56 0.63 0.00 0.41 0.05 -0.84 -0.68 116.97 117.11 1req h TYR 102 Ca 0.33 0.03 -0.19 0.00 0.05 0.00 0.00 58.73 58.95 1req h TYR 102 Cb 0.34 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 1req h TYR 102 CO -0.12 0.23 -0.89 0.00 -1.05 0.00 0.00 178.16 176.33 1req h ARG 103 N 0.60 0.01 -0.26 4.88 3.08 -0.82 -0.55 114.38 121.33 1req h ARG 103 Ca 0.34 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 60.20 1req h ARG 103 Cb 0.35 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 1req h ARG 103 CO -0.26 0.89 -0.53 0.00 -1.07 0.00 0.00 179.97 179.00 1req h ARG 104 N 0.01 0.75 -0.60 0.04 3.08 -1.19 -1.75 114.38 114.72 1req h ARG 104 Ca -0.01 -0.47 -0.06 0.00 0.07 0.00 0.00 59.98 59.52 1req h ARG 104 Cb 1.57 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.65 1req h ARG 104 CO 0.12 1.09 0.15 -0.91 -1.07 0.00 0.00 179.97 179.35 1req h ASN 105 N 0.58 0.90 -0.14 7.04 2.35 -0.90 -2.37 115.58 123.05 1req h ASN 105 Ca 0.02 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.41 1req h ASN 105 Cb 1.11 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.23 1req h ASN 105 CO 0.11 0.90 -0.34 -0.07 -1.65 0.00 0.00 177.43 176.38 1req h LEU 106 N 0.86 0.67 -1.87 1.61 3.38 -1.04 -1.35 115.31 117.57 1req h LEU 106 Ca 0.19 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1req h LEU 106 Cb 0.35 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1req h LEU 106 CO 0.00 0.95 -0.13 0.00 0.09 0.00 0.00 178.44 179.35 1req h ALA 107 N 1.09 1.30 -0.45 1.53 0.00 -1.18 -2.42 119.26 119.12 1req h ALA 107 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1req h ALA 107 Cb 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1req h ALA 107 CO 0.07 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.48 1req n ALA 108 N -2.29 3.25 0.00 0.00 0.00 -0.90 -4.91 120.51 115.66 1req n ALA 108 Ca -0.02 -1.29 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1req n ALA 108 Cb 0.25 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1req n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 109 N 0.68 1.34 3.77 0.00 0.00 -0.91 -4.97 105.19 105.10 1req n GLY 109 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1req n GLY 109 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1req s GLN 110 N -0.21 3.95 -0.26 1.61 0.74 -0.53 -4.91 119.66 120.04 1req s GLN 110 Ca 0.00 2.06 -0.14 0.00 0.05 0.00 0.00 55.36 57.33 1req s GLN 110 Cb 0.00 -2.70 -0.11 0.00 1.10 0.00 0.00 33.01 31.30 1req s GLN 110 CO 0.00 -0.48 -0.35 1.17 -0.55 0.00 0.00 175.29 175.08 1req n LYS 111 N 0.04 0.57 -5.19 1.67 3.00 -0.52 -4.52 118.16 113.21 1req n LYS 111 Ca 0.04 0.25 -0.32 0.00 -0.00 0.00 0.00 58.31 58.29 1req n LYS 111 Cb 0.45 -1.46 -0.16 0.00 0.00 0.00 0.00 35.03 33.86 1req n LYS 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1req s GLY 112 N -5.43 1.34 0.52 3.14 0.00 -0.59 -4.82 107.32 101.48 1req s GLY 112 Ca -0.37 -1.05 -0.14 0.00 0.00 0.00 0.00 44.72 43.16 1req s GLY 112 CO 0.47 -0.74 0.95 1.08 0.00 0.00 0.00 173.10 174.86 1req s LEU 113 N -0.39 3.57 -0.13 0.66 1.43 -1.15 -4.15 118.68 118.52 1req s LEU 113 Ca 0.03 1.44 -0.05 0.00 -1.03 0.00 0.00 54.13 54.52 1req s LEU 113 Cb -0.12 -4.39 0.06 0.00 0.03 0.00 0.00 46.19 41.76 1req s LEU 113 CO 0.02 -0.62 0.28 -0.55 0.23 0.00 0.00 176.35 175.70 1req s SER 114 N -3.38 0.00 -0.16 2.29 0.15 -1.25 -1.13 113.70 110.22 1req s SER 114 Ca 0.56 0.62 -0.06 0.00 0.70 0.00 0.00 55.95 57.77 1req s SER 114 Cb -0.10 0.63 -0.04 0.00 -1.71 0.00 0.00 66.02 64.80 1req s SER 114 CO 0.37 -0.21 0.05 -0.69 1.20 0.00 0.00 173.24 173.96 1req s VAL 115 N 1.89 4.68 -0.22 4.45 1.01 -0.13 -2.06 120.40 130.03 1req s VAL 115 Ca -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.82 1req s VAL 115 Cb -0.11 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1req s VAL 115 CO -0.09 0.50 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 1req s ALA 116 N 0.02 2.89 0.12 5.51 0.00 -0.72 -2.32 121.76 127.25 1req s ALA 116 Ca 0.05 -1.11 0.04 0.00 0.00 0.00 0.00 51.96 50.93 1req s ALA 116 Cb -0.12 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1req s ALA 116 CO 0.01 -0.35 0.13 -0.06 0.00 0.00 0.00 175.76 175.49 1req s PHE 117 N 1.34 3.22 1.05 0.00 0.08 -1.26 -1.70 117.98 120.72 1req s PHE 117 Ca 0.04 0.05 -0.14 0.00 0.12 0.00 0.00 56.93 57.01 1req s PHE 117 Cb -0.14 -1.59 0.22 0.00 -0.57 0.00 0.00 43.02 40.93 1req s PHE 117 CO -0.01 0.53 1.09 0.16 -0.10 0.00 0.00 175.22 176.89 1req s ASP 118 N -2.76 2.15 0.15 1.36 1.47 0.21 -4.01 116.67 115.23 1req s ASP 118 Ca 0.31 1.06 -0.11 0.00 1.18 0.00 0.00 52.55 54.99 1req s ASP 118 Cb -0.11 -1.65 -0.02 0.00 -0.34 0.00 0.00 42.92 40.80 1req s ASP 118 CO 0.24 -3.41 1.52 -0.07 0.68 0.00 0.00 175.17 174.12 1req h LEU 119 N -2.09 1.00 -0.44 2.11 3.38 -1.89 -2.34 115.31 115.04 1req h LEU 119 Ca -0.53 -0.42 0.08 0.00 0.09 0.00 0.00 57.88 57.09 1req h LEU 119 Cb 1.33 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 1req h LEU 119 CO 0.53 1.21 0.06 -0.65 0.09 0.00 0.00 178.44 179.68 1req h PRO 120 N 0.80 0.18 -0.64 1.13 0.11 -1.88 -1.45 132.00 130.24 1req h PRO 120 Ca 0.09 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.28 1req h PRO 120 Cb 0.86 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.86 1req h PRO 120 CO 0.08 0.12 0.28 1.15 -0.21 0.00 0.00 178.00 179.41 1req h THR 121 N 0.18 0.81 -0.44 -1.15 2.02 -1.62 -0.84 112.91 111.87 1req h THR 121 Ca 0.22 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 67.28 1req h THR 121 Cb 0.29 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 1req h THR 121 CO -0.31 0.09 0.19 0.45 0.37 0.00 0.00 175.52 176.31 1req h HIS 122 N 0.49 0.35 -0.43 3.16 3.86 -0.79 -2.87 115.15 118.92 1req h HIS 122 Ca 0.32 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.49 1req h HIS 122 Cb 0.37 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 1req h HIS 122 CO -0.14 0.16 0.07 0.54 0.86 0.00 0.00 177.93 179.42 1req n ARG 123 N -4.95 3.32 -2.15 2.45 1.74 -0.63 -2.36 116.66 114.08 1req n ARG 123 Ca 0.03 -2.09 -0.12 0.00 -0.77 0.00 0.00 57.85 54.90 1req n ARG 123 Cb 0.14 -1.98 -0.01 0.00 -1.02 0.00 0.00 32.46 29.59 1req n ARG 123 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1req n GLY 124 N 0.25 0.01 3.68 -0.13 0.00 -0.93 -4.92 105.19 103.15 1req n GLY 124 Ca 0.22 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1req n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1req s TYR 125 N -2.59 3.08 0.57 1.61 2.02 -0.36 -4.03 117.35 117.65 1req s TYR 125 Ca 0.00 0.09 -0.14 0.00 -0.37 0.00 0.00 57.07 56.65 1req s TYR 125 Cb 0.00 -1.69 -0.05 0.00 -0.40 0.00 0.00 41.96 39.82 1req s TYR 125 CO 0.00 0.46 1.01 -0.51 -1.57 0.00 0.00 175.55 174.94 1req s ASP 126 N -1.44 6.34 0.45 2.29 1.01 -1.26 -3.82 116.67 120.23 1req s ASP 126 Ca 0.18 1.52 0.23 0.00 0.71 0.00 0.00 52.55 55.19 1req s ASP 126 Cb -0.11 -2.49 1.06 0.00 1.01 0.00 0.00 42.92 42.39 1req s ASP 126 CO 0.09 -0.79 1.91 0.28 0.21 0.00 0.00 175.17 176.87 1req h SER 127 N 0.27 0.00 0.17 0.27 0.02 -1.93 -2.62 113.55 109.72 1req h SER 127 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1req h SER 127 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1req h SER 127 CO 0.61 0.23 -0.03 -0.90 -1.14 0.00 0.00 176.83 175.60 1req n ASP 128 N -3.63 0.40 -4.67 3.07 5.68 -1.26 -4.69 116.55 111.45 1req n ASP 128 Ca -0.01 -0.86 -0.42 0.00 -0.50 0.00 0.00 54.79 52.99 1req n ASP 128 Cb 0.36 -0.05 -0.03 0.00 -1.14 0.00 0.00 41.12 40.26 1req n ASP 128 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1req s ASN 129 N -2.20 6.60 0.47 -1.12 3.84 -0.99 -4.92 114.94 116.61 1req s ASN 129 Ca 0.38 2.42 0.12 0.00 0.21 0.00 0.00 52.86 55.99 1req s ASN 129 Cb 0.21 -2.54 1.08 0.00 -0.55 0.00 0.00 41.25 39.44 1req s ASN 129 CO 0.40 -0.94 2.09 -0.65 -2.79 0.00 0.00 177.10 175.22 1req h PRO 130 N 9.29 0.27 0.00 0.43 0.11 -1.89 -2.81 132.00 137.40 1req h PRO 130 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1req h PRO 130 Cb 1.20 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1req h PRO 130 CO 0.94 0.18 0.00 -0.09 -0.21 0.00 0.00 178.00 178.82 1req h ARG 131 N 0.27 0.00 -0.05 1.05 2.43 -1.96 -3.27 114.38 112.86 1req h ARG 131 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1req h ARG 131 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1req h ARG 131 CO -0.02 0.00 0.00 1.33 -1.51 0.00 0.00 179.97 179.77 1req n VAL 132 N -2.94 0.82 -0.32 0.20 0.24 -1.06 -4.83 118.33 110.45 1req n VAL 132 Ca -0.02 -0.91 0.12 0.00 -2.04 0.00 0.00 64.34 61.49 1req n VAL 132 Cb 0.13 0.59 0.30 0.00 -1.47 0.00 0.00 33.84 33.40 1req n VAL 132 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1req h ALA 133 N 0.32 1.50 0.00 2.33 0.00 -1.66 -0.49 119.26 121.26 1req h ALA 133 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1req h ALA 133 Cb 0.45 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1req h ALA 133 CO 0.00 -0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.46 1req n GLY 134 N -1.33 -1.12 0.25 0.00 0.00 -1.26 -3.16 105.19 98.57 1req n GLY 134 Ca 0.22 -0.11 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1req n GLY 134 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1req n ASP 135 N -1.32 1.34 -4.66 1.61 8.00 -0.21 -4.65 116.55 116.65 1req n ASP 135 Ca 0.11 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 54.01 1req n ASP 135 Cb 0.21 0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 1req n ASP 135 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1req s VAL 136 N -1.02 3.79 -0.08 2.53 1.01 -1.11 -2.78 120.40 122.74 1req s VAL 136 Ca 0.08 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1req s VAL 136 Cb 0.07 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1req s VAL 136 CO 0.17 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1req n GLY 137 N 3.93 0.31 0.14 4.51 0.00 -1.26 -4.74 105.19 108.08 1req n GLY 137 Ca 0.16 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1req n GLY 137 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1req h MET 138 N 0.45 0.31 -0.01 1.61 2.07 -1.88 0.57 114.93 118.06 1req h MET 138 Ca -0.01 -0.53 0.00 0.00 -2.07 0.00 0.00 59.70 57.09 1req h MET 138 Cb 0.53 0.20 0.00 0.00 -1.87 0.00 0.00 31.60 30.45 1req h MET 138 CO 0.02 1.24 -0.31 0.00 1.07 0.00 0.00 176.91 178.93 1req n ALA 139 N -2.94 3.14 0.00 6.32 0.00 -1.26 -4.90 120.51 120.86 1req n ALA 139 Ca -0.29 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1req n ALA 139 Cb 1.06 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1req n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 140 N 1.14 -1.10 3.75 0.00 0.00 -1.26 -4.71 105.19 103.01 1req n GLY 140 Ca 0.07 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 1req n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1req s VAL 141 N -3.00 3.09 -0.41 1.61 0.11 -0.69 -2.28 120.40 118.84 1req s VAL 141 Ca 0.00 1.01 -0.24 0.00 -2.93 0.00 0.00 61.98 59.83 1req s VAL 141 Cb 0.00 -3.65 0.02 0.00 -1.53 0.00 0.00 36.38 31.22 1req s VAL 141 CO 0.00 0.21 0.81 0.00 -3.33 0.00 0.00 175.10 172.79 1req s ALA 142 N -0.67 3.35 -0.13 1.54 0.00 -0.68 -0.62 121.76 124.56 1req s ALA 142 Ca 0.51 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1req s ALA 142 Cb -0.37 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.32 1req s ALA 142 CO 0.44 -1.72 -0.13 0.42 0.00 0.00 0.00 175.76 174.77 1req s ILE 143 N 3.29 1.45 0.00 0.00 -1.09 -1.26 -4.55 121.20 119.03 1req s ILE 143 Ca 0.32 -0.58 0.00 0.00 -2.23 0.00 0.00 60.65 58.16 1req s ILE 143 Cb -0.12 -1.36 0.00 0.00 -1.58 0.00 0.00 42.46 39.40 1req s ILE 143 CO 0.20 0.44 0.00 0.47 -1.23 0.00 0.00 174.94 174.82 1req n ASP 144 N 4.58 4.92 -1.80 3.58 8.00 -1.26 -4.69 116.55 129.87 1req n ASP 144 Ca -0.17 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.31 1req n ASP 144 Cb 0.50 0.67 0.01 0.00 -0.02 0.00 0.00 41.12 42.28 1req n ASP 144 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1req n SER 145 N -1.79 -0.79 -0.21 -2.24 3.41 -1.26 -0.04 113.62 110.69 1req n SER 145 Ca 0.00 -1.49 0.22 0.00 -0.26 0.00 0.00 58.87 57.35 1req n SER 145 Cb 0.31 1.30 0.59 0.00 -0.26 0.00 0.00 64.21 66.15 1req n SER 145 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1req h ILE 146 N 1.39 0.63 -0.24 -1.33 6.09 -1.83 -1.51 117.51 120.70 1req h ILE 146 Ca -0.12 -0.09 0.05 0.00 -1.37 0.00 0.00 64.86 63.33 1req h ILE 146 Cb 0.48 0.36 -0.05 0.00 0.47 0.00 0.00 36.82 38.08 1req h ILE 146 CO 0.15 0.05 -0.05 1.88 -3.07 0.00 0.00 178.15 177.11 1req h TYR 147 N 0.25 -0.11 -0.45 2.19 0.05 -1.97 -1.01 116.97 115.93 1req h TYR 147 Ca 0.45 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 59.17 1req h TYR 147 Cb 1.35 0.09 -0.02 0.00 1.01 0.00 0.00 36.73 39.16 1req h TYR 147 CO -0.00 -0.10 -0.04 -0.44 -1.05 0.00 0.00 178.16 176.53 1req h ASP 148 N 0.01 0.82 0.03 3.88 3.32 -1.63 -2.85 116.42 120.00 1req h ASP 148 Ca 0.12 -0.33 -0.09 0.00 0.02 0.00 0.00 57.03 56.74 1req h ASP 148 Cb 0.17 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1req h ASP 148 CO -0.24 0.95 -0.27 0.24 -1.72 0.00 0.00 179.24 178.20 1req h MET 149 N 0.66 0.38 -0.38 3.56 2.86 -1.33 -1.43 114.93 119.25 1req h MET 149 Ca 0.12 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 1req h MET 149 Cb 0.56 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 1req h MET 149 CO 0.03 0.63 0.09 0.00 1.06 0.00 0.00 176.91 178.72 1req h ARG 150 N 0.34 0.61 -0.61 1.72 3.08 -1.17 -3.11 114.38 115.24 1req h ARG 150 Ca 0.05 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 1req h ARG 150 Cb 0.66 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1req h ARG 150 CO 0.05 0.64 0.05 0.93 -1.07 0.00 0.00 179.97 180.58 1req h GLU 151 N 0.47 1.04 -0.48 0.04 5.08 -1.43 -2.34 114.58 116.97 1req h GLU 151 Ca 0.12 -0.30 0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1req h GLU 151 Cb 0.31 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 1req h GLU 151 CO 0.00 1.00 0.13 1.25 -1.00 0.00 0.00 179.01 180.38 1req h LEU 152 N 0.95 0.08 -3.61 1.33 5.85 -1.19 -2.79 115.31 115.92 1req h LEU 152 Ca 0.18 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.86 1req h LEU 152 Cb 0.49 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.53 1req h LEU 152 CO 0.02 0.07 0.13 0.49 -0.34 0.00 0.00 178.44 178.81 1req n PHE 153 N -5.06 2.10 -2.35 1.25 3.72 -1.19 -4.47 117.46 111.45 1req n PHE 153 Ca 0.05 -1.01 -0.42 0.00 -0.05 0.00 0.00 57.45 56.01 1req n PHE 153 Cb 0.21 -0.58 -0.03 0.00 -0.94 0.00 0.00 39.48 38.15 1req n PHE 153 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1req s ALA 154 N -2.91 3.52 0.00 4.37 0.00 -0.89 -1.85 121.76 124.00 1req s ALA 154 Ca 0.53 0.77 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1req s ALA 154 Cb 0.42 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 20.00 1req s ALA 154 CO 0.13 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.52 1req n GLY 155 N 3.47 0.73 2.91 0.00 0.00 -1.26 -5.02 105.19 106.02 1req n GLY 155 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1req n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1req s ILE 156 N -2.52 1.64 -0.14 -0.61 1.01 -0.77 -5.10 121.20 114.70 1req s ILE 156 Ca 0.00 -1.72 -0.29 0.00 0.00 0.00 0.00 60.65 58.64 1req s ILE 156 Cb 0.00 -2.12 -0.05 0.00 0.01 0.00 0.00 42.46 40.30 1req s ILE 156 CO 0.00 -0.47 1.94 -2.84 0.00 0.00 0.00 174.94 173.57 1req s PRO 157 N 1.26 3.66 0.23 2.79 0.02 -1.26 -4.91 135.00 136.78 1req s PRO 157 Ca 0.05 2.07 0.25 0.00 0.02 0.00 0.00 61.00 63.40 1req s PRO 157 Cb -0.18 -4.20 0.86 0.00 0.02 0.00 0.00 34.50 31.00 1req s PRO 157 CO -0.13 -1.49 1.76 1.28 -0.33 0.00 0.00 177.00 178.10 1req n LEU 158 N 9.35 0.79 0.13 -5.54 4.77 -1.26 -2.60 117.00 122.64 1req n LEU 158 Ca 0.23 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.82 1req n LEU 158 Cb 0.44 -0.39 0.05 0.00 -2.33 0.00 0.00 43.42 41.19 1req n LEU 158 CO 0.66 -0.29 0.42 -2.24 -1.33 0.00 0.00 177.39 174.61 1req h ASP 159 N 0.00 0.00 -0.03 -1.43 2.03 -1.91 -3.33 116.42 111.75 1req h ASP 159 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1req h ASP 159 Cb 0.64 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 1req h ASP 159 CO 0.00 0.62 -0.02 0.00 -1.03 0.00 0.00 179.24 178.82 1req n GLN 160 N -3.35 1.84 -4.30 4.15 6.02 -1.07 -4.91 117.38 115.76 1req n GLN 160 Ca 0.01 -1.69 -0.23 0.00 -0.01 0.00 0.00 57.00 55.07 1req n GLN 160 Cb 0.74 -1.39 -0.13 0.00 1.02 0.00 0.00 30.24 30.48 1req n GLN 160 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1req s MET 161 N -1.74 1.09 -0.23 -1.09 -1.94 -1.13 -5.04 119.30 109.22 1req s MET 161 Ca 0.24 -1.10 -0.08 0.00 -1.71 0.00 0.00 55.69 53.05 1req s MET 161 Cb 0.17 -1.30 -0.03 0.00 2.01 0.00 0.00 34.83 35.68 1req s MET 161 CO 0.27 0.30 0.08 0.45 -0.01 0.00 0.00 175.02 176.11 1req s SER 162 N -1.79 5.34 -0.12 3.03 0.15 -1.26 -4.40 113.70 114.65 1req s SER 162 Ca 0.05 -0.11 0.02 0.00 0.70 0.00 0.00 55.95 56.61 1req s SER 162 Cb -0.10 -1.95 0.01 0.00 -1.71 0.00 0.00 66.02 62.28 1req s SER 162 CO 0.04 0.03 -0.17 -0.69 1.20 0.00 0.00 173.24 173.64 1req s VAL 163 N 1.24 1.67 0.09 4.45 1.01 -0.77 -2.92 120.40 125.18 1req s VAL 163 Ca 0.05 -0.74 -0.07 0.00 0.00 0.00 0.00 61.98 61.22 1req s VAL 163 Cb -0.14 -1.51 -0.06 0.00 0.00 0.00 0.00 36.38 34.67 1req s VAL 163 CO 0.04 0.47 0.37 -0.55 0.00 0.00 0.00 175.10 175.43 1req s SER 164 N 1.01 6.56 -0.05 3.32 0.15 -0.28 -1.49 113.70 122.91 1req s SER 164 Ca -0.05 0.67 -0.02 0.00 0.70 0.00 0.00 55.95 57.25 1req s SER 164 Cb -0.15 -2.13 0.03 0.00 -1.71 0.00 0.00 66.02 62.06 1req s SER 164 CO -0.03 0.13 0.05 -0.04 1.20 0.00 0.00 173.24 174.55 1req s MET 165 N -2.19 0.11 -0.82 5.44 -1.94 0.40 -0.95 119.30 119.33 1req s MET 165 Ca 0.35 0.29 -0.21 0.00 -1.71 0.00 0.00 55.69 54.42 1req s MET 165 Cb -0.13 -0.68 0.10 0.00 2.01 0.00 0.00 34.83 36.13 1req s MET 165 CO 0.20 -0.34 1.08 0.99 -0.01 0.00 0.00 175.02 176.94 1req s THR 166 N 2.12 4.51 -0.27 2.05 2.01 -0.98 -1.59 115.64 123.48 1req s THR 166 Ca 0.05 -1.02 -0.09 0.00 0.31 0.00 0.00 61.69 60.94 1req s THR 166 Cb -0.12 -4.76 0.12 0.00 0.01 0.00 0.00 72.50 67.75 1req s THR 166 CO -0.04 -1.51 0.58 -0.32 -0.69 0.00 0.00 174.62 172.64 1req s MET 167 N 3.40 0.51 -0.01 4.92 0.00 -1.26 -4.54 119.30 122.31 1req s MET 167 Ca 0.29 1.33 -0.01 0.00 0.00 0.00 0.00 55.69 57.30 1req s MET 167 Cb -0.10 0.71 -0.00 0.00 0.00 0.00 0.00 34.83 35.44 1req s MET 167 CO -0.01 -0.23 -0.01 0.09 0.00 0.00 0.00 175.02 174.86 1req n ASN 168 N 5.43 0.20 0.06 1.11 3.02 -1.26 -1.37 115.26 122.45 1req n ASN 168 Ca -0.11 0.01 -0.03 0.00 -0.03 0.00 0.00 54.58 54.43 1req n ASN 168 Cb 0.49 -0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 39.62 1req n ASN 168 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1req h GLY 169 N -0.04 -0.18 -3.34 7.41 0.00 -1.67 -3.32 103.07 101.94 1req h GLY 169 Ca -0.03 0.07 -0.25 0.00 0.00 0.00 0.00 47.33 47.12 1req h GLY 169 CO -0.02 -0.07 0.32 0.00 0.00 0.00 0.00 176.54 176.78 1req n ALA 170 N -2.20 4.81 -0.19 3.60 0.00 -0.99 -4.67 120.51 120.86 1req n ALA 170 Ca -0.02 -1.28 -0.06 0.00 0.00 0.00 0.00 53.44 52.08 1req n ALA 170 Cb 0.07 -1.28 0.04 0.00 0.00 0.00 0.00 19.45 18.27 1req n ALA 170 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1req h VAL 171 N 0.97 1.10 0.60 0.00 3.04 -1.85 -2.10 116.25 118.01 1req h VAL 171 Ca 0.23 -0.24 -0.02 0.00 -1.01 0.00 0.00 66.70 65.65 1req h VAL 171 Cb 0.97 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.57 1req h VAL 171 CO 0.59 0.13 -0.41 -0.07 -1.01 0.00 0.00 177.57 176.79 1req h LEU 172 N 0.71 -1.06 -0.40 3.16 3.38 -1.90 0.16 115.31 119.36 1req h LEU 172 Ca 0.22 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.30 1req h LEU 172 Cb -0.03 0.32 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1req h LEU 172 CO -0.07 -0.62 0.16 1.55 0.09 0.00 0.00 178.44 179.55 1req h PRO 173 N -0.97 0.33 -0.09 1.13 0.13 -1.92 -0.43 132.00 130.17 1req h PRO 173 Ca -0.07 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 1req h PRO 173 Cb 0.80 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 1req h PRO 173 CO 0.04 0.22 0.02 0.82 -0.23 0.00 0.00 178.00 178.87 1req h ILE 174 N 0.34 1.19 -0.52 -3.56 1.08 -1.19 -0.28 117.51 114.57 1req h ILE 174 Ca 0.18 -0.59 0.04 0.00 -0.39 0.00 0.00 64.86 64.10 1req h ILE 174 Cb 0.13 1.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 1req h ILE 174 CO -0.16 0.17 0.27 0.25 -0.69 0.00 0.00 178.15 177.99 1req h LEU 175 N -0.06 0.39 -1.10 1.44 5.85 -0.65 -2.42 115.31 118.75 1req h LEU 175 Ca 0.03 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 1req h LEU 175 Cb 0.25 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 1req h LEU 175 CO 0.00 0.27 0.23 0.00 -0.34 0.00 0.00 178.44 178.60 1req h ALA 176 N 1.28 1.29 -0.30 1.25 0.00 -0.89 -2.21 119.26 119.68 1req h ALA 176 Ca 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 176 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1req h ALA 176 CO -0.16 0.53 0.04 -0.07 0.00 0.00 0.00 179.25 179.59 1req h LEU 177 N 0.86 0.40 -0.13 0.00 3.38 -0.58 -0.73 115.31 118.51 1req h LEU 177 Ca 0.20 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1req h LEU 177 Cb 0.18 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1req h LEU 177 CO -0.02 0.43 0.07 0.22 0.09 0.00 0.00 178.44 179.23 1req h TYR 178 N 0.43 0.18 -0.84 1.13 3.20 -1.11 0.21 116.97 120.17 1req h TYR 178 Ca 0.10 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.01 1req h TYR 178 Cb 0.22 -0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.38 1req h TYR 178 CO 0.01 0.20 0.52 0.28 -1.64 0.00 0.00 178.16 177.53 1req h VAL 179 N 0.10 1.07 -0.39 1.81 2.07 -0.80 -1.76 116.25 118.35 1req h VAL 179 Ca 0.04 -0.34 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 1req h VAL 179 Cb 0.09 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1req h VAL 179 CO -0.01 0.18 -0.30 0.58 0.02 0.00 0.00 177.57 178.04 1req h VAL 180 N 0.98 1.28 -0.28 2.57 2.07 -0.98 -1.88 116.25 120.00 1req h VAL 180 Ca 0.35 -1.46 0.01 0.00 0.82 0.00 0.00 66.70 66.42 1req h VAL 180 Cb 0.11 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1req h VAL 180 CO -0.15 0.49 0.18 0.74 0.02 0.00 0.00 177.57 178.84 1req h THR 181 N 0.72 1.06 -0.06 2.57 2.02 0.07 -2.47 112.91 116.81 1req h THR 181 Ca 0.08 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 67.16 1req h THR 181 Cb 0.86 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 1req h THR 181 CO 0.08 0.07 -0.08 0.00 0.37 0.00 0.00 175.52 175.95 1req h ALA 182 N 1.11 -0.03 -0.88 6.16 0.00 -1.17 -2.95 119.26 121.51 1req h ALA 182 Ca 0.11 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.16 1req h ALA 182 Cb -0.03 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1req h ALA 182 CO -0.03 -0.55 0.51 1.49 0.00 0.00 0.00 179.25 180.66 1req h GLU 183 N -0.11 0.78 0.00 0.00 4.81 -1.04 0.57 114.58 119.59 1req h GLU 183 Ca 0.05 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1req h GLU 183 Cb 0.19 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1req h GLU 183 CO -0.13 0.52 0.00 0.39 -0.73 0.00 0.00 179.01 179.06 1req n GLU 184 N -4.74 0.12 0.01 1.92 1.02 -0.96 -0.33 120.64 117.68 1req n GLU 184 Ca 0.16 0.54 0.11 0.00 -0.02 0.00 0.00 57.16 57.95 1req n GLU 184 Cb 0.34 -1.82 0.09 0.00 -0.02 0.00 0.00 31.44 30.03 1req n GLU 184 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1req n GLN 185 N -2.06 0.11 -0.62 3.49 6.02 -0.67 -4.95 117.38 118.69 1req n GLN 185 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1req n GLN 185 Cb 0.08 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 29.80 1req n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1req n GLY 186 N 1.45 0.99 3.41 1.08 0.00 0.55 -5.03 105.19 107.64 1req n GLY 186 Ca 0.04 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 1req n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 187 N -2.00 3.84 0.70 1.61 1.01 0.11 -4.96 120.40 120.70 1req s VAL 187 Ca 0.00 -0.34 -0.11 0.00 0.00 0.00 0.00 61.98 61.53 1req s VAL 187 Cb 0.00 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1req s VAL 187 CO 0.00 0.42 1.08 -1.59 0.00 0.00 0.00 175.10 175.00 1req s LYS 188 N 1.18 2.79 0.40 2.72 0.00 -1.26 -2.69 119.74 122.88 1req s LYS 188 Ca 0.03 0.36 0.08 0.00 0.00 0.00 0.00 55.97 56.44 1req s LYS 188 Cb -0.14 -2.05 0.85 0.00 0.00 0.00 0.00 37.83 36.48 1req s LYS 188 CO 0.01 -1.03 2.00 -1.35 0.00 0.00 0.00 175.35 174.98 1req h PRO 189 N -0.62 0.59 0.00 1.78 0.11 -1.92 -3.08 132.00 128.87 1req h PRO 189 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1req h PRO 189 Cb 1.26 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1req h PRO 189 CO 0.63 0.39 0.00 -0.85 -0.21 0.00 0.00 178.00 177.96 1req n GLU 190 N -4.47 0.23 0.00 1.05 0.00 -1.08 -2.00 120.64 114.36 1req n GLU 190 Ca 0.07 0.35 0.13 0.00 0.00 0.00 0.00 57.16 57.72 1req n GLU 190 Cb 0.19 -1.86 0.48 0.00 0.00 0.00 0.00 31.44 30.25 1req n GLU 190 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1req n GLN 191 N -2.28 0.57 -2.74 3.44 6.02 -1.16 -4.36 117.38 116.87 1req n GLN 191 Ca 0.03 -0.26 -0.43 0.00 -0.01 0.00 0.00 57.00 56.34 1req n GLN 191 Cb 0.31 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.05 1req n GLN 191 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1req s LEU 192 N -2.61 3.93 -0.12 1.08 1.43 -0.85 -4.64 118.68 116.90 1req s LEU 192 Ca 0.23 0.64 -0.03 0.00 -1.03 0.00 0.00 54.13 53.94 1req s LEU 192 Cb 0.19 -3.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.02 1req s LEU 192 CO 0.53 -0.93 -0.01 0.00 0.23 0.00 0.00 176.35 176.17 1req s ALA 193 N 3.67 3.17 0.00 4.21 0.00 -1.26 -3.32 121.76 128.23 1req s ALA 193 Ca 0.41 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.56 1req s ALA 193 Cb -0.11 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.46 1req s ALA 193 CO 0.20 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.77 1req n GLY 194 N 2.85 -0.93 3.11 0.00 0.00 -1.24 -1.84 105.19 107.15 1req n GLY 194 Ca -0.18 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 1req n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1req s THR 195 N -3.00 -0.01 -0.07 2.61 2.01 -0.55 -0.40 115.64 116.23 1req s THR 195 Ca 0.00 0.03 0.05 0.00 0.31 0.00 0.00 61.69 62.08 1req s THR 195 Cb 0.00 -0.35 -0.01 0.00 0.01 0.00 0.00 72.50 72.15 1req s THR 195 CO 0.00 0.01 -0.22 -0.51 -0.69 0.00 0.00 174.62 173.21 1req s ILE 196 N 0.32 2.31 0.02 1.82 1.10 -0.93 -0.46 121.20 125.39 1req s ILE 196 Ca -0.02 -0.97 -0.25 0.00 -0.51 0.00 0.00 60.65 58.90 1req s ILE 196 Cb -0.03 -1.86 -0.17 0.00 0.15 0.00 0.00 42.46 40.54 1req s ILE 196 CO -0.01 0.57 1.40 -0.61 -2.11 0.00 0.00 174.94 174.17 1req h GLN 197 N 6.04 -0.21 -6.67 3.50 4.15 -1.35 -3.12 115.11 117.45 1req h GLN 197 Ca -0.33 0.01 -0.54 0.00 0.77 0.00 0.00 58.65 58.57 1req h GLN 197 Cb 1.18 0.05 -0.13 0.00 0.21 0.00 0.00 27.48 28.78 1req h GLN 197 CO 0.48 0.08 -0.88 -1.71 -1.93 0.00 0.00 178.83 174.87 1req n ASN 198 N -5.06 -1.20 -3.91 -0.69 4.05 -0.47 -0.40 115.26 107.58 1req n ASN 198 Ca -0.09 -1.05 -0.30 0.00 0.45 0.00 0.00 54.58 53.59 1req n ASN 198 Cb 0.21 -2.74 -0.15 0.00 1.23 0.00 0.00 39.78 38.33 1req n ASN 198 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1req s ASP 199 N -3.98 4.39 0.05 1.20 -1.08 -1.26 -4.76 116.67 111.23 1req s ASP 199 Ca 0.27 -2.23 0.14 0.00 -0.52 0.00 0.00 52.55 50.20 1req s ASP 199 Cb -0.15 -1.38 -0.16 0.00 -1.46 0.00 0.00 42.92 39.76 1req s ASP 199 CO 0.92 -0.35 0.88 -0.29 0.52 0.00 0.00 175.17 176.85 1req h ILE 200 N 6.24 0.83 -0.52 4.11 6.09 -1.90 -3.30 117.51 129.06 1req h ILE 200 Ca -0.07 -2.48 0.10 0.00 -1.37 0.00 0.00 64.86 61.04 1req h ILE 200 Cb 0.99 2.33 -0.09 0.00 0.47 0.00 0.00 36.82 40.52 1req h ILE 200 CO 0.53 0.47 -0.03 -0.07 -3.07 0.00 0.00 178.15 175.98 1req h LEU 201 N 0.00 -0.29 -1.38 2.19 3.38 -1.98 -0.54 115.31 116.68 1req h LEU 201 Ca -0.18 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1req h LEU 201 Cb 1.76 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 1req h LEU 201 CO 0.07 -0.10 -0.09 0.07 0.09 0.00 0.00 178.44 178.48 1req h LYS 202 N 0.08 0.00 -0.67 1.13 5.09 -1.91 -2.18 116.57 118.12 1req h LYS 202 Ca 0.26 0.00 0.02 0.00 0.09 0.00 0.00 60.65 61.03 1req h LYS 202 Cb 0.40 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 32.69 1req h LYS 202 CO -0.46 0.09 0.43 0.93 -2.09 0.00 0.00 179.45 178.34 1req h GLU 203 N 0.00 0.82 -0.32 0.07 4.39 -1.18 0.55 114.58 118.91 1req h GLU 203 Ca -0.00 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.49 1req h GLU 203 Cb 0.58 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1req h GLU 203 CO 0.01 0.54 -0.44 0.74 -1.16 0.00 0.00 179.01 178.70 1req h PHE 204 N 0.85 1.05 0.45 4.33 0.04 -1.23 0.13 116.94 122.56 1req h PHE 204 Ca 0.26 -0.35 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1req h PHE 204 Cb -0.01 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 37.93 1req h PHE 204 CO -0.04 1.16 -0.22 1.98 -0.60 0.00 0.00 178.31 180.59 1req h MET 205 N 0.64 -0.59 0.00 1.51 4.05 -1.34 -3.45 114.93 115.75 1req h MET 205 Ca 0.03 0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1req h MET 205 Cb 1.04 0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 1req h MET 205 CO 0.10 -0.28 -0.25 1.33 0.23 0.00 0.00 176.91 178.05 1req n VAL 206 N -5.23 0.00 0.02 -5.77 0.24 0.13 -4.58 118.33 103.14 1req n VAL 206 Ca -0.10 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.21 1req n VAL 206 Cb 0.30 -0.09 -0.09 0.00 -1.47 0.00 0.00 33.84 32.49 1req n VAL 206 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1req n ARG 207 N -0.66 0.63 -2.20 7.34 0.00 -0.84 -4.89 116.66 116.05 1req n ARG 207 Ca 0.00 0.13 -0.15 0.00 -0.00 0.00 0.00 57.85 57.84 1req n ARG 207 Cb 0.07 -1.74 -0.01 0.00 0.00 0.00 0.00 32.46 30.78 1req n ARG 207 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1req n ASN 208 N -2.77 -4.48 -1.00 6.15 3.02 0.43 -4.79 115.26 111.83 1req n ASN 208 Ca -0.11 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1req n ASN 208 Cb 0.81 -3.60 0.15 0.00 -0.61 0.00 0.00 39.78 36.54 1req n ASN 208 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1req n THR 209 N -3.88 2.04 -0.84 3.41 -2.24 -1.26 -4.77 114.28 106.74 1req n THR 209 Ca -0.17 -3.21 -0.29 0.00 -2.27 0.00 0.00 64.05 58.11 1req n THR 209 Cb 0.62 -0.25 0.20 0.00 -2.10 0.00 0.00 70.33 68.80 1req n THR 209 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1req s TYR 210 N -3.02 1.75 0.08 4.78 -0.85 -1.26 -3.44 117.35 115.39 1req s TYR 210 Ca 0.40 1.23 0.00 0.00 -0.52 0.00 0.00 57.07 58.18 1req s TYR 210 Cb 0.38 -3.18 0.00 0.00 0.38 0.00 0.00 41.96 39.54 1req s TYR 210 CO -0.06 -3.22 0.00 -0.89 -1.52 0.00 0.00 175.55 169.87 1req n ILE 211 N -4.45 0.33 -2.99 -3.49 5.41 -1.26 -4.85 119.36 108.06 1req n ILE 211 Ca 0.05 0.11 -0.25 0.00 1.00 0.00 0.00 62.75 63.66 1req n ILE 211 Cb 0.55 -0.86 -0.00 0.00 -0.71 0.00 0.00 39.64 38.62 1req n ILE 211 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1req s TYR 212 N -1.43 3.45 0.85 1.39 2.02 -1.26 -0.95 117.35 121.42 1req s TYR 212 Ca 0.00 0.50 -0.14 0.00 -0.37 0.00 0.00 57.07 57.06 1req s TYR 212 Cb 0.00 -2.16 0.02 0.00 -0.40 0.00 0.00 41.96 39.42 1req s TYR 212 CO 0.00 -0.16 0.58 -2.30 -1.57 0.00 0.00 175.55 172.10 1req n PRO 213 N -2.05 -0.03 -0.28 -1.71 -0.02 -1.26 -4.46 135.00 125.19 1req n PRO 213 Ca -0.01 0.05 0.10 0.00 -2.02 0.00 0.00 63.50 61.61 1req n PRO 213 Cb 0.56 -1.95 0.24 0.00 -0.02 0.00 0.00 33.50 32.34 1req n PRO 213 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1req h PRO 214 N -1.08 0.19 0.15 0.52 0.11 -1.97 -1.39 132.00 128.53 1req h PRO 214 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 1req h PRO 214 Cb 1.31 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1req h PRO 214 CO 0.39 0.13 -0.07 0.37 -0.21 0.00 0.00 178.00 178.60 1req h GLN 215 N 0.20 -0.19 -0.43 1.05 -0.00 -2.00 -0.14 115.11 113.59 1req h GLN 215 Ca 0.50 0.01 -0.07 0.00 -0.00 0.00 0.00 58.65 59.09 1req h GLN 215 Cb 0.96 0.04 -0.02 0.00 0.00 0.00 0.00 27.48 28.46 1req h GLN 215 CO -0.64 0.10 -0.02 -1.35 0.00 0.00 0.00 178.83 176.92 1req h PRO 216 N -0.49 0.72 -0.72 -2.39 0.10 -1.93 -1.39 132.00 125.91 1req h PRO 216 Ca -0.02 -0.19 -0.01 0.00 0.10 0.00 0.00 66.00 65.88 1req h PRO 216 Cb 0.38 -0.08 -0.03 0.00 0.10 0.00 0.00 31.00 31.36 1req h PRO 216 CO 0.03 0.75 0.41 0.77 0.10 0.00 0.00 178.00 180.06 1req h SER 217 N 0.67 0.88 -0.32 -2.05 0.02 -0.99 -0.96 113.55 110.80 1req h SER 217 Ca 0.13 -0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 1req h SER 217 Cb 0.45 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 1req h SER 217 CO 0.02 0.70 -0.05 0.24 -1.14 0.00 0.00 176.83 176.60 1req h MET 218 N 0.98 0.70 -0.55 3.45 2.86 -0.69 -2.22 114.93 119.46 1req h MET 218 Ca 0.26 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1req h MET 218 Cb 0.00 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 1req h MET 218 CO -0.04 0.75 0.29 -0.09 1.06 0.00 0.00 176.91 178.87 1req h ARG 219 N 0.65 0.79 -0.72 1.72 2.43 -0.95 0.23 114.38 118.52 1req h ARG 219 Ca 0.12 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1req h ARG 219 Cb 0.48 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1req h ARG 219 CO 0.02 0.62 0.47 0.82 -1.51 0.00 0.00 179.97 180.40 1req h ILE 220 N 0.75 1.14 -0.29 1.20 2.04 -0.80 -0.12 117.51 121.42 1req h ILE 220 Ca 0.19 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1req h ILE 220 Cb 0.08 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1req h ILE 220 CO -0.03 0.17 0.14 0.40 0.00 0.00 0.00 178.15 178.83 1req h ILE 221 N 0.93 1.15 -0.54 -0.67 2.04 -0.80 -1.60 117.51 118.02 1req h ILE 221 Ca 0.28 -0.44 -0.04 0.00 1.00 0.00 0.00 64.86 65.66 1req h ILE 221 Cb -0.04 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1req h ILE 221 CO -0.09 0.16 0.17 0.77 0.00 0.00 0.00 178.15 179.16 1req h SER 222 N 0.33 0.75 0.50 1.72 4.64 -0.60 -1.16 113.55 119.74 1req h SER 222 Ca 0.10 -0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 1req h SER 222 Cb 0.12 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1req h SER 222 CO -0.01 0.71 -0.51 -0.33 -0.87 0.00 0.00 176.83 175.81 1req h GLU 223 N 0.79 0.01 -0.26 4.77 5.08 -0.80 -0.24 114.58 123.93 1req h GLU 223 Ca 0.18 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 1req h GLU 223 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1req h GLU 223 CO -0.01 0.52 -0.28 0.82 -1.00 0.00 0.00 179.01 179.06 1req h ILE 224 N 0.01 1.31 -0.35 3.13 2.04 -0.26 -1.76 117.51 121.63 1req h ILE 224 Ca -0.00 -1.46 0.06 0.00 1.00 0.00 0.00 64.86 64.45 1req h ILE 224 Cb 0.91 1.66 -0.05 0.00 -0.74 0.00 0.00 36.82 38.60 1req h ILE 224 CO 0.07 0.46 0.03 -0.26 0.00 0.00 0.00 178.15 178.45 1req h PHE 225 N 0.36 0.05 -0.60 1.37 0.04 -0.80 -0.41 116.94 116.95 1req h PHE 225 Ca 0.04 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.84 1req h PHE 225 Cb 0.85 0.03 -0.03 0.00 2.20 0.00 0.00 35.95 39.00 1req h PHE 225 CO 0.08 -0.02 0.39 0.00 -0.60 0.00 0.00 178.31 178.16 1req h ALA 226 N 1.28 0.77 -0.19 2.45 0.00 -1.05 0.51 119.26 123.04 1req h ALA 226 Ca 0.17 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1req h ALA 226 Cb 0.21 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1req h ALA 226 CO -0.25 0.18 -0.10 -0.92 0.00 0.00 0.00 179.25 178.16 1req h TYR 227 N 0.80 0.46 -0.04 0.00 5.03 -1.16 -2.78 116.97 119.28 1req h TYR 227 Ca 0.22 -0.12 -0.19 0.00 2.58 0.00 0.00 58.73 61.23 1req h TYR 227 Cb -0.07 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.09 1req h TYR 227 CO -0.04 0.70 -0.78 1.79 -1.32 0.00 0.00 178.16 178.52 1req h THR 228 N 0.08 1.42 -0.71 1.81 1.35 -0.94 0.07 112.91 115.98 1req h THR 228 Ca 0.04 -2.31 0.07 0.00 -0.55 0.00 0.00 66.41 63.66 1req h THR 228 Cb 0.59 2.25 -0.05 0.00 -1.73 0.00 0.00 68.15 69.21 1req h THR 228 CO 0.03 0.68 0.47 -1.28 -0.25 0.00 0.00 175.52 175.17 1req h SER 229 N 0.19 0.61 0.19 5.36 0.87 -0.91 0.62 113.55 120.49 1req h SER 229 Ca -0.04 0.01 -0.34 0.00 -1.23 0.00 0.00 61.79 60.19 1req h SER 229 Cb 1.37 -0.12 0.01 0.00 -0.44 0.00 0.00 62.40 63.22 1req h SER 229 CO 0.13 0.39 -1.66 0.00 -0.53 0.00 0.00 176.83 175.15 1req h ALA 230 N 1.62 0.09 0.00 6.23 0.00 -1.28 -3.43 119.26 122.49 1req h ALA 230 Ca 0.31 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1req h ALA 230 Cb 0.33 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1req h ALA 230 CO -0.11 0.93 -0.45 0.09 0.00 0.00 0.00 179.25 179.71 1req n ASN 231 N -3.66 1.08 -3.22 0.00 3.02 -0.01 -4.93 115.26 107.54 1req n ASN 231 Ca -0.23 -0.47 -0.23 0.00 -0.03 0.00 0.00 54.58 53.62 1req n ASN 231 Cb 1.06 1.05 -0.07 0.00 -0.61 0.00 0.00 39.78 41.21 1req n ASN 231 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1req n MET 232 N -1.24 0.47 0.19 3.52 2.81 0.19 -2.65 117.12 120.40 1req n MET 232 Ca 0.00 -3.03 0.14 0.00 -1.81 0.00 0.00 57.70 53.01 1req n MET 232 Cb 0.09 -1.45 0.50 0.00 -0.71 0.00 0.00 33.22 31.65 1req n MET 232 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1req h PRO 233 N 4.80 0.00 -0.01 0.03 0.13 -1.80 -0.52 132.00 134.63 1req h PRO 233 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1req h PRO 233 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1req h PRO 233 CO 0.38 0.00 -0.28 1.63 -0.23 0.00 0.00 178.00 179.50 1req n LYS 234 N -2.64 0.87 -3.03 0.86 5.02 -1.26 -4.92 118.16 113.06 1req n LYS 234 Ca 0.02 -0.54 -0.41 0.00 -2.02 0.00 0.00 58.31 55.37 1req n LYS 234 Cb 0.33 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.80 1req n LYS 234 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1req s TRP 235 N -2.50 3.32 -0.21 2.13 -0.11 -0.21 -3.61 118.94 117.75 1req s TRP 235 Ca 0.24 0.97 -0.29 0.00 1.22 0.00 0.00 56.10 58.23 1req s TRP 235 Cb 0.19 -2.91 -0.01 0.00 -1.50 0.00 0.00 33.47 29.24 1req s TRP 235 CO 0.53 -0.31 1.30 -0.80 -4.62 0.00 0.00 176.95 173.05 1req s ASN 236 N 1.35 6.83 0.00 5.86 0.01 0.46 -4.83 114.94 124.62 1req s ASN 236 Ca 0.30 1.56 0.27 0.00 -0.71 0.00 0.00 52.86 54.28 1req s ASN 236 Cb -0.16 -2.54 0.80 0.00 0.41 0.00 0.00 41.25 39.77 1req s ASN 236 CO 0.09 -0.89 1.61 -1.54 -1.51 0.00 0.00 177.10 174.86 1req n SER 237 N 7.02 0.46 -3.53 -1.22 3.41 -0.32 -2.18 113.62 117.25 1req n SER 237 Ca 0.14 -0.23 -0.14 0.00 -0.26 0.00 0.00 58.87 58.39 1req n SER 237 Cb 0.45 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.38 1req n SER 237 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1req s ILE 238 N -2.85 0.00 -0.47 -1.33 2.07 -1.18 -4.69 121.20 112.74 1req s ILE 238 Ca 0.16 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.43 1req s ILE 238 Cb 0.18 -1.00 0.13 0.00 0.13 0.00 0.00 42.46 41.90 1req s ILE 238 CO 0.61 0.00 0.23 -0.55 -1.91 0.00 0.00 174.94 173.31 1req s SER 239 N -1.39 4.17 -0.39 4.50 0.15 0.46 -1.30 113.70 119.90 1req s SER 239 Ca -0.06 -2.79 -0.28 0.00 0.70 0.00 0.00 55.95 53.53 1req s SER 239 Cb -0.00 -1.45 -0.02 0.00 -1.71 0.00 0.00 66.02 62.84 1req s SER 239 CO 0.04 -0.26 1.81 -0.63 1.20 0.00 0.00 173.24 175.39 1req s ILE 240 N 0.05 3.46 -0.10 6.45 1.01 0.41 -4.64 121.20 127.84 1req s ILE 240 Ca 0.16 0.44 -0.02 0.00 0.00 0.00 0.00 60.65 61.23 1req s ILE 240 Cb -0.25 -3.71 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 1req s ILE 240 CO -0.01 -0.52 -0.02 -0.44 0.00 0.00 0.00 174.94 173.95 1req s SER 241 N 6.52 5.00 -0.08 3.58 0.01 -1.26 -1.35 113.70 126.11 1req s SER 241 Ca 0.77 0.03 0.09 0.00 1.31 0.00 0.00 55.95 58.15 1req s SER 241 Cb -0.20 -1.50 -0.13 0.00 0.21 0.00 0.00 66.02 64.39 1req s SER 241 CO 0.31 0.31 0.08 0.61 0.41 0.00 0.00 173.24 174.96 1req n GLY 242 N 2.59 -0.49 0.42 3.44 0.00 0.30 -4.70 105.19 106.74 1req n GLY 242 Ca -0.18 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 1req n GLY 242 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1req h TYR 243 N 0.00 -1.53 -0.68 1.61 3.20 -1.65 -0.90 116.97 117.01 1req h TYR 243 Ca -0.21 0.09 0.08 0.00 3.14 0.00 0.00 58.73 61.83 1req h TYR 243 Cb 1.38 0.76 -0.06 0.00 1.54 0.00 0.00 36.73 40.34 1req h TYR 243 CO 0.00 -0.43 0.36 0.45 -1.64 0.00 0.00 178.16 176.89 1req h HIS 244 N -0.22 0.64 -0.58 -3.82 -0.00 -1.88 0.07 115.15 109.36 1req h HIS 244 Ca 0.15 0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.57 1req h HIS 244 Cb 0.54 -0.19 -0.04 0.00 -0.00 0.00 0.00 27.41 27.73 1req h HIS 244 CO -0.79 0.27 0.36 0.52 -0.00 0.00 0.00 177.93 178.28 1req h MET 245 N 0.63 0.69 -0.28 2.45 2.86 -1.75 -1.53 114.93 118.00 1req h MET 245 Ca 0.32 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.84 1req h MET 245 Cb 0.28 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1req h MET 245 CO -0.23 0.45 -0.19 0.37 1.06 0.00 0.00 176.91 178.37 1req h GLN 246 N 0.71 0.50 0.00 1.72 4.15 -0.30 -0.47 115.11 121.41 1req h GLN 246 Ca 0.23 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 1req h GLN 246 Cb 0.01 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 1req h GLN 246 CO -0.10 0.68 -0.31 0.93 -1.93 0.00 0.00 178.83 178.10 1req h GLU 247 N 0.46 0.00 0.00 1.69 4.39 -0.72 -1.93 114.58 118.47 1req h GLU 247 Ca 0.07 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 1req h GLU 247 Cb 0.60 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1req h GLU 247 CO 0.04 0.31 -0.08 0.00 -1.16 0.00 0.00 179.01 178.11 1req h ALA 248 N 1.69 0.95 0.00 3.43 0.00 -1.14 -3.48 119.26 120.72 1req h ALA 248 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1req h ALA 248 Cb 0.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1req h ALA 248 CO 0.04 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1req n GLY 249 N 1.11 -0.53 3.77 0.00 0.00 -0.72 -4.61 105.19 104.19 1req n GLY 249 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1req n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 250 N -0.13 3.22 0.63 4.61 0.00 -0.22 -4.19 121.76 125.68 1req s ALA 250 Ca 0.00 1.37 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 1req s ALA 250 Cb 0.00 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 1req s ALA 250 CO 0.00 -1.06 1.03 0.95 0.00 0.00 0.00 175.76 176.68 1req s THR 251 N -1.23 4.46 0.25 0.00 -4.23 -1.26 -4.54 115.64 109.08 1req s THR 251 Ca 0.60 0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 61.82 1req s THR 251 Cb -0.41 -3.78 0.22 0.00 1.34 0.00 0.00 72.50 69.86 1req s THR 251 CO 0.53 -1.02 1.74 0.00 -0.54 0.00 0.00 174.62 175.33 1req h ALA 252 N -0.36 1.11 -0.73 3.99 0.00 -1.94 -1.24 119.26 120.08 1req h ALA 252 Ca -0.44 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1req h ALA 252 Cb 1.20 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1req h ALA 252 CO 0.62 -0.18 0.34 0.38 0.00 0.00 0.00 179.25 180.42 1req h ASP 253 N 0.49 0.96 -0.08 0.00 2.03 -1.94 -0.76 116.42 117.11 1req h ASP 253 Ca 0.42 -0.11 -0.21 0.00 -0.73 0.00 0.00 57.03 56.40 1req h ASP 253 Cb 0.62 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 38.89 1req h ASP 253 CO -0.39 0.81 -0.78 0.40 -1.03 0.00 0.00 179.24 178.26 1req h ILE 254 N 1.04 1.31 -0.16 4.15 1.08 -1.76 -2.20 117.51 120.97 1req h ILE 254 Ca 0.25 -2.03 0.05 0.00 -0.39 0.00 0.00 64.86 62.74 1req h ILE 254 Cb 0.12 2.20 -0.05 0.00 -3.07 0.00 0.00 36.82 36.02 1req h ILE 254 CO -0.03 0.63 -0.19 -0.08 -0.69 0.00 0.00 178.15 177.79 1req h GLU 255 N 0.35 -0.21 -0.10 2.37 4.81 -1.20 -0.47 114.58 120.12 1req h GLU 255 Ca -0.07 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1req h GLU 255 Cb 1.43 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.85 1req h GLU 255 CO 0.16 -0.14 0.05 0.52 -0.73 0.00 0.00 179.01 178.87 1req h MET 256 N -0.22 0.11 -0.27 1.92 2.86 -1.16 -2.49 114.93 115.68 1req h MET 256 Ca 0.11 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1req h MET 256 Cb 0.38 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1req h MET 256 CO -0.29 0.07 0.02 0.00 1.06 0.00 0.00 176.91 177.78 1req h ALA 257 N 1.05 0.37 -0.49 6.32 0.00 -0.77 -0.80 119.26 124.93 1req h ALA 257 Ca 0.04 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1req h ALA 257 Cb 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1req h ALA 257 CO -0.03 0.08 0.07 1.88 0.00 0.00 0.00 179.25 181.25 1req h TYR 258 N 0.27 0.87 -0.22 0.00 0.05 -1.20 0.29 116.97 117.02 1req h TYR 258 Ca 0.08 -0.12 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 1req h TYR 258 Cb 0.38 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 1req h TYR 258 CO 0.03 0.80 0.03 1.15 -1.05 0.00 0.00 178.16 179.11 1req h THR 259 N 0.68 1.23 -0.51 -2.88 2.02 -1.33 0.35 112.91 112.48 1req h THR 259 Ca 0.15 -0.79 -0.11 0.00 0.77 0.00 0.00 66.41 66.43 1req h THR 259 Cb 0.41 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 1req h THR 259 CO 0.01 0.25 -0.11 -0.07 0.37 0.00 0.00 175.52 175.97 1req h LEU 260 N 0.16 0.97 -0.60 2.58 3.38 -1.01 -0.91 115.31 119.88 1req h LEU 260 Ca 0.07 -0.35 -0.14 0.00 0.09 0.00 0.00 57.88 57.54 1req h LEU 260 Cb 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1req h LEU 260 CO 0.01 1.10 -0.45 0.00 0.09 0.00 0.00 178.44 179.19 1req h ALA 261 N 0.90 0.77 -0.39 1.53 0.00 -0.35 -0.81 119.26 120.93 1req h ALA 261 Ca 0.13 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.62 1req h ALA 261 Cb 0.67 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1req h ALA 261 CO 0.05 0.66 0.13 -0.44 0.00 0.00 0.00 179.25 179.65 1req h ASP 262 N 0.48 0.13 -0.99 0.00 3.32 -0.02 -1.54 116.42 117.81 1req h ASP 262 Ca 0.03 0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.22 1req h ASP 262 Cb 0.97 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 40.48 1req h ASP 262 CO 0.09 0.11 0.63 1.23 -1.72 0.00 0.00 179.24 179.58 1req h GLY 263 N 0.28 1.55 0.80 2.75 0.00 -0.19 -1.31 103.07 106.96 1req h GLY 263 Ca 0.18 -0.44 0.05 0.00 0.00 0.00 0.00 47.33 47.12 1req h GLY 263 CO -0.19 0.25 0.62 -2.08 0.00 0.00 0.00 176.54 175.14 1req h VAL 264 N 1.07 1.12 -0.75 4.60 2.07 -0.18 0.73 116.25 124.90 1req h VAL 264 Ca 0.45 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 1req h VAL 264 Cb 0.31 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 29.91 1req h VAL 264 CO -0.21 0.21 0.28 0.44 0.02 0.00 0.00 177.57 178.30 1req h ASP 265 N 1.16 1.06 -0.59 0.57 5.19 -0.89 -1.48 116.42 121.43 1req h ASP 265 Ca 0.40 -0.19 -0.08 0.00 -0.62 0.00 0.00 57.03 56.54 1req h ASP 265 Cb 0.09 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.30 1req h ASP 265 CO -0.15 0.96 0.07 1.88 -3.12 0.00 0.00 179.24 178.88 1req h TYR 266 N 1.10 1.09 -0.38 4.55 0.05 -0.77 0.19 116.97 122.80 1req h TYR 266 Ca 0.25 -0.15 -0.06 0.00 0.05 0.00 0.00 58.73 58.82 1req h TYR 266 Cb 0.25 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 1req h TYR 266 CO 0.02 0.93 0.02 0.82 -1.05 0.00 0.00 178.16 178.90 1req h ILE 267 N 0.96 1.25 -0.30 -2.88 2.04 -0.05 -1.78 117.51 116.76 1req h ILE 267 Ca 0.19 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 65.11 1req h ILE 267 Cb 0.45 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1req h ILE 267 CO 0.02 0.32 0.20 0.03 0.00 0.00 0.00 178.15 178.72 1req h ARG 268 N 0.50 0.28 -0.43 2.37 3.08 -1.14 -0.02 114.38 119.02 1req h ARG 268 Ca 0.11 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1req h ARG 268 Cb 0.44 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1req h ARG 268 CO 0.02 0.18 0.24 0.00 -1.07 0.00 0.00 179.97 179.34 1req h ALA 269 N 1.83 0.55 -0.34 0.04 0.00 -0.73 -0.15 119.26 120.48 1req h ALA 269 Ca 0.12 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1req h ALA 269 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1req h ALA 269 CO -0.03 0.07 -0.26 0.78 0.00 0.00 0.00 179.25 179.82 1req h GLY 270 N 0.56 0.74 0.99 0.00 0.00 -0.28 -2.91 103.07 102.17 1req h GLY 270 Ca 0.15 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 1req h GLY 270 CO -0.02 0.59 0.00 0.83 0.00 0.00 0.00 176.54 177.93 1req h GLU 271 N 0.59 0.82 -0.08 4.80 5.08 -0.77 -2.71 114.58 122.31 1req h GLU 271 Ca 0.08 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1req h GLU 271 Cb 0.75 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1req h GLU 271 CO 0.06 0.87 0.24 0.66 -1.00 0.00 0.00 179.01 179.84 1req h SER 272 N 0.67 0.00 -0.58 1.42 4.64 -0.82 0.11 113.55 118.99 1req h SER 272 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1req h SER 272 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1req h SER 272 CO 0.02 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.31 1req n VAL 273 N -3.21 1.81 0.00 0.95 0.24 -1.06 -4.94 118.33 112.12 1req n VAL 273 Ca -0.01 -1.25 0.00 0.00 -2.04 0.00 0.00 64.34 61.04 1req n VAL 273 Cb 0.32 0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1req n VAL 273 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1req n GLY 274 N 0.90 0.37 3.77 7.63 0.00 0.37 -4.93 105.19 113.32 1req n GLY 274 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1req n GLY 274 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1req s LEU 275 N 0.00 4.53 0.59 0.99 1.43 -1.05 -5.01 118.68 120.16 1req s LEU 275 Ca 0.00 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.75 1req s LEU 275 Cb 0.00 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.56 1req s LEU 275 CO 0.00 0.11 1.02 0.21 0.23 0.00 0.00 176.35 177.92 1req s ASN 276 N -1.32 6.17 0.29 2.29 3.84 -1.26 -3.83 114.94 121.12 1req s ASN 276 Ca 0.42 1.58 -0.01 0.00 0.21 0.00 0.00 52.86 55.06 1req s ASN 276 Cb -0.23 -2.50 0.47 0.00 -0.55 0.00 0.00 41.25 38.45 1req s ASN 276 CO 0.27 -0.90 1.92 1.62 -2.79 0.00 0.00 177.10 177.22 1req h VAL 277 N 0.22 1.11 0.00 -5.21 3.04 -1.95 -0.23 116.25 113.23 1req h VAL 277 Ca -0.46 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 64.86 1req h VAL 277 Cb 1.20 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 1req h VAL 277 CO 0.60 0.20 0.00 0.47 -1.01 0.00 0.00 177.57 177.83 1req n ASP 278 N -4.47 0.52 0.09 3.17 8.00 -1.26 -0.71 116.55 121.89 1req n ASP 278 Ca 0.13 0.62 0.12 0.00 0.71 0.00 0.00 54.79 56.38 1req n ASP 278 Cb 0.16 -0.74 0.45 0.00 -0.02 0.00 0.00 41.12 40.97 1req n ASP 278 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1req n GLN 279 N -2.07 0.19 0.00 -1.24 6.02 -0.10 -4.53 117.38 115.65 1req n GLN 279 Ca 0.03 0.24 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1req n GLN 279 Cb 0.23 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.73 1req n GLN 279 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 177.06 178.02 1req n PHE 280 N -2.10 0.00 -0.14 1.08 -1.74 -1.03 -4.66 117.46 108.87 1req n PHE 280 Ca 0.05 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 56.93 1req n PHE 280 Cb 0.35 0.00 0.24 0.00 1.52 0.00 0.00 39.48 41.59 1req n PHE 280 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1req h ALA 281 N 0.00 1.37 0.00 1.98 0.00 -1.15 -2.12 119.26 119.33 1req h ALA 281 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1req h ALA 281 Cb 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1req h ALA 281 CO 0.00 0.49 -0.10 -1.35 0.00 0.00 0.00 179.25 178.30 1req h PRO 282 N 0.84 0.00 -0.58 0.00 0.11 -1.80 -2.68 132.00 127.89 1req h PRO 282 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1req h PRO 282 Cb 0.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1req h PRO 282 CO -0.03 0.10 0.00 0.54 -0.21 0.00 0.00 178.00 178.40 1req n ARG 283 N -4.08 2.53 -3.02 1.05 5.12 -0.81 -4.93 116.66 112.52 1req n ARG 283 Ca -0.03 -1.60 -0.40 0.00 -1.93 0.00 0.00 57.85 53.90 1req n ARG 283 Cb 0.18 -1.61 -0.05 0.00 -1.16 0.00 0.00 32.46 29.82 1req n ARG 283 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1req s LEU 284 N -1.25 4.47 0.09 0.55 1.43 -1.01 -1.18 118.68 121.78 1req s LEU 284 Ca 0.29 1.43 0.02 0.00 -1.03 0.00 0.00 54.13 54.84 1req s LEU 284 Cb 0.18 -3.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 1req s LEU 284 CO 0.14 0.07 -0.07 -0.94 0.23 0.00 0.00 176.35 175.77 1req s SER 285 N -0.29 1.12 0.50 2.29 1.04 -0.42 -4.66 113.70 113.29 1req s SER 285 Ca 0.37 -0.87 0.07 0.00 0.48 0.00 0.00 55.95 56.00 1req s SER 285 Cb -0.21 0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.00 1req s SER 285 CO 0.23 -0.37 0.43 -0.36 0.98 0.00 0.00 173.24 174.14 1req s PHE 286 N -2.91 2.03 -0.25 5.02 0.40 0.50 -0.45 117.98 122.32 1req s PHE 286 Ca 0.06 -0.69 -0.04 0.00 -0.60 0.00 0.00 56.93 55.66 1req s PHE 286 Cb 0.00 -2.04 0.14 0.00 0.51 0.00 0.00 43.02 41.63 1req s PHE 286 CO -0.03 -0.40 0.47 0.12 0.70 0.00 0.00 175.22 176.09 1req s PHE 287 N -2.65 -1.08 0.21 0.36 5.36 -0.46 -0.84 117.98 118.89 1req s PHE 287 Ca 0.43 1.36 0.06 0.00 -0.96 0.00 0.00 56.93 57.82 1req s PHE 287 Cb -0.03 0.30 -0.04 0.00 -0.34 0.00 0.00 43.02 42.92 1req s PHE 287 CO 0.26 -0.71 0.14 -1.58 -1.46 0.00 0.00 175.22 171.87 1req s TRP 288 N 2.68 3.07 0.12 10.12 0.23 -0.27 -0.54 118.94 134.35 1req s TRP 288 Ca 0.10 -0.08 -0.02 0.00 -2.03 0.00 0.00 56.10 54.07 1req s TRP 288 Cb -0.14 -1.43 -0.05 0.00 0.03 0.00 0.00 33.47 31.88 1req s TRP 288 CO -0.17 0.53 0.31 0.20 0.96 0.00 0.00 176.95 178.78 1req s GLY 289 N -3.43 2.11 -0.33 0.98 0.00 -1.26 -1.97 107.32 103.41 1req s GLY 289 Ca 0.31 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 44.29 1req s GLY 289 CO 0.23 -0.70 0.12 -0.42 0.00 0.00 0.00 173.10 172.33 1req s ILE 290 N -1.64 1.10 0.00 0.90 -1.09 -0.31 -4.87 121.20 115.29 1req s ILE 290 Ca 0.38 -1.69 0.00 0.00 -2.23 0.00 0.00 60.65 57.11 1req s ILE 290 Cb -0.12 -1.82 0.00 0.00 -1.58 0.00 0.00 42.46 38.94 1req s ILE 290 CO 0.27 -0.71 0.00 0.61 -1.23 0.00 0.00 174.94 173.88 1req n GLY 291 N 4.57 0.71 0.16 6.18 0.00 -1.26 -0.50 105.19 115.05 1req n GLY 291 Ca 0.00 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.27 1req n GLY 291 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1req n MET 292 N -0.33 0.60 -2.69 1.61 2.81 -1.26 -4.49 117.12 113.38 1req n MET 292 Ca 0.00 -0.33 -0.43 0.00 -1.81 0.00 0.00 57.70 55.13 1req n MET 292 Cb 0.00 -1.49 -0.00 0.00 -0.71 0.00 0.00 33.22 31.01 1req n MET 292 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1req s ASN 293 N -2.63 6.86 0.16 7.83 3.84 -1.26 -4.87 114.94 124.87 1req s ASN 293 Ca 0.22 -2.48 -0.26 0.00 0.21 0.00 0.00 52.86 50.54 1req s ASN 293 Cb 0.19 -2.53 0.02 0.00 -0.55 0.00 0.00 41.25 38.38 1req s ASN 293 CO 0.56 -1.09 1.57 0.15 -2.79 0.00 0.00 177.10 175.50 1req h PHE 294 N 7.72 -1.25 0.00 0.43 3.04 -1.93 -1.54 116.94 123.41 1req h PHE 294 Ca 0.38 0.07 -0.12 0.00 3.98 0.00 0.00 57.97 62.28 1req h PHE 294 Cb 0.89 0.61 -0.02 0.00 2.56 0.00 0.00 35.95 40.00 1req h PHE 294 CO 1.32 -0.43 -0.57 0.74 -2.02 0.00 0.00 178.31 177.35 1req h PHE 295 N -0.28 0.00 -0.63 0.41 0.04 -1.97 -2.59 116.94 111.92 1req h PHE 295 Ca 0.16 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.93 1req h PHE 295 Cb 0.57 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.69 1req h PHE 295 CO -0.66 0.57 0.40 1.98 -0.60 0.00 0.00 178.31 180.01 1req h MET 296 N 0.00 0.83 -0.58 1.51 4.05 -1.78 -2.39 114.93 116.57 1req h MET 296 Ca -0.01 -0.06 -0.10 0.00 -0.28 0.00 0.00 59.70 59.26 1req h MET 296 Cb 1.17 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.77 1req h MET 296 CO 0.07 0.57 -0.02 0.93 0.23 0.00 0.00 176.91 178.69 1req h GLU 297 N 0.85 1.01 -0.54 0.39 4.39 -1.19 0.13 114.58 119.63 1req h GLU 297 Ca 0.23 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1req h GLU 297 Cb -0.08 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 1req h GLU 297 CO -0.05 1.00 0.34 0.28 -1.16 0.00 0.00 179.01 179.42 1req h VAL 298 N 0.92 1.15 -0.58 3.13 2.07 -1.37 -2.59 116.25 118.98 1req h VAL 298 Ca 0.16 -0.32 -0.11 0.00 0.82 0.00 0.00 66.70 67.26 1req h VAL 298 Cb 0.56 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1req h VAL 298 CO 0.03 0.15 -0.05 0.00 0.02 0.00 0.00 177.57 177.73 1req h ALA 299 N 1.18 0.79 -0.41 1.67 0.00 -1.01 -2.74 119.26 118.74 1req h ALA 299 Ca 0.20 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1req h ALA 299 Cb -0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.47 1req h ALA 299 CO -0.04 0.67 0.07 -0.22 0.00 0.00 0.00 179.25 179.73 1req h LYS 300 N 0.95 0.19 -0.40 0.00 3.64 -0.48 0.50 116.57 120.96 1req h LYS 300 Ca 0.16 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1req h LYS 300 Cb 0.61 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1req h LYS 300 CO 0.04 0.12 0.18 -0.07 -2.27 0.00 0.00 179.45 177.45 1req h LEU 301 N 0.19 0.54 -0.30 5.20 4.07 -1.40 0.17 115.31 123.78 1req h LEU 301 Ca 0.20 -0.15 -0.20 0.00 0.08 0.00 0.00 57.88 57.82 1req h LEU 301 Cb 0.25 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1req h LEU 301 CO -0.28 0.54 -0.67 0.03 -1.08 0.00 0.00 178.44 176.98 1req h ARG 302 N 0.51 0.71 -0.17 1.13 3.08 -1.09 -2.89 114.38 115.65 1req h ARG 302 Ca 0.14 -0.52 -0.15 0.00 0.07 0.00 0.00 59.98 59.51 1req h ARG 302 Cb 0.15 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1req h ARG 302 CO -0.01 1.14 -0.54 0.00 -1.07 0.00 0.00 179.97 179.49 1req h ALA 303 N 0.73 0.74 -0.76 0.04 0.00 0.18 -3.02 119.26 117.17 1req h ALA 303 Ca -0.02 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1req h ALA 303 Cb 1.27 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 1req h ALA 303 CO 0.13 0.69 0.42 0.00 0.00 0.00 0.00 179.25 180.50 1req h ALA 304 N 1.02 0.97 -0.47 0.00 0.00 -0.73 0.52 119.26 120.57 1req h ALA 304 Ca 0.01 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1req h ALA 304 Cb 1.07 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1req h ALA 304 CO 0.10 0.48 0.22 0.00 0.00 0.00 0.00 179.25 180.05 1req h ARG 305 N 1.05 0.43 -0.61 0.00 3.08 -1.38 0.22 114.38 117.17 1req h ARG 305 Ca 0.27 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.22 1req h ARG 305 Cb 0.02 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1req h ARG 305 CO -0.04 0.28 0.07 0.52 -1.07 0.00 0.00 179.97 179.73 1req h MET 306 N 0.44 1.01 -0.44 0.04 2.86 -1.39 -2.04 114.93 115.41 1req h MET 306 Ca 0.21 -0.27 -0.10 0.00 -2.06 0.00 0.00 59.70 57.48 1req h MET 306 Cb 0.14 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1req h MET 306 CO -0.16 0.94 -0.14 -0.07 1.06 0.00 0.00 176.91 178.54 1req h LEU 307 N 0.94 0.81 -0.56 1.22 3.38 -0.41 -1.84 115.31 118.85 1req h LEU 307 Ca 0.18 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1req h LEU 307 Cb 0.44 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1req h LEU 307 CO 0.02 0.96 0.30 -0.25 0.09 0.00 0.00 178.44 179.56 1req h TRP 308 N 0.73 0.77 -0.36 1.13 2.91 -0.89 -2.01 115.95 118.22 1req h TRP 308 Ca 0.11 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.10 1req h TRP 308 Cb 0.65 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 29.04 1req h TRP 308 CO 0.03 0.57 0.16 0.00 -1.03 0.00 0.00 178.44 178.17 1req h ALA 309 N 1.13 0.47 -0.48 2.65 0.00 -1.02 -0.22 119.26 121.79 1req h ALA 309 Ca 0.20 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1req h ALA 309 Cb 0.06 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 1req h ALA 309 CO -0.03 0.06 0.03 -0.22 0.00 0.00 0.00 179.25 179.09 1req h LYS 310 N 0.44 0.15 -0.23 0.00 3.64 -1.15 -0.57 116.57 118.84 1req h LYS 310 Ca 0.12 -0.01 -0.20 0.00 -1.27 0.00 0.00 60.65 59.30 1req h LYS 310 Cb 0.16 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1req h LYS 310 CO -0.01 0.10 -0.62 -0.07 -2.27 0.00 0.00 179.45 176.57 1req h LEU 311 N 0.15 0.92 -0.57 5.20 3.38 -1.16 -2.97 115.31 120.27 1req h LEU 311 Ca 0.24 -0.53 -0.16 0.00 0.09 0.00 0.00 57.88 57.53 1req h LEU 311 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1req h LEU 311 CO -0.37 1.32 -0.57 0.58 0.09 0.00 0.00 178.44 179.49 1req h VAL 312 N 0.60 1.34 -0.76 1.22 2.07 -0.98 -2.80 116.25 116.94 1req h VAL 312 Ca -0.01 -1.85 0.17 0.00 0.82 0.00 0.00 66.70 65.83 1req h VAL 312 Cb 1.23 1.85 -0.05 0.00 -1.52 0.00 0.00 31.29 32.80 1req h VAL 312 CO 0.13 0.57 0.52 -0.74 0.02 0.00 0.00 177.57 178.06 1req h HIS 313 N 0.34 0.40 -0.23 1.57 6.17 -0.93 -1.91 115.15 120.57 1req h HIS 313 Ca 0.00 0.01 0.07 0.00 0.71 0.00 0.00 60.37 61.16 1req h HIS 313 Cb 1.10 -0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.89 1req h HIS 313 CO 0.04 0.14 0.17 1.96 0.71 0.00 0.00 177.93 180.95 1req h GLN 314 N 0.33 0.00 -0.00 5.26 4.20 -1.51 -0.44 115.11 122.95 1req h GLN 314 Ca 0.38 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.09 1req h GLN 314 Cb 0.99 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.77 1req h GLN 314 CO -0.11 0.00 -0.02 1.19 -0.67 0.00 0.00 178.83 179.23 1req n PHE 315 N -4.38 0.00 -3.28 2.96 3.72 -0.72 -4.97 117.46 110.79 1req n PHE 315 Ca 0.02 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.28 1req n PHE 315 Cb 0.32 -0.21 0.05 0.00 -0.94 0.00 0.00 39.48 38.70 1req n PHE 315 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1req n GLY 316 N 1.22 -1.16 3.76 1.37 0.00 -0.18 -4.89 105.19 105.31 1req n GLY 316 Ca 0.16 0.55 -0.39 0.00 0.00 0.00 0.00 46.02 46.34 1req n GLY 316 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1req s PRO 317 N -4.32 3.76 -0.00 1.61 0.04 -1.26 -4.92 135.00 129.90 1req s PRO 317 Ca 0.36 2.12 0.22 0.00 0.04 0.00 0.00 61.00 63.73 1req s PRO 317 Cb -0.06 -2.59 -0.27 0.00 0.04 0.00 0.00 34.50 31.61 1req s PRO 317 CO 0.76 -0.65 0.63 1.63 0.04 0.00 0.00 177.00 179.40 1req n LYS 318 N -0.22 0.51 -3.49 4.56 4.76 -1.26 -4.79 118.16 118.23 1req n LYS 318 Ca 0.06 -0.13 -0.38 0.00 -2.87 0.00 0.00 58.31 54.98 1req n LYS 318 Cb 0.44 -1.54 -0.09 0.00 -1.84 0.00 0.00 35.03 32.00 1req n LYS 318 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1req s ASN 319 N -4.26 6.20 0.50 4.39 3.84 -1.26 -4.98 114.94 119.38 1req s ASN 319 Ca -0.04 0.22 0.33 0.00 0.21 0.00 0.00 52.86 53.58 1req s ASN 319 Cb 0.14 -2.17 1.47 0.00 -0.55 0.00 0.00 41.25 40.14 1req s ASN 319 CO 0.89 -0.09 1.98 1.55 -2.79 0.00 0.00 177.10 178.64 1req h PRO 320 N 7.95 0.00 0.00 0.43 0.13 -2.02 -1.30 132.00 137.20 1req h PRO 320 Ca -0.34 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.77 1req h PRO 320 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1req h PRO 320 CO 0.64 0.00 -0.07 0.87 -0.23 0.00 0.00 178.00 179.20 1req h LYS 321 N 0.00 0.00 -0.99 0.86 1.57 -1.96 -2.55 116.57 113.50 1req h LYS 321 Ca 0.00 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.91 1req h LYS 321 Cb 0.37 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.59 1req h LYS 321 CO 0.00 0.07 0.63 0.77 -0.57 0.00 0.00 179.45 180.35 1req h SER 322 N 0.00 0.89 -0.03 0.86 0.02 -1.51 -2.56 113.55 111.22 1req h SER 322 Ca -0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1req h SER 322 Cb 0.41 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1req h SER 322 CO 0.01 0.46 0.00 0.23 -1.14 0.00 0.00 176.83 176.39 1req n MET 323 N -4.62 1.32 -3.60 3.45 2.81 -0.96 -4.60 117.12 110.93 1req n MET 323 Ca 0.19 -0.48 -0.37 0.00 -1.81 0.00 0.00 57.70 55.24 1req n MET 323 Cb 0.38 -1.44 -0.07 0.00 -0.71 0.00 0.00 33.22 31.38 1req n MET 323 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1req s SER 324 N -1.85 6.47 -0.54 7.83 1.04 -0.96 -3.73 113.70 121.95 1req s SER 324 Ca 0.39 0.55 -0.22 0.00 0.48 0.00 0.00 55.95 57.15 1req s SER 324 Cb 0.19 -2.17 0.05 0.00 0.10 0.00 0.00 66.02 64.19 1req s SER 324 CO 0.31 0.19 0.81 -0.22 0.98 0.00 0.00 173.24 175.31 1req s LEU 325 N -0.02 4.50 -0.20 2.42 0.20 -1.26 -4.99 118.68 119.32 1req s LEU 325 Ca 0.17 -0.63 -0.10 0.00 0.69 0.00 0.00 54.13 54.26 1req s LEU 325 Cb -0.13 -2.64 -0.05 0.00 -0.43 0.00 0.00 46.19 42.94 1req s LEU 325 CO 0.05 -1.09 0.12 -0.13 -0.29 0.00 0.00 176.35 175.00 1req s ARG 326 N 3.38 4.14 0.01 1.98 0.52 -1.26 -4.71 118.95 123.01 1req s ARG 326 Ca 0.23 -0.24 0.00 0.00 -0.52 0.00 0.00 55.73 55.21 1req s ARG 326 Cb -0.16 -3.38 -0.01 0.00 0.52 0.00 0.00 34.95 31.92 1req s ARG 326 CO 0.16 0.30 -0.02 -0.08 0.02 0.00 0.00 175.30 175.68 1req s THR 327 N 0.34 0.12 0.46 0.02 -1.32 -1.26 -0.37 115.64 113.63 1req s THR 327 Ca 0.07 -0.42 -0.05 0.00 -1.21 0.00 0.00 61.69 60.08 1req s THR 327 Cb -0.11 -0.18 -0.04 0.00 -1.51 0.00 0.00 72.50 70.66 1req s THR 327 CO -0.02 -0.19 0.75 -2.28 -2.21 0.00 0.00 174.62 170.67 1req s HIS 328 N -0.63 3.55 0.03 9.09 2.46 -0.02 0.32 115.29 130.09 1req s HIS 328 Ca -0.06 0.75 -0.02 0.00 0.47 0.00 0.00 55.06 56.20 1req s HIS 328 Cb -0.04 -2.25 -0.02 0.00 -0.13 0.00 0.00 32.58 30.14 1req s HIS 328 CO -0.00 -0.21 0.02 -1.12 -2.47 0.00 0.00 174.74 170.96 1req s SER 329 N -4.05 0.25 -0.02 9.88 0.01 -0.64 -1.11 113.70 118.02 1req s SER 329 Ca 0.46 -0.58 0.01 0.00 1.31 0.00 0.00 55.95 57.15 1req s SER 329 Cb -0.10 0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.31 1req s SER 329 CO 0.43 -0.42 -0.02 -1.58 0.41 0.00 0.00 173.24 172.06 1req s GLN 330 N -2.25 0.39 0.74 12.44 0.74 -0.83 -1.18 119.66 129.71 1req s GLN 330 Ca -0.08 -0.02 -0.14 0.00 0.05 0.00 0.00 55.36 55.17 1req s GLN 330 Cb -0.04 -0.48 0.05 0.00 1.10 0.00 0.00 33.01 33.64 1req s GLN 330 CO -0.03 -0.06 1.15 0.95 -0.55 0.00 0.00 175.29 176.75 1req s THR 331 N 0.64 2.67 -0.37 -0.34 -4.23 -0.79 -1.16 115.64 112.05 1req s THR 331 Ca -0.07 0.29 -0.29 0.00 -1.18 0.00 0.00 61.69 60.44 1req s THR 331 Cb -0.10 -2.75 0.02 0.00 1.34 0.00 0.00 72.50 71.01 1req s THR 331 CO -0.01 -0.21 1.20 -0.55 -0.54 0.00 0.00 174.62 174.51 1req s SER 332 N -2.47 6.69 0.20 3.99 0.15 0.34 -4.72 113.70 117.88 1req s SER 332 Ca 0.69 0.89 -0.09 0.00 0.70 0.00 0.00 55.95 58.14 1req s SER 332 Cb -0.24 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 61.64 1req s SER 332 CO 0.48 -1.13 1.71 1.23 1.20 0.00 0.00 173.24 176.73 1req h GLY 333 N 10.94 1.22 0.37 9.45 0.00 -1.91 -3.05 103.07 120.09 1req h GLY 333 Ca -0.24 -0.77 0.13 0.00 0.00 0.00 0.00 47.33 46.46 1req h GLY 333 CO 1.07 0.71 0.56 -0.25 0.00 0.00 0.00 176.54 178.64 1req h TRP 334 N 1.07 1.01 -0.00 5.60 7.01 -1.91 -2.33 115.95 126.40 1req h TRP 334 Ca 0.22 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.25 1req h TRP 334 Cb 0.38 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 27.13 1req h TRP 334 CO 0.03 0.34 0.06 0.66 -2.79 0.00 0.00 178.44 176.74 1req h SER 335 N 0.85 0.00 -3.22 2.65 4.64 -1.95 -3.44 113.55 113.08 1req h SER 335 Ca 0.49 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.24 1req h SER 335 Cb 0.57 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.62 1req h SER 335 CO -0.30 0.00 -0.16 -0.76 -0.87 0.00 0.00 176.83 174.73 1req s LEU 336 N -6.10 4.34 0.30 5.97 1.43 -0.88 -5.04 118.68 118.70 1req s LEU 336 Ca -0.05 0.93 0.09 0.00 -1.03 0.00 0.00 54.13 54.07 1req s LEU 336 Cb 0.12 -3.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 1req s LEU 336 CO 0.39 0.13 0.10 0.42 0.23 0.00 0.00 176.35 177.62 1req s THR 337 N -1.44 3.45 -1.38 5.49 -4.23 -1.26 -4.73 115.64 111.54 1req s THR 337 Ca 0.36 -1.71 0.26 0.00 -1.18 0.00 0.00 61.69 59.41 1req s THR 337 Cb -0.14 -3.01 0.13 0.00 1.34 0.00 0.00 72.50 70.82 1req s THR 337 CO 0.19 -0.28 1.47 0.00 -0.54 0.00 0.00 174.62 175.45 1req n ALA 338 N -1.07 3.36 -2.65 3.99 0.00 -1.26 -4.50 120.51 118.38 1req n ALA 338 Ca -0.05 -0.39 -0.35 0.00 0.00 0.00 0.00 53.44 52.66 1req n ALA 338 Cb 0.60 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.83 1req n ALA 338 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1req s GLN 339 N -2.75 2.91 -0.86 0.00 1.11 -1.26 -4.68 119.66 114.12 1req s GLN 339 Ca 0.17 -0.46 -0.04 0.00 0.01 0.00 0.00 55.36 55.04 1req s GLN 339 Cb 0.18 -2.72 0.00 0.00 -1.01 0.00 0.00 33.01 29.46 1req s GLN 339 CO 0.62 0.68 0.65 -3.47 0.01 0.00 0.00 175.29 173.78 1req n ASP 340 N 2.19 -5.62 0.24 5.90 2.03 -1.26 -4.86 116.55 115.17 1req n ASP 340 Ca -0.18 -0.76 0.15 0.00 0.52 0.00 0.00 54.79 54.52 1req n ASP 340 Cb 0.53 -2.78 0.55 0.00 -0.72 0.00 0.00 41.12 38.70 1req n ASP 340 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1req h VAL 341 N -0.40 0.00 0.00 5.18 -1.51 -1.83 -2.66 116.25 115.02 1req h VAL 341 Ca -0.48 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.43 1req h VAL 341 Cb 1.29 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.97 1req h VAL 341 CO 0.37 0.00 0.00 1.88 -1.23 0.00 0.00 177.57 178.59 1req h TYR 342 N 0.00 0.00 0.00 5.19 -1.99 -1.89 -1.53 116.97 116.76 1req h TYR 342 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1req h TYR 342 Cb 0.59 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.32 1req h TYR 342 CO 0.00 0.00 -0.09 -0.91 -0.00 0.00 0.00 178.16 177.16 1req h ASN 343 N 0.00 0.00 -0.02 3.88 2.35 -1.83 -2.48 115.58 117.48 1req h ASN 343 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1req h ASN 343 Cb 0.43 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1req h ASN 343 CO 0.00 0.09 -0.02 0.78 -1.65 0.00 0.00 177.43 176.63 1req h ASN 344 N 0.00 0.11 -0.39 5.81 2.35 -1.48 -2.06 115.58 119.91 1req h ASN 344 Ca -0.00 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1req h ASN 344 Cb 0.33 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.64 1req h ASN 344 CO 0.01 0.15 0.18 0.58 -1.65 0.00 0.00 177.43 176.70 1req h VAL 345 N 0.12 0.95 -0.33 2.81 2.07 -1.60 0.05 116.25 120.33 1req h VAL 345 Ca 0.03 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 1req h VAL 345 Cb 0.12 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1req h VAL 345 CO 0.00 0.07 -0.08 0.58 0.02 0.00 0.00 177.57 178.16 1req h VAL 346 N 0.36 1.28 -0.21 2.57 2.07 -1.64 -2.13 116.25 118.56 1req h VAL 346 Ca 0.17 -1.13 0.04 0.00 0.82 0.00 0.00 66.70 66.60 1req h VAL 346 Cb 0.10 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 1req h VAL 346 CO -0.14 0.37 -0.05 0.03 0.02 0.00 0.00 177.57 177.80 1req h ARG 347 N 0.41 0.00 -0.54 1.57 3.08 -1.08 -2.11 114.38 115.71 1req h ARG 347 Ca 0.08 -0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 1req h ARG 347 Cb 0.58 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1req h ARG 347 CO 0.03 0.00 -0.12 1.15 -1.07 0.00 0.00 179.97 179.96 1req h THR 348 N 0.00 1.27 -0.29 2.04 2.02 -1.02 -2.04 112.91 114.89 1req h THR 348 Ca 0.10 -1.29 0.07 0.00 0.77 0.00 0.00 66.41 66.06 1req h THR 348 Cb 0.15 0.97 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 1req h THR 348 CO -0.21 0.45 -0.21 0.00 0.37 0.00 0.00 175.52 175.93 1req h ILE 350 N -0.18 1.24 -0.67 0.00 1.08 -1.19 -0.60 117.51 117.19 1req h ILE 350 Ca 0.16 -1.06 -0.04 0.00 -0.39 0.00 0.00 64.86 63.53 1req h ILE 350 Cb 0.42 1.11 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 1req h ILE 350 CO -0.40 0.35 0.25 -0.33 -0.69 0.00 0.00 178.15 177.33 1req h GLU 351 N 0.52 1.01 -0.29 2.37 5.08 -1.32 -0.73 114.58 121.22 1req h GLU 351 Ca 0.10 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 1req h GLU 351 Cb 0.52 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1req h GLU 351 CO 0.03 0.85 -0.11 0.00 -1.00 0.00 0.00 179.01 178.78 1req h ALA 352 N 1.11 1.27 -0.38 3.43 0.00 -0.34 -1.29 119.26 123.06 1req h ALA 352 Ca 0.22 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1req h ALA 352 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1req h ALA 352 CO -0.02 0.48 0.10 0.52 0.00 0.00 0.00 179.25 180.34 1req h MET 353 N 0.45 0.61 -0.68 0.00 2.86 -0.75 -2.29 114.93 115.12 1req h MET 353 Ca 0.09 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1req h MET 353 Cb 0.47 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1req h MET 353 CO 0.03 0.63 0.44 0.00 1.06 0.00 0.00 176.91 179.07 1req h ALA 354 N 0.95 0.87 -0.23 6.32 0.00 -0.64 0.08 119.26 126.62 1req h ALA 354 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1req h ALA 354 Cb 0.29 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1req h ALA 354 CO -0.00 0.25 0.13 0.00 0.00 0.00 0.00 179.25 179.64 1req h ALA 355 N 1.26 0.29 0.00 0.00 0.00 -1.19 -2.05 119.26 117.57 1req h ALA 355 Ca 0.26 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 355 Cb -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1req h ALA 355 CO -0.07 -0.19 -0.78 1.79 0.00 0.00 0.00 179.25 180.00 1req h THR 356 N 0.28 1.37 0.00 0.00 1.35 -1.34 -0.13 112.91 114.44 1req h THR 356 Ca 0.08 -2.87 0.00 0.00 -0.55 0.00 0.00 66.41 63.08 1req h THR 356 Cb 0.04 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1req h THR 356 CO -0.01 0.77 -0.08 0.00 -0.25 0.00 0.00 175.52 175.94 1req n GLN 357 N -3.33 0.14 0.03 4.72 6.02 0.01 -1.22 117.38 123.75 1req n GLN 357 Ca 0.01 0.10 0.13 0.00 -0.01 0.00 0.00 57.00 57.23 1req n GLN 357 Cb 0.84 -1.65 0.42 0.00 1.02 0.00 0.00 30.24 30.86 1req n GLN 357 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1req n GLY 358 N 1.40 -1.47 2.42 1.08 0.00 -0.78 -4.69 105.19 103.15 1req n GLY 358 Ca 0.06 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 1req n GLY 358 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1req n HIS 359 N -1.75 -1.30 -1.87 1.61 8.25 -0.36 -4.55 115.22 115.26 1req n HIS 359 Ca 0.06 0.52 -0.33 0.00 -0.26 0.00 0.00 57.72 57.71 1req n HIS 359 Cb 0.37 -3.63 0.03 0.00 1.12 0.00 0.00 29.99 27.88 1req n HIS 359 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1req s THR 360 N -3.21 3.59 -0.10 1.59 -1.32 -0.15 -4.89 115.64 111.16 1req s THR 360 Ca 0.10 0.72 0.15 0.00 -1.21 0.00 0.00 61.69 61.45 1req s THR 360 Cb -0.01 -3.26 -0.14 0.00 -1.51 0.00 0.00 72.50 67.58 1req s THR 360 CO 0.42 -0.48 0.88 1.56 -2.21 0.00 0.00 174.62 174.79 1req h GLN 361 N 0.13 0.00 -3.73 7.08 7.50 -0.48 -3.43 115.11 122.18 1req h GLN 361 Ca -0.46 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 58.61 1req h GLN 361 Cb 1.23 0.00 -0.11 0.00 0.05 0.00 0.00 27.48 28.65 1req h GLN 361 CO 0.56 0.39 -0.19 -1.54 -1.50 0.00 0.00 178.83 176.55 1req s SER 362 N -5.96 -0.06 -0.17 1.46 1.04 -0.73 -1.45 113.70 107.83 1req s SER 362 Ca -0.02 -0.87 -0.25 0.00 0.48 0.00 0.00 55.95 55.28 1req s SER 362 Cb 0.08 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.79 1req s SER 362 CO 0.81 -1.03 0.64 -0.22 0.98 0.00 0.00 173.24 174.41 1req s LEU 363 N -2.99 -0.46 -0.09 2.42 2.96 -0.65 -1.61 118.68 118.26 1req s LEU 363 Ca 0.20 1.04 0.03 0.00 -0.22 0.00 0.00 54.13 55.17 1req s LEU 363 Cb 0.01 2.27 -0.02 0.00 0.50 0.00 0.00 46.19 48.96 1req s LEU 363 CO 0.05 -0.37 -0.17 -2.28 -1.32 0.00 0.00 176.35 172.26 1req s HIS 364 N -0.27 2.67 -0.17 5.38 5.65 -0.33 -1.36 115.29 126.86 1req s HIS 364 Ca -0.05 -0.57 -0.03 0.00 0.25 0.00 0.00 55.06 54.66 1req s HIS 364 Cb -0.03 -1.72 -0.02 0.00 -1.18 0.00 0.00 32.58 29.63 1req s HIS 364 CO 0.04 -0.13 -0.05 0.95 -0.65 0.00 0.00 174.74 174.90 1req s THR 365 N -0.05 3.64 1.18 0.89 -4.23 -1.26 -1.89 115.64 113.91 1req s THR 365 Ca -0.04 -0.44 -0.16 0.00 -1.18 0.00 0.00 61.69 59.87 1req s THR 365 Cb -0.14 -2.60 0.27 0.00 1.34 0.00 0.00 72.50 71.37 1req s THR 365 CO 0.04 0.48 1.05 0.20 -0.54 0.00 0.00 174.62 175.85 1req s ASN 366 N 0.65 1.04 0.30 3.99 0.01 -1.26 -4.82 114.94 114.85 1req s ASN 366 Ca -0.03 1.05 0.10 0.00 -0.71 0.00 0.00 52.86 53.27 1req s ASN 366 Cb -0.15 -1.59 -0.05 0.00 0.41 0.00 0.00 41.25 39.87 1req s ASN 366 CO 0.02 -4.10 -0.05 -0.44 -1.51 0.00 0.00 177.10 171.03 1req s SER 367 N -3.27 4.16 0.46 -1.22 0.01 -1.26 -4.54 113.70 108.04 1req s SER 367 Ca 0.68 -0.88 0.12 0.00 1.31 0.00 0.00 55.95 57.18 1req s SER 367 Cb -0.17 -0.58 1.05 0.00 0.21 0.00 0.00 66.02 66.53 1req s SER 367 CO 0.59 -0.09 2.09 0.17 0.41 0.00 0.00 173.24 176.42 1req h LEU 368 N 1.95 0.26 -2.47 2.44 8.10 -1.88 -1.12 115.31 122.58 1req h LEU 368 Ca -0.43 -0.01 -0.11 0.00 0.11 0.00 0.00 57.88 57.45 1req h LEU 368 Cb 1.25 -0.06 -0.06 0.00 -0.44 0.00 0.00 40.66 41.35 1req h LEU 368 CO 0.63 0.18 0.14 -0.90 -4.11 0.00 0.00 178.44 174.38 1req n ASP 369 N -4.50 3.19 -0.22 0.17 5.68 -1.26 -4.57 116.55 115.04 1req n ASP 369 Ca 0.01 -2.54 0.11 0.00 -0.50 0.00 0.00 54.79 51.87 1req n ASP 369 Cb 0.10 -0.61 0.40 0.00 -1.14 0.00 0.00 41.12 39.87 1req n ASP 369 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1req h GLU 370 N 1.13 0.62 -0.01 0.11 4.57 -1.38 -0.45 114.58 119.17 1req h GLU 370 Ca 0.13 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1req h GLU 370 Cb 1.46 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1req h GLU 370 CO 0.34 0.41 -0.11 0.00 -1.18 0.00 0.00 179.01 178.47 1req n ALA 371 N -2.46 2.79 -0.04 2.92 0.00 -1.26 -4.29 120.51 118.17 1req n ALA 371 Ca 0.15 -0.34 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 1req n ALA 371 Cb 0.42 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1req n ALA 371 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1req n ILE 372 N -0.62 0.44 -3.84 0.00 5.41 -0.53 -4.75 119.36 115.47 1req n ILE 372 Ca 0.16 -0.15 -0.05 0.00 1.00 0.00 0.00 62.75 63.71 1req n ILE 372 Cb 0.30 -1.10 0.01 0.00 -0.71 0.00 0.00 39.64 38.14 1req n ILE 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1req s ALA 373 N -2.15 -1.34 0.79 -1.39 0.00 -0.29 -4.65 121.76 112.72 1req s ALA 373 Ca -0.11 -0.38 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 1req s ALA 373 Cb 0.03 0.72 0.07 0.00 0.00 0.00 0.00 23.12 23.94 1req s ALA 373 CO 0.16 -1.04 1.12 -0.51 0.00 0.00 0.00 175.76 175.49 1req s LEU 374 N -3.21 3.07 0.61 0.00 1.43 -1.26 -4.26 118.68 115.06 1req s LEU 374 Ca 0.18 1.99 -0.18 0.00 -1.03 0.00 0.00 54.13 55.08 1req s LEU 374 Cb -0.03 -4.54 -0.03 0.00 0.03 0.00 0.00 46.19 41.62 1req s LEU 374 CO 0.07 -2.26 1.22 -2.84 0.23 0.00 0.00 176.35 172.76 1req s PRO 375 N -4.63 2.87 0.51 1.29 0.02 -1.26 -3.95 135.00 129.85 1req s PRO 375 Ca 0.65 1.85 0.01 0.00 0.02 0.00 0.00 61.00 63.53 1req s PRO 375 Cb -0.20 -1.91 0.10 0.00 0.02 0.00 0.00 34.50 32.51 1req s PRO 375 CO 0.53 -1.30 0.71 0.25 -0.33 0.00 0.00 177.00 176.86 1req n THR 376 N -1.71 0.00 -0.16 0.99 -2.24 -1.26 -4.78 114.28 105.12 1req n THR 376 Ca 0.14 -1.22 -0.09 0.00 -2.27 0.00 0.00 64.05 60.61 1req n THR 376 Cb 0.49 -0.94 -0.00 0.00 -2.10 0.00 0.00 70.33 67.78 1req n THR 376 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1req h ASP 377 N -0.33 0.72 0.14 3.42 3.32 -1.98 0.89 116.42 122.61 1req h ASP 377 Ca -0.23 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 1req h ASP 377 Cb 0.91 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1req h ASP 377 CO 0.27 0.80 -0.07 0.15 -1.72 0.00 0.00 179.24 178.67 1req h PHE 378 N 0.62 -0.18 -0.69 4.55 3.57 -1.99 -2.26 116.94 120.56 1req h PHE 378 Ca 0.14 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1req h PHE 378 Cb 0.39 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 1req h PHE 378 CO 0.03 0.08 0.33 0.66 -2.23 0.00 0.00 178.31 177.18 1req h SER 379 N -0.43 0.90 -0.20 0.41 4.64 -1.93 -2.33 113.55 114.61 1req h SER 379 Ca -0.02 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.10 1req h SER 379 Cb 0.34 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1req h SER 379 CO 0.03 0.78 -0.07 0.00 -0.87 0.00 0.00 176.83 176.70 1req h ALA 380 N 1.16 1.26 -0.41 5.18 0.00 -0.87 -1.57 119.26 124.00 1req h ALA 380 Ca 0.24 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1req h ALA 380 Cb 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1req h ALA 380 CO -0.03 0.49 -0.25 -0.09 0.00 0.00 0.00 179.25 179.37 1req h ARG 381 N 0.51 0.87 -0.32 0.00 2.43 -1.04 -1.31 114.38 115.52 1req h ARG 381 Ca 0.10 -0.38 -0.07 0.00 -0.81 0.00 0.00 59.98 58.83 1req h ARG 381 Cb 0.44 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1req h ARG 381 CO 0.02 1.02 -0.06 0.82 -1.51 0.00 0.00 179.97 180.26 1req h ILE 382 N 0.74 1.28 -0.86 1.20 2.04 -1.13 0.12 117.51 120.90 1req h ILE 382 Ca 0.09 -1.08 0.11 0.00 1.00 0.00 0.00 64.86 64.98 1req h ILE 382 Cb 0.80 1.34 -0.08 0.00 -0.74 0.00 0.00 36.82 38.14 1req h ILE 382 CO 0.07 0.35 0.48 0.00 0.00 0.00 0.00 178.15 179.05 1req h ALA 383 N 0.81 1.25 0.12 1.87 0.00 -1.18 0.45 119.26 122.58 1req h ALA 383 Ca 0.08 0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.77 1req h ALA 383 Cb 0.54 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1req h ALA 383 CO 0.03 0.05 -1.21 -0.09 0.00 0.00 0.00 179.25 178.03 1req h ARG 384 N 0.76 0.30 0.00 0.00 2.43 -1.11 -3.02 114.38 113.74 1req h ARG 384 Ca 0.43 -0.48 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1req h ARG 384 Cb 0.47 0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1req h ARG 384 CO -0.29 1.21 -0.10 -0.91 -1.51 0.00 0.00 179.97 178.38 1req h ASN 385 N 0.10 0.00 -0.30 -3.80 -0.26 -0.79 -1.50 115.58 109.02 1req h ASN 385 Ca -0.13 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.66 1req h ASN 385 Cb 1.92 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 39.14 1req h ASN 385 CO 0.20 0.10 0.02 0.74 -1.06 0.00 0.00 177.43 177.44 1req h THR 386 N 0.00 0.81 -0.26 2.81 2.02 -0.77 0.23 112.91 117.75 1req h THR 386 Ca -0.00 -0.04 -0.17 0.00 0.77 0.00 0.00 66.41 66.96 1req h THR 386 Cb 0.51 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1req h THR 386 CO 0.01 0.02 -0.53 1.56 0.37 0.00 0.00 175.52 176.95 1req h GLN 387 N 0.12 0.76 -0.39 6.66 4.20 -1.46 -2.60 115.11 122.39 1req h GLN 387 Ca 0.15 -0.47 -0.10 0.00 0.06 0.00 0.00 58.65 58.28 1req h GLN 387 Cb 0.18 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1req h GLN 387 CO -0.22 1.10 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.80 1req h LEU 388 N 0.59 0.82 -0.39 1.46 3.38 -0.98 -0.43 115.31 119.75 1req h LEU 388 Ca 0.02 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.68 1req h LEU 388 Cb 1.11 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.56 1req h LEU 388 CO 0.11 1.03 -0.16 0.15 0.09 0.00 0.00 178.44 179.67 1req h PHE 389 N 0.61 -0.37 -0.88 1.13 3.57 -0.57 0.12 116.94 120.56 1req h PHE 389 Ca 0.09 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1req h PHE 389 Cb 0.71 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 1req h PHE 389 CO 0.06 -0.23 0.57 -0.07 -2.23 0.00 0.00 178.31 176.40 1req h LEU 390 N -0.08 0.97 -0.05 0.59 3.38 -1.11 0.69 115.31 119.72 1req h LEU 390 Ca 0.19 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1req h LEU 390 Cb 0.37 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1req h LEU 390 CO -0.45 0.69 0.01 1.56 0.09 0.00 0.00 178.44 180.34 1req h GLN 391 N 1.15 0.08 0.10 1.13 4.20 -0.24 -3.26 115.11 118.27 1req h GLN 391 Ca 0.33 -0.02 -0.33 0.00 0.06 0.00 0.00 58.65 58.69 1req h GLN 391 Cb -0.07 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1req h GLN 391 CO -0.09 0.30 -1.77 1.96 -0.67 0.00 0.00 178.83 178.56 1req h GLN 392 N -0.16 0.22 0.00 1.46 4.20 -0.57 -3.44 115.11 116.83 1req h GLN 392 Ca 0.01 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1req h GLN 392 Cb 0.26 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1req h GLN 392 CO 0.00 1.05 -0.78 0.39 -0.67 0.00 0.00 178.83 178.82 1req n GLU 393 N -3.40 2.58 0.12 1.46 1.02 0.21 -4.79 120.64 117.85 1req n GLU 393 Ca -0.23 -0.03 -0.02 0.00 -0.02 0.00 0.00 57.16 56.86 1req n GLU 393 Cb 1.05 -0.95 0.20 0.00 -0.02 0.00 0.00 31.44 31.72 1req n GLU 393 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1req h SER 394 N 0.00 0.13 -0.30 1.62 4.64 -1.52 -3.47 113.55 114.65 1req h SER 394 Ca 0.00 -0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 61.13 1req h SER 394 Cb 0.19 -0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 62.20 1req h SER 394 CO 0.00 0.63 -0.11 0.61 -0.87 0.00 0.00 176.83 177.09 1req n GLY 395 N 0.02 0.82 0.70 -0.77 0.00 -1.26 -4.91 105.19 99.79 1req n GLY 395 Ca -0.02 -0.78 0.13 0.00 0.00 0.00 0.00 46.02 45.35 1req n GLY 395 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1req n THR 396 N -2.86 0.04 0.20 2.61 -2.24 -1.26 -3.94 114.28 106.83 1req n THR 396 Ca -0.06 -0.38 0.11 0.00 -2.27 0.00 0.00 64.05 61.46 1req n THR 396 Cb 0.21 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 1req n THR 396 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1req n THR 397 N 0.68 0.37 -0.09 4.28 -2.24 -1.26 -4.53 114.28 111.49 1req n THR 397 Ca 0.17 -0.46 -0.02 0.00 -2.27 0.00 0.00 64.05 61.47 1req n THR 397 Cb 0.46 -0.13 0.22 0.00 -2.10 0.00 0.00 70.33 68.78 1req n THR 397 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1req h ARG 398 N 0.00 0.73 -6.00 -0.78 0.11 -1.85 -2.69 114.38 103.90 1req h ARG 398 Ca 0.00 -0.16 -0.68 0.00 0.10 0.00 0.00 59.98 59.25 1req h ARG 398 Cb 0.93 -0.11 -0.15 0.00 1.11 0.00 0.00 29.97 31.76 1req h ARG 398 CO 0.00 0.69 -0.63 0.08 0.10 0.00 0.00 179.97 180.22 1req s VAL 399 N -5.10 4.29 -0.31 0.08 1.01 -1.26 -4.46 120.40 114.65 1req s VAL 399 Ca -0.09 -0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 1req s VAL 399 Cb 0.15 -2.82 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 1req s VAL 399 CO 0.79 0.57 1.35 -0.63 0.00 0.00 0.00 175.10 177.19 1req s ILE 400 N -0.91 4.05 -0.51 2.22 1.01 -1.26 -3.96 121.20 121.84 1req s ILE 400 Ca 0.14 1.17 -0.21 0.00 0.00 0.00 0.00 60.65 61.75 1req s ILE 400 Cb -0.11 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.27 1req s ILE 400 CO 0.03 -0.50 0.64 -0.67 0.00 0.00 0.00 174.94 174.44 1req n ASP 401 N 7.90 -6.80 0.24 3.58 2.03 -1.26 -4.89 116.55 117.36 1req n ASP 401 Ca 0.15 0.09 0.10 0.00 0.52 0.00 0.00 54.79 55.65 1req n ASP 401 Cb 0.47 -3.74 0.63 0.00 -0.72 0.00 0.00 41.12 37.75 1req n ASP 401 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1req h PRO 402 N 1.65 0.00 0.00 -0.67 0.13 -1.84 -2.29 132.00 128.98 1req h PRO 402 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1req h PRO 402 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1req h PRO 402 CO 0.24 0.16 -0.17 0.91 -0.23 0.00 0.00 178.00 178.91 1req n TRP 403 N -3.87 0.06 -1.67 1.56 7.02 -1.26 -4.91 117.44 114.37 1req n TRP 403 Ca -0.02 0.02 -0.59 0.00 -1.02 0.00 0.00 57.50 55.88 1req n TRP 403 Cb 0.26 -0.45 -0.08 0.00 -2.42 0.00 0.00 31.31 28.62 1req n TRP 403 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1req n SER 404 N -1.55 2.04 0.00 -0.99 2.88 -0.87 -0.46 113.62 114.67 1req n SER 404 Ca 0.06 1.01 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 1req n SER 404 Cb 0.35 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 1req n SER 404 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1req n GLY 405 N 4.60 3.11 3.42 0.46 0.00 -1.26 -5.06 105.19 110.46 1req n GLY 405 Ca 0.31 -0.95 -0.58 0.00 0.00 0.00 0.00 46.02 44.80 1req n GLY 405 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1req n SER 406 N 0.77 0.09 -0.16 1.61 2.88 0.39 -4.86 113.62 114.34 1req n SER 406 Ca 0.00 1.13 -0.10 0.00 -1.33 0.00 0.00 58.87 58.57 1req n SER 406 Cb 0.00 -0.89 -0.00 0.00 -0.75 0.00 0.00 64.21 62.57 1req n SER 406 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1req h ALA 407 N 3.07 0.64 0.10 -1.46 0.00 -1.89 -1.10 119.26 118.63 1req h ALA 407 Ca -0.49 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.12 1req h ALA 407 Cb 1.38 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1req h ALA 407 CO 0.66 0.47 -0.05 -0.92 0.00 0.00 0.00 179.25 179.41 1req h TYR 408 N 0.70 -0.13 -0.49 0.00 3.20 -1.89 -2.22 116.97 116.14 1req h TYR 408 Ca 0.13 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.88 1req h TYR 408 Cb 0.55 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1req h TYR 408 CO 0.04 -0.07 -0.15 0.28 -1.64 0.00 0.00 178.16 176.62 1req h VAL 409 N -0.15 1.27 -0.87 1.81 2.07 -1.89 -1.46 116.25 117.02 1req h VAL 409 Ca -0.01 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.21 1req h VAL 409 Cb 0.12 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1req h VAL 409 CO 0.02 0.45 0.58 -0.33 0.02 0.00 0.00 177.57 178.31 1req h GLU 410 N 0.84 1.14 -0.09 1.57 4.39 -1.31 -1.08 114.58 120.03 1req h GLU 410 Ca 0.12 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 1req h GLU 410 Cb 0.72 -0.26 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1req h GLU 410 CO 0.06 0.76 0.02 1.49 -1.16 0.00 0.00 179.01 180.17 1req h GLU 411 N 1.18 0.15 -0.86 2.33 4.57 -0.72 -2.33 114.58 118.89 1req h GLU 411 Ca 0.32 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.52 1req h GLU 411 Cb -0.13 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.38 1req h GLU 411 CO -0.07 0.33 0.54 -0.07 -1.18 0.00 0.00 179.01 178.56 1req h LEU 412 N -0.06 0.87 0.35 1.64 3.38 -1.22 0.33 115.31 120.60 1req h LEU 412 Ca 0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1req h LEU 412 Cb 0.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1req h LEU 412 CO 0.00 0.57 -0.28 0.74 0.09 0.00 0.00 178.44 179.56 1req h THR 413 N 1.01 0.41 -0.32 0.22 2.02 -1.11 0.19 112.91 115.34 1req h THR 413 Ca 0.37 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.56 1req h THR 413 Cb 0.11 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1req h THR 413 CO -0.15 0.00 0.19 -0.25 0.37 0.00 0.00 175.52 175.68 1req h TRP 414 N -0.64 0.36 -0.65 3.16 -0.00 -0.74 0.15 115.95 117.58 1req h TRP 414 Ca -0.03 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 58.90 1req h TRP 414 Cb 0.56 -0.12 -0.04 0.00 -0.00 0.00 0.00 29.16 29.56 1req h TRP 414 CO -0.15 0.22 0.41 -0.44 -0.00 0.00 0.00 178.44 178.48 1req h ASP 415 N 0.39 0.68 0.00 2.65 3.32 -0.15 -1.54 116.42 121.78 1req h ASP 415 Ca 0.13 -0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.91 1req h ASP 415 Cb -0.01 -0.15 0.02 0.00 0.22 0.00 0.00 39.33 39.41 1req h ASP 415 CO -0.05 0.48 -1.04 -0.07 -1.72 0.00 0.00 179.24 176.84 1req h LEU 416 N 0.82 0.91 -0.26 1.55 3.38 -0.20 -1.89 115.31 119.61 1req h LEU 416 Ca 0.26 -0.74 0.06 0.00 0.09 0.00 0.00 57.88 57.54 1req h LEU 416 Cb -0.01 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.41 1req h LEU 416 CO -0.09 1.53 -0.11 0.00 0.09 0.00 0.00 178.44 179.86 1req h ALA 417 N 0.39 0.12 -0.21 1.53 0.00 -0.72 0.13 119.26 120.50 1req h ALA 417 Ca -0.13 0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 1req h ALA 417 Cb 1.69 0.27 0.01 0.00 0.00 0.00 0.00 17.79 19.76 1req h ALA 417 CO 0.20 -0.51 -0.68 0.00 0.00 0.00 0.00 179.25 178.26 1req h ARG 418 N -0.06 0.82 -0.67 0.00 3.08 -1.31 -0.95 114.38 115.29 1req h ARG 418 Ca 0.14 -0.61 -0.07 0.00 0.07 0.00 0.00 59.98 59.50 1req h ARG 418 Cb 0.27 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 1req h ARG 418 CO -0.31 1.23 0.14 0.87 -1.07 0.00 0.00 179.97 180.83 1req h LYS 419 N 0.58 1.09 -0.50 0.04 1.57 -1.09 -0.64 116.57 117.62 1req h LYS 419 Ca -0.03 -0.28 -0.10 0.00 -1.87 0.00 0.00 60.65 58.38 1req h LYS 419 Cb 1.30 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 1req h LYS 419 CO 0.14 0.98 -0.07 0.00 -0.57 0.00 0.00 179.45 179.94 1req h ALA 420 N 1.06 0.68 -0.95 3.86 0.00 -0.74 -2.30 119.26 120.87 1req h ALA 420 Ca 0.21 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1req h ALA 420 Cb 0.40 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1req h ALA 420 CO 0.01 0.55 0.63 2.35 0.00 0.00 0.00 179.25 182.79 1req h TRP 421 N 0.79 1.18 -0.27 0.00 2.91 -1.02 -0.20 115.95 119.34 1req h TRP 421 Ca 0.13 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 60.10 1req h TRP 421 Cb 0.62 -0.40 -0.02 0.00 -0.51 0.00 0.00 29.16 28.85 1req h TRP 421 CO 0.05 0.72 -0.17 0.78 -1.03 0.00 0.00 178.44 178.79 1req h GLY 422 N 1.25 0.52 1.67 2.65 0.00 -0.72 -1.54 103.07 106.90 1req h GLY 422 Ca 0.36 -0.38 -0.15 0.00 0.00 0.00 0.00 47.33 47.15 1req h GLY 422 CO -0.09 0.35 -0.61 0.45 0.00 0.00 0.00 176.54 176.64 1req h HIS 423 N 0.44 0.43 -0.49 5.60 3.86 -0.94 -2.83 115.15 121.22 1req h HIS 423 Ca 0.08 -0.17 -0.06 0.00 -1.16 0.00 0.00 60.37 59.07 1req h HIS 423 Cb 0.55 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.92 1req h HIS 423 CO 0.02 0.86 0.09 0.82 0.86 0.00 0.00 177.93 180.57 1req h ILE 424 N 0.25 1.25 0.16 2.45 2.04 -0.83 -1.72 117.51 121.11 1req h ILE 424 Ca -0.01 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 64.96 1req h ILE 424 Cb 1.13 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 1req h ILE 424 CO 0.10 0.32 -0.40 1.56 0.00 0.00 0.00 178.15 179.73 1req h GLN 425 N 0.69 -0.63 -0.21 2.37 4.20 -1.29 -0.05 115.11 120.18 1req h GLN 425 Ca 0.15 0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.96 1req h GLN 425 Cb 0.38 0.14 -0.07 0.00 0.30 0.00 0.00 27.48 28.23 1req h GLN 425 CO 0.01 -0.42 -0.38 0.93 -0.67 0.00 0.00 178.83 178.30 1req h GLU 426 N -0.66 -0.39 -0.61 1.46 5.08 -1.38 0.08 114.58 118.17 1req h GLU 426 Ca 0.02 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.51 1req h GLU 426 Cb 0.67 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.93 1req h GLU 426 CO -0.21 -0.26 0.19 0.28 -1.00 0.00 0.00 179.01 178.01 1req h VAL 427 N -0.40 0.71 -0.56 3.13 2.07 -1.21 -1.05 116.25 118.94 1req h VAL 427 Ca 0.11 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 1req h VAL 427 Cb 0.59 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1req h VAL 427 CO -0.43 0.06 0.18 -0.33 0.02 0.00 0.00 177.57 177.07 1req h GLU 428 N 0.35 0.84 -0.25 1.57 4.39 -0.46 0.85 114.58 121.86 1req h GLU 428 Ca 0.31 -0.15 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1req h GLU 428 Cb 0.42 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.89 1req h GLU 428 CO -0.35 0.72 -0.02 0.87 -1.16 0.00 0.00 179.01 179.08 1req h LYS 429 N 0.82 0.06 -0.97 2.33 1.57 0.34 -2.92 116.57 117.79 1req h LYS 429 Ca 0.19 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1req h LYS 429 Cb 0.22 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1req h LYS 429 CO -0.01 0.04 0.00 0.28 -0.57 0.00 0.00 179.45 179.19 1req n VAL 430 N -5.17 0.02 -0.72 0.50 0.31 -1.01 -4.79 118.33 107.47 1req n VAL 430 Ca -0.01 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1req n VAL 430 Cb 0.14 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 1req n VAL 430 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1req n GLY 431 N 0.02 0.59 0.00 2.92 0.00 -1.10 -4.61 105.19 103.00 1req n GLY 431 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1req n GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 432 N -2.72 1.16 0.32 -0.02 0.00 0.27 -4.42 105.19 99.77 1req n GLY 432 Ca 0.00 -1.91 -0.06 0.00 0.00 0.00 0.00 46.02 44.05 1req n GLY 432 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1req h MET 433 N 0.00 1.10 -0.28 1.61 2.86 -1.85 -0.94 114.93 117.43 1req h MET 433 Ca 0.00 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1req h MET 433 Cb 0.00 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 1req h MET 433 CO 0.00 0.88 0.18 0.00 1.06 0.00 0.00 176.91 179.03 1req h ALA 434 N 1.17 0.36 -0.51 6.32 0.00 -1.95 0.28 119.26 124.92 1req h ALA 434 Ca 0.25 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1req h ALA 434 Cb 0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1req h ALA 434 CO -0.03 -0.18 0.22 0.87 0.00 0.00 0.00 179.25 180.13 1req h LYS 435 N 0.37 0.73 -0.24 0.00 1.57 -1.74 -2.54 116.57 114.72 1req h LYS 435 Ca 0.11 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.69 1req h LYS 435 Cb -0.03 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1req h LYS 435 CO -0.03 0.60 -0.22 0.00 -0.57 0.00 0.00 179.45 179.22 1req h ALA 436 N 1.51 0.35 -0.44 3.86 0.00 -0.31 -3.12 119.26 121.11 1req h ALA 436 Ca 0.18 -0.37 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1req h ALA 436 Cb 0.13 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 1req h ALA 436 CO -0.02 0.30 0.02 0.82 0.00 0.00 0.00 179.25 180.37 1req h ILE 437 N 0.27 0.68 -0.01 0.00 2.04 -0.47 -1.84 117.51 118.19 1req h ILE 437 Ca 0.04 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1req h ILE 437 Cb 0.78 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1req h ILE 437 CO 0.06 0.02 0.01 -0.08 0.00 0.00 0.00 178.15 178.16 1req h GLU 438 N 0.13 0.00 0.00 2.37 4.57 -1.39 -1.18 114.58 119.08 1req h GLU 438 Ca 0.22 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1req h GLU 438 Cb 0.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1req h GLU 438 CO -0.35 0.00 0.00 0.87 -1.18 0.00 0.00 179.01 178.35 1req h LYS 439 N 0.00 0.00 0.00 1.92 1.57 -1.30 -3.48 116.57 115.28 1req h LYS 439 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1req h LYS 439 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1req h LYS 439 CO -0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 1req n GLY 440 N 0.25 0.71 0.10 3.86 0.00 -0.45 -4.98 105.19 104.69 1req n GLY 440 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 1req n GLY 440 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1req h ILE 441 N 0.00 1.40 -0.08 -0.61 2.04 -1.81 -1.22 117.51 117.22 1req h ILE 441 Ca 0.00 -1.33 0.04 0.00 1.00 0.00 0.00 64.86 64.57 1req h ILE 441 Cb 0.00 2.13 -0.06 0.00 -0.74 0.00 0.00 36.82 38.15 1req h ILE 441 CO 0.00 0.37 -0.29 -0.65 0.00 0.00 0.00 178.15 177.58 1req h PRO 442 N -0.29 -0.38 -0.71 2.37 0.11 -1.90 0.49 132.00 131.70 1req h PRO 442 Ca 0.01 0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 1req h PRO 442 Cb 0.64 0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.80 1req h PRO 442 CO 0.02 -0.25 0.24 -0.22 -0.21 0.00 0.00 178.00 177.58 1req h LYS 443 N -0.39 1.09 -0.14 1.05 3.64 -1.80 -1.62 116.57 118.39 1req h LYS 443 Ca 0.08 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.29 1req h LYS 443 Cb 0.52 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.11 1req h LYS 443 CO -0.30 0.93 -0.24 1.98 -2.27 0.00 0.00 179.45 179.55 1req h MET 444 N 1.04 -0.29 -0.92 1.90 4.05 -0.65 -0.09 114.93 119.97 1req h MET 444 Ca 0.23 0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.73 1req h MET 444 Cb 0.28 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.08 1req h MET 444 CO -0.01 -0.19 0.58 -0.09 0.23 0.00 0.00 176.91 177.43 1req h ARG 445 N -0.30 1.02 -0.29 0.39 9.65 0.45 -1.58 114.38 123.73 1req h ARG 445 Ca 0.11 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.89 1req h ARG 445 Cb 0.45 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 28.79 1req h ARG 445 CO -0.32 0.68 0.05 0.82 2.80 0.00 0.00 179.97 184.00 1req h ILE 446 N 1.05 1.23 -0.27 1.20 2.04 -0.98 -2.89 117.51 118.89 1req h ILE 446 Ca 0.40 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1req h ILE 446 Cb 0.17 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1req h ILE 446 CO -0.17 0.26 -0.02 -0.33 0.00 0.00 0.00 178.15 177.89 1req h GLU 447 N 0.30 0.42 -0.09 2.37 5.08 -0.75 -2.54 114.58 119.37 1req h GLU 447 Ca 0.09 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1req h GLU 447 Cb 0.34 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1req h GLU 447 CO 0.01 0.46 0.04 0.93 -1.00 0.00 0.00 179.01 179.45 1req h GLU 448 N 0.40 0.13 -0.81 2.33 5.08 -1.32 -1.59 114.58 118.79 1req h GLU 448 Ca 0.09 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.51 1req h GLU 448 Cb 0.30 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 1req h GLU 448 CO 0.01 0.20 0.48 0.00 -1.00 0.00 0.00 179.01 178.70 1req h ALA 449 N 0.92 1.14 -0.76 3.43 0.00 -1.33 -0.89 119.26 121.77 1req h ALA 449 Ca 0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1req h ALA 449 Cb 0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1req h ALA 449 CO -0.00 0.14 0.48 0.00 0.00 0.00 0.00 179.25 179.87 1req h ALA 450 N 1.43 0.97 -0.34 0.00 0.00 -1.33 0.62 119.26 120.60 1req h ALA 450 Ca 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1req h ALA 450 Cb 0.29 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1req h ALA 450 CO -0.22 0.42 0.14 0.00 0.00 0.00 0.00 179.25 179.59 1req h ALA 451 N 1.26 0.45 -0.48 0.00 0.00 -0.96 -0.41 119.26 119.12 1req h ALA 451 Ca 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1req h ALA 451 Cb -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1req h ALA 451 CO -0.06 0.04 0.30 0.00 0.00 0.00 0.00 179.25 179.54 1req h ARG 452 N 0.41 0.64 -0.43 0.00 3.08 -0.93 -0.50 114.38 116.64 1req h ARG 452 Ca 0.11 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1req h ARG 452 Cb 0.18 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1req h ARG 452 CO -0.01 0.44 0.27 1.15 -1.07 0.00 0.00 179.97 180.75 1req h THR 453 N 0.64 1.12 -0.68 2.04 2.02 -0.76 -2.23 112.91 115.06 1req h THR 453 Ca 0.17 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1req h THR 453 Cb -0.05 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1req h THR 453 CO -0.04 0.12 0.42 -0.61 0.37 0.00 0.00 175.52 175.79 1req h GLN 454 N 0.58 0.91 -0.41 6.66 5.75 -0.87 -1.55 115.11 126.18 1req h GLN 454 Ca 0.16 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1req h GLN 454 Cb -0.04 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.29 1req h GLN 454 CO -0.03 0.63 0.25 0.00 -2.65 0.00 0.00 178.83 177.03 1req h ALA 455 N 1.23 0.51 -0.30 3.38 0.00 -0.99 0.45 119.26 123.53 1req h ALA 455 Ca 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1req h ALA 455 Cb -0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1req h ALA 455 CO -0.05 -0.06 -0.02 0.00 0.00 0.00 0.00 179.25 179.11 1req h ARG 456 N 0.51 0.47 0.15 0.00 3.08 -1.08 -1.79 114.38 115.72 1req h ARG 456 Ca 0.16 -0.10 -0.24 0.00 0.07 0.00 0.00 59.98 59.86 1req h ARG 456 Cb -0.02 -0.07 0.03 0.00 0.08 0.00 0.00 29.97 29.98 1req h ARG 456 CO -0.06 0.52 -1.04 0.82 -1.07 0.00 0.00 179.97 179.14 1req h ILE 457 N 0.45 1.41 -0.06 2.04 2.04 -1.09 -0.02 117.51 122.28 1req h ILE 457 Ca 0.10 -2.52 -0.00 0.00 1.00 0.00 0.00 64.86 63.44 1req h ILE 457 Cb 0.33 3.02 -0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1req h ILE 457 CO 0.01 0.73 0.03 0.44 0.00 0.00 0.00 178.15 179.37 1req h ASP 458 N -0.10 0.08 -0.32 1.72 3.32 -0.79 -2.82 116.42 117.51 1req h ASP 458 Ca -0.17 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 1req h ASP 458 Cb 1.79 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 41.31 1req h ASP 458 CO 0.20 0.17 0.17 0.77 -1.72 0.00 0.00 179.24 178.83 1req h SER 459 N -0.02 0.43 0.00 6.45 4.64 -1.48 -3.47 113.55 120.10 1req h SER 459 Ca 0.02 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1req h SER 459 Cb 0.11 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1req h SER 459 CO -0.00 0.36 0.00 0.61 -0.87 0.00 0.00 176.83 176.93 1req n GLY 460 N -1.32 0.53 0.14 -0.77 0.00 -0.85 -4.98 105.19 97.94 1req n GLY 460 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1req n GLY 460 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1req h ARG 461 N 2.88 0.26 -4.50 1.61 -0.00 -1.53 -3.32 114.38 109.78 1req h ARG 461 Ca 0.00 -0.02 -0.72 0.00 -0.50 0.00 0.00 59.98 58.74 1req h ARG 461 Cb 0.00 -0.06 -0.21 0.00 0.00 0.00 0.00 29.97 29.70 1req h ARG 461 CO 0.00 0.17 -0.18 -1.14 0.00 0.00 0.00 179.97 178.83 1req s GLN 462 N -6.17 3.03 0.59 0.04 0.74 -0.14 -5.01 119.66 112.74 1req s GLN 462 Ca -0.13 -1.25 -0.20 0.00 0.05 0.00 0.00 55.36 53.83 1req s GLN 462 Cb 0.10 -4.15 -0.03 0.00 1.10 0.00 0.00 33.01 30.03 1req s GLN 462 CO 0.70 -1.15 1.28 -2.14 -0.55 0.00 0.00 175.29 173.43 1req s PRO 463 N 2.00 2.95 -0.32 1.67 0.02 -1.25 -4.23 135.00 135.84 1req s PRO 463 Ca 0.08 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.12 1req s PRO 463 Cb -0.23 -2.03 0.14 0.00 0.02 0.00 0.00 34.50 32.40 1req s PRO 463 CO 0.08 -1.28 0.33 -1.17 -0.33 0.00 0.00 177.00 174.63 1req s LEU 464 N -3.92 -0.17 0.11 -5.54 2.96 -1.26 -5.04 118.68 105.81 1req s LEU 464 Ca 0.76 -1.06 -0.31 0.00 -0.22 0.00 0.00 54.13 53.31 1req s LEU 464 Cb -0.35 0.53 -0.10 0.00 0.50 0.00 0.00 46.19 46.76 1req s LEU 464 CO 0.40 -0.34 1.78 -0.63 -1.32 0.00 0.00 176.35 176.24 1req s ILE 465 N 2.02 2.66 0.00 6.68 -1.09 -1.26 -1.62 121.20 128.58 1req s ILE 465 Ca 0.12 0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.70 1req s ILE 465 Cb -0.15 -3.10 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1req s ILE 465 CO -0.22 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.10 1req n GLY 466 N 4.17 0.78 0.75 6.18 0.00 0.50 -4.87 105.19 112.71 1req n GLY 466 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1req n GLY 466 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1req n VAL 467 N -2.00 0.00 1.00 1.61 0.31 -0.64 -4.48 118.33 114.12 1req n VAL 467 Ca 0.00 0.11 0.10 0.00 -0.01 0.00 0.00 64.34 64.54 1req n VAL 467 Cb 0.00 -1.09 -0.10 0.00 -0.91 0.00 0.00 33.84 31.73 1req n VAL 467 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1req n ASN 468 N -2.45 1.14 -3.82 4.52 0.23 -0.83 -4.76 115.26 109.29 1req n ASN 468 Ca 0.00 -1.07 -0.13 0.00 -0.53 0.00 0.00 54.58 52.85 1req n ASN 468 Cb 0.00 0.93 -0.14 0.00 -2.08 0.00 0.00 39.78 38.48 1req n ASN 468 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1req s LYS 469 N -2.93 0.02 -1.12 -3.83 2.20 -1.23 -4.92 119.74 107.93 1req s LYS 469 Ca 0.09 0.14 -0.20 0.00 -0.36 0.00 0.00 55.97 55.64 1req s LYS 469 Cb 0.16 -0.09 -0.01 0.00 -1.51 0.00 0.00 37.83 36.38 1req s LYS 469 CO 0.83 -0.08 0.79 0.66 -0.36 0.00 0.00 175.35 177.20 1req n TYR 470 N 3.57 -1.95 -1.85 4.03 4.01 -1.26 -0.37 117.16 123.34 1req n TYR 470 Ca -0.19 0.48 -0.33 0.00 -0.16 0.00 0.00 57.90 57.70 1req n TYR 470 Cb 0.56 -3.45 0.03 0.00 -0.31 0.00 0.00 39.34 36.17 1req n TYR 470 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1req s ARG 471 N -5.84 3.01 0.61 -0.72 0.52 -1.26 -3.94 118.95 111.32 1req s ARG 471 Ca 0.46 1.28 -0.02 0.00 -0.52 0.00 0.00 55.73 56.93 1req s ARG 471 Cb -0.16 -1.98 0.04 0.00 0.52 0.00 0.00 34.95 33.37 1req s ARG 471 CO 0.86 -1.07 0.87 -0.51 0.02 0.00 0.00 175.30 175.47 1req s LEU 472 N -4.78 3.09 0.00 2.53 1.43 -1.26 -5.00 118.68 114.69 1req s LEU 472 Ca 0.65 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 1req s LEU 472 Cb -0.18 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.08 1req s LEU 472 CO 0.41 -1.33 0.00 -0.62 0.23 0.00 0.00 176.35 175.04 1req n GLU 473 N -2.57 0.00 -2.98 1.70 1.02 -1.26 -4.84 120.64 111.71 1req n GLU 473 Ca 0.08 0.06 -0.40 0.00 -0.02 0.00 0.00 57.16 56.88 1req n GLU 473 Cb 0.60 -0.50 -0.05 0.00 -0.02 0.00 0.00 31.44 31.48 1req n GLU 473 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1req s HIS 474 N -0.14 3.64 -0.37 -0.32 0.00 -1.26 -5.03 115.29 111.81 1req s HIS 474 Ca 0.00 1.38 -0.14 0.00 -3.00 0.00 0.00 55.06 53.30 1req s HIS 474 Cb 0.00 -2.85 0.00 0.00 -4.00 0.00 0.00 32.58 25.73 1req s HIS 474 CO 0.00 0.13 0.27 -1.21 -1.00 0.00 0.00 174.74 172.94 1req s GLU 475 N 0.56 3.24 0.33 -0.38 0.41 -1.26 -5.04 118.70 116.57 1req s GLU 475 Ca 0.40 -0.82 -0.29 0.00 -0.41 0.00 0.00 54.97 53.85 1req s GLU 475 Cb -0.19 -3.89 -0.12 0.00 -1.78 0.00 0.00 34.13 28.15 1req s GLU 475 CO 0.21 -0.60 1.49 -0.35 -0.49 0.00 0.00 175.26 175.52 1req n PRO 476 N 5.14 2.56 -1.40 0.39 -0.04 -1.26 -4.93 135.00 135.46 1req n PRO 476 Ca -0.12 0.90 -0.41 0.00 -0.04 0.00 0.00 63.50 63.84 1req n PRO 476 Cb 0.48 -2.62 0.01 0.00 -0.04 0.00 0.00 33.50 31.33 1req n PRO 476 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1req n PRO 477 N 1.13 0.38 -3.82 0.54 -0.01 -1.26 -4.99 135.00 126.98 1req n PRO 477 Ca 0.05 0.14 -0.24 0.00 -0.01 0.00 0.00 63.50 63.44 1req n PRO 477 Cb 0.37 -1.39 -0.17 0.00 -0.01 0.00 0.00 33.50 32.30 1req n PRO 477 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 175.50 174.32 1req s LEU 478 N 2.43 0.82 -0.26 2.45 2.96 -1.26 -5.09 118.68 120.73 1req s LEU 478 Ca 0.63 -0.19 -0.28 0.00 -0.22 0.00 0.00 54.13 54.07 1req s LEU 478 Cb -0.57 -0.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.50 1req s LEU 478 CO 0.59 -0.17 1.89 -1.81 -1.32 0.00 0.00 176.35 175.53 1req s ASP 479 N 1.88 5.89 0.27 3.68 1.11 -1.26 -4.98 116.67 123.25 1req s ASP 479 Ca 0.05 1.59 0.12 0.00 0.18 0.00 0.00 52.55 54.48 1req s ASP 479 Cb -0.13 -2.52 -0.05 0.00 1.07 0.00 0.00 42.92 41.29 1req s ASP 479 CO -0.06 -1.67 -0.20 0.68 1.18 0.00 0.00 175.17 175.10 1req s VAL 480 N 6.85 2.49 0.09 -1.27 -7.23 -1.26 -4.97 120.40 115.10 1req s VAL 480 Ca 0.84 -2.35 -0.30 0.00 -1.81 0.00 0.00 61.98 58.36 1req s VAL 480 Cb -0.27 -2.29 -0.06 0.00 0.56 0.00 0.00 36.38 34.32 1req s VAL 480 CO 0.34 -0.36 1.16 -0.22 -0.31 0.00 0.00 175.10 175.71 1req s LEU 481 N -3.41 4.40 -0.05 1.32 2.96 -1.25 -5.03 118.68 117.62 1req s LEU 481 Ca 0.29 2.03 0.03 0.00 -0.22 0.00 0.00 54.13 56.26 1req s LEU 481 Cb -0.05 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.05 1req s LEU 481 CO 0.14 -0.40 -0.14 -0.75 -1.32 0.00 0.00 176.35 173.88 1req s LYS 482 N 0.66 1.68 0.04 1.98 2.20 -1.26 -4.42 119.74 120.62 1req s LYS 482 Ca 0.56 -0.50 -0.20 0.00 -0.36 0.00 0.00 55.97 55.47 1req s LYS 482 Cb -0.29 -1.43 -0.06 0.00 -1.51 0.00 0.00 37.83 34.54 1req s LYS 482 CO 0.31 0.14 0.57 0.08 -0.36 0.00 0.00 175.35 176.09 1req s VAL 483 N 0.32 4.82 -0.40 4.02 1.01 -1.26 -5.07 120.40 123.84 1req s VAL 483 Ca -0.09 1.21 -0.17 0.00 0.00 0.00 0.00 61.98 62.94 1req s VAL 483 Cb -0.13 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1req s VAL 483 CO 0.03 0.50 0.42 -0.62 0.00 0.00 0.00 175.10 175.43 1req s ASP 484 N -0.73 6.19 0.10 3.32 2.15 -1.26 -5.02 116.67 121.42 1req s ASP 484 Ca 0.29 -0.54 -0.31 0.00 0.43 0.00 0.00 52.55 52.42 1req s ASP 484 Cb -0.19 -2.22 -0.13 0.00 -0.30 0.00 0.00 42.92 40.09 1req s ASP 484 CO 0.18 -0.51 1.51 0.78 -0.17 0.00 0.00 175.17 176.95 1req h ASN 485 N 8.65 -1.51 0.00 -0.34 -0.26 -1.94 -3.33 115.58 116.85 1req h ASN 485 Ca -0.27 0.17 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 1req h ASN 485 Cb 1.12 0.57 0.00 0.00 -1.06 0.00 0.00 38.32 38.95 1req h ASN 485 CO 0.77 -0.49 0.00 -0.24 -1.06 0.00 0.00 177.43 176.41 1req n SER 486 N -5.20 0.00 -0.26 5.81 2.88 -1.26 0.29 113.62 115.88 1req n SER 486 Ca -0.07 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.40 1req n SER 486 Cb 0.37 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.87 1req n SER 486 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1req h THR 487 N 0.00 1.26 0.78 2.46 2.02 -1.99 0.19 112.91 117.64 1req h THR 487 Ca 0.00 -0.92 -0.04 0.00 0.77 0.00 0.00 66.41 66.23 1req h THR 487 Cb 0.00 0.49 0.01 0.00 -1.74 0.00 0.00 68.15 66.91 1req h THR 487 CO 0.00 0.36 -0.38 0.58 0.37 0.00 0.00 175.52 176.45 1req h VAL 488 N 1.07 0.06 -0.47 3.16 2.07 -0.27 0.24 116.25 122.10 1req h VAL 488 Ca 0.23 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.63 1req h VAL 488 Cb 0.32 0.08 -0.10 0.00 -1.52 0.00 0.00 31.29 30.07 1req h VAL 488 CO -0.01 0.01 -0.38 0.25 0.02 0.00 0.00 177.57 177.46 1req h LEU 489 N -1.24 -1.29 -0.17 2.57 5.85 -0.70 0.02 115.31 120.35 1req h LEU 489 Ca -0.11 0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1req h LEU 489 Cb 0.82 0.59 -0.06 0.00 0.37 0.00 0.00 40.66 42.37 1req h LEU 489 CO 0.18 -0.34 -0.28 0.00 -0.34 0.00 0.00 178.44 177.67 1req h ALA 490 N 0.68 -0.25 -0.75 1.25 0.00 -0.61 0.19 119.26 119.76 1req h ALA 490 Ca 0.18 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1req h ALA 490 Cb 0.56 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1req h ALA 490 CO -0.61 -0.73 0.37 1.49 0.00 0.00 0.00 179.25 179.77 1req h GLU 491 N -0.32 1.07 -0.26 0.00 4.81 0.03 0.50 114.58 120.41 1req h GLU 491 Ca 0.11 -0.14 -0.14 0.00 -0.13 0.00 0.00 59.36 59.05 1req h GLU 491 Cb 0.50 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1req h GLU 491 CO -0.36 0.82 -0.40 1.96 -0.73 0.00 0.00 179.01 180.30 1req h GLN 492 N 1.06 0.74 0.00 1.92 1.08 -0.57 -1.65 115.11 117.70 1req h GLN 492 Ca 0.26 -0.44 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1req h GLN 492 Cb 0.09 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 1req h GLN 492 CO -0.04 1.06 -0.02 0.87 -0.95 0.00 0.00 178.83 179.75 1req h LYS 493 N 0.47 -0.04 -0.58 1.46 1.57 -0.75 -1.18 116.57 117.52 1req h LYS 493 Ca 0.03 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1req h LYS 493 Cb 0.99 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 1req h LYS 493 CO 0.09 -0.03 0.38 0.00 -0.57 0.00 0.00 179.45 179.33 1req h ALA 494 N 0.96 1.68 0.00 3.86 0.00 -0.88 0.30 119.26 125.17 1req h ALA 494 Ca 0.01 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1req h ALA 494 Cb 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1req h ALA 494 CO -0.02 0.27 -0.59 0.87 0.00 0.00 0.00 179.25 179.78 1req h LYS 495 N 0.70 0.00 -0.21 0.00 1.57 -1.14 -1.95 116.57 115.53 1req h LYS 495 Ca 0.23 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.83 1req h LYS 495 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1req h LYS 495 CO -0.06 0.59 -0.57 -0.07 -0.57 0.00 0.00 179.45 178.77 1req h LEU 496 N 0.00 0.75 0.22 2.94 3.38 0.08 -1.01 115.31 121.68 1req h LEU 496 Ca -0.01 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.56 1req h LEU 496 Cb 1.06 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1req h LEU 496 CO 0.08 1.16 -0.28 0.58 0.09 0.00 0.00 178.44 180.07 1req h VAL 497 N 0.51 0.41 -0.54 1.22 2.07 -0.88 -2.21 116.25 116.84 1req h VAL 497 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1req h VAL 497 Cb 1.14 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 1req h VAL 497 CO 0.11 0.00 0.19 0.50 0.02 0.00 0.00 177.57 178.39 1req h LYS 498 N -0.55 0.36 -0.29 1.57 3.64 -1.38 -2.90 116.57 117.02 1req h LYS 498 Ca 0.01 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1req h LYS 498 Cb 0.53 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1req h LYS 498 CO -0.10 0.24 0.18 1.25 -2.27 0.00 0.00 179.45 178.75 1req h LEU 499 N 0.37 0.31 -1.17 5.20 5.85 -0.92 -2.18 115.31 122.76 1req h LEU 499 Ca 0.26 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.90 1req h LEU 499 Cb 0.30 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1req h LEU 499 CO -0.27 0.22 -0.40 0.03 -0.34 0.00 0.00 178.44 177.68 1req h ARG 500 N 0.37 0.00 0.00 1.25 3.08 -1.23 -0.78 114.38 117.07 1req h ARG 500 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1req h ARG 500 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1req h ARG 500 CO -0.03 0.40 -0.22 0.00 -1.07 0.00 0.00 179.97 179.05 1req n ALA 501 N -2.42 2.65 0.04 0.04 0.00 -1.11 -3.43 120.51 116.27 1req n ALA 501 Ca -0.02 -0.15 0.10 0.00 0.00 0.00 0.00 53.44 53.37 1req n ALA 501 Cb 0.45 -1.35 -0.15 0.00 0.00 0.00 0.00 19.45 18.40 1req n ALA 501 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1req n GLU 502 N -1.86 0.60 -2.42 0.00 1.02 -0.82 -4.99 120.64 112.16 1req n GLU 502 Ca 0.06 -0.17 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 1req n GLU 502 Cb 0.39 -1.45 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1req n GLU 502 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1req s ARG 503 N -3.31 3.61 -0.36 3.49 1.70 -0.33 -5.03 118.95 118.73 1req s ARG 503 Ca -0.06 0.43 -0.24 0.00 -0.47 0.00 0.00 55.73 55.39 1req s ARG 503 Cb 0.12 -2.28 0.01 0.00 -0.57 0.00 0.00 34.95 32.24 1req s ARG 503 CO 0.80 -0.30 0.83 0.34 -1.08 0.00 0.00 175.30 175.90 1req s ASP 504 N -3.96 6.61 0.37 -2.89 -1.08 -1.26 -4.95 116.67 109.51 1req s ASP 504 Ca 0.51 0.48 0.04 0.00 -0.52 0.00 0.00 52.55 53.06 1req s ASP 504 Cb -0.10 -2.42 0.70 0.00 -1.46 0.00 0.00 42.92 39.64 1req s ASP 504 CO 0.45 -0.75 1.99 -0.65 0.52 0.00 0.00 175.17 176.73 1req h PRO 505 N 8.42 0.66 -0.10 4.34 0.11 -1.96 -2.92 132.00 140.55 1req h PRO 505 Ca -0.24 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.74 1req h PRO 505 Cb 1.09 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1req h PRO 505 CO 0.93 0.49 -0.22 1.05 -0.21 0.00 0.00 178.00 180.04 1req h GLU 506 N 0.67 0.33 -0.74 1.05 9.09 -2.00 -3.04 114.58 119.94 1req h GLU 506 Ca 0.17 -0.22 -0.03 0.00 0.05 0.00 0.00 59.36 59.33 1req h GLU 506 Cb 0.02 0.03 -0.03 0.00 -1.65 0.00 0.00 28.75 27.11 1req h GLU 506 CO -0.03 0.81 0.33 0.87 0.05 0.00 0.00 179.01 181.05 1req h LYS 507 N -0.12 1.08 -0.26 1.06 1.57 -1.94 -0.85 116.57 117.10 1req h LYS 507 Ca 0.00 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1req h LYS 507 Cb 0.81 -0.19 -0.07 0.00 0.08 0.00 0.00 32.23 32.86 1req h LYS 507 CO 0.05 0.86 -0.51 0.28 -0.57 0.00 0.00 179.45 179.56 1req h VAL 508 N 1.04 0.04 -0.72 0.50 2.07 -1.58 -0.09 116.25 117.52 1req h VAL 508 Ca 0.25 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.79 1req h VAL 508 Cb 0.16 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 1req h VAL 508 CO -0.03 0.00 0.46 0.50 0.02 0.00 0.00 177.57 178.53 1req h LYS 509 N -0.47 0.90 0.10 1.57 3.64 -1.42 0.19 116.57 121.08 1req h LYS 509 Ca 0.07 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1req h LYS 509 Cb 0.63 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1req h LYS 509 CO -0.50 0.60 -0.07 0.00 -2.27 0.00 0.00 179.45 177.20 1req h ALA 510 N 1.28 -0.16 -0.51 5.00 0.00 -0.49 0.39 119.26 124.77 1req h ALA 510 Ca 0.27 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1req h ALA 510 Cb -0.05 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1req h ALA 510 CO -0.08 -0.60 0.07 0.00 0.00 0.00 0.00 179.25 178.65 1req h ALA 511 N 0.73 1.16 -0.58 0.00 0.00 -0.84 0.23 119.26 119.96 1req h ALA 511 Ca -0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1req h ALA 511 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1req h ALA 511 CO -0.00 0.56 0.19 -0.07 0.00 0.00 0.00 179.25 179.93 1req h LEU 512 N 0.78 0.84 -1.00 0.00 3.38 -0.52 -2.22 115.31 116.56 1req h LEU 512 Ca 0.16 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1req h LEU 512 Cb 0.37 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1req h LEU 512 CO 0.01 0.82 -0.19 0.44 0.09 0.00 0.00 178.44 179.61 1req h ASP 513 N 0.82 0.49 -0.72 -0.43 3.32 0.45 -2.41 116.42 117.94 1req h ASP 513 Ca 0.19 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 57.11 1req h ASP 513 Cb 0.27 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 1req h ASP 513 CO -0.01 0.69 0.46 0.50 -1.72 0.00 0.00 179.24 179.17 1req h LYS 514 N 0.45 0.89 0.24 3.56 3.64 -0.18 -0.64 116.57 124.54 1req h LYS 514 Ca 0.07 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1req h LYS 514 Cb 0.59 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1req h LYS 514 CO 0.04 0.59 -0.32 0.82 -2.27 0.00 0.00 179.45 178.31 1req h ILE 515 N 0.92 0.33 -0.84 2.00 2.04 -1.03 0.11 117.51 121.04 1req h ILE 515 Ca 0.28 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.20 1req h ILE 515 Cb -0.03 0.33 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 1req h ILE 515 CO -0.09 0.00 0.52 0.74 0.00 0.00 0.00 178.15 179.32 1req h THR 516 N -0.62 1.05 0.16 -0.27 2.02 -1.28 0.17 112.91 114.13 1req h THR 516 Ca 0.00 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 66.87 1req h THR 516 Cb 0.60 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 1req h THR 516 CO -0.11 0.17 -0.27 -0.25 0.37 0.00 0.00 175.52 175.43 1req h TRP 517 N 0.95 -0.73 -0.51 3.16 7.01 -0.94 -0.71 115.95 124.18 1req h TRP 517 Ca 0.36 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.43 1req h TRP 517 Cb 0.15 0.30 -0.05 0.00 -2.10 0.00 0.00 29.16 27.47 1req h TRP 517 CO -0.04 -0.38 0.24 0.00 -2.79 0.00 0.00 178.44 175.48 1req h ALA 518 N 0.18 0.66 -0.56 2.65 0.00 -0.42 -0.61 119.26 121.16 1req h ALA 518 Ca 0.02 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1req h ALA 518 Cb 0.52 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 1req h ALA 518 CO -0.13 -0.12 -0.17 0.00 0.00 0.00 0.00 179.25 178.83 1req h ALA 519 N 1.29 0.31 0.00 0.00 0.00 -0.42 -1.77 119.26 118.67 1req h ALA 519 Ca 0.23 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 1req h ALA 519 Cb 0.17 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1req h ALA 519 CO -0.18 -0.47 -0.14 0.78 0.00 0.00 0.00 179.25 179.24 1req h GLY 520 N -0.04 0.00 -6.31 0.00 0.00 -0.64 -3.39 103.07 92.69 1req h GLY 520 Ca 0.27 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 47.00 1req h GLY 520 CO -0.60 0.00 -0.71 0.70 0.00 0.00 0.00 176.54 175.93 1req n ASN 521 N -3.61 2.70 -4.75 0.19 4.13 -0.28 -5.09 115.26 108.54 1req n ASN 521 Ca -0.01 -3.20 -0.41 0.00 1.68 0.00 0.00 54.58 52.63 1req n ASN 521 Cb 0.27 -0.67 -0.02 0.00 -1.54 0.00 0.00 39.78 37.82 1req n ASN 521 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1req s PRO 522 N -1.91 4.26 -0.23 3.52 0.04 -1.22 -4.81 135.00 134.65 1req s PRO 522 Ca 0.36 2.32 -0.03 0.00 0.04 0.00 0.00 61.00 63.68 1req s PRO 522 Cb 0.12 -3.10 0.10 0.00 0.04 0.00 0.00 34.50 31.65 1req s PRO 522 CO -0.07 -0.42 0.21 0.34 0.04 0.00 0.00 177.00 177.10 1req s ASP 523 N 0.32 1.78 0.36 6.66 2.15 -1.26 -5.04 116.67 121.64 1req s ASP 523 Ca 0.59 -0.49 0.27 0.00 0.43 0.00 0.00 52.55 53.35 1req s ASP 523 Cb -0.42 0.26 1.14 0.00 -0.30 0.00 0.00 42.92 43.60 1req s ASP 523 CO 0.44 -0.35 1.81 -2.24 -0.17 0.00 0.00 175.17 174.66 1req h ASP 524 N 8.32 0.00 0.23 -0.34 3.04 -1.93 -2.21 116.42 123.54 1req h ASP 524 Ca -0.16 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.63 1req h ASP 524 Cb 1.12 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.41 1req h ASP 524 CO 0.31 0.00 -0.23 0.29 -2.04 0.00 0.00 179.24 177.57 1req n LYS 525 N -2.51 0.88 -3.72 4.15 4.01 -1.26 -4.66 118.16 115.04 1req n LYS 525 Ca 0.01 -0.50 -0.38 0.00 -0.51 0.00 0.00 58.31 56.93 1req n LYS 525 Cb 0.24 -1.49 -0.12 0.00 -0.51 0.00 0.00 35.03 33.15 1req n LYS 525 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1req s ASP 526 N -2.47 5.38 0.43 4.39 2.15 -0.83 -4.98 116.67 120.73 1req s ASP 526 Ca 0.25 -1.24 0.14 0.00 0.43 0.00 0.00 52.55 52.13 1req s ASP 526 Cb 0.19 -1.89 0.94 0.00 -0.30 0.00 0.00 42.92 41.87 1req s ASP 526 CO 0.50 -0.37 1.96 -0.65 -0.17 0.00 0.00 175.17 176.45 1req h PRO 527 N 8.25 0.03 0.00 4.34 0.11 -1.83 -1.42 132.00 141.47 1req h PRO 527 Ca -0.23 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1req h PRO 527 Cb 1.08 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1req h PRO 527 CO 0.63 0.23 0.00 -0.44 -0.21 0.00 0.00 178.00 178.21 1req h ASP 528 N 0.03 0.00 0.09 -2.05 3.32 -1.95 -1.88 116.42 113.97 1req h ASP 528 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1req h ASP 528 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1req h ASP 528 CO 0.03 0.00 -0.16 -1.14 -1.72 0.00 0.00 179.24 176.24 1req n ARG 529 N -3.01 1.35 -1.63 3.56 0.63 -0.53 -4.80 116.66 112.22 1req n ARG 529 Ca -0.00 -0.88 -0.47 0.00 -0.92 0.00 0.00 57.85 55.58 1req n ARG 529 Cb 0.24 -1.48 -0.03 0.00 0.45 0.00 0.00 32.46 31.63 1req n ARG 529 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1req n ASN 530 N -0.06 2.17 -0.03 6.15 2.85 -0.71 -4.82 115.26 120.81 1req n ASN 530 Ca 0.14 1.14 0.01 0.00 -0.11 0.00 0.00 54.58 55.76 1req n ASN 530 Cb 0.39 -1.33 0.32 0.00 1.24 0.00 0.00 39.78 40.40 1req n ASN 530 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1req h LEU 531 N 4.03 0.55 -0.14 1.20 3.38 -1.91 0.79 115.31 123.20 1req h LEU 531 Ca -0.44 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.40 1req h LEU 531 Cb 1.30 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1req h LEU 531 CO 0.75 0.53 -0.15 0.25 0.09 0.00 0.00 178.44 179.91 1req h LEU 532 N 0.59 0.37 -0.62 1.67 5.85 -1.90 0.34 115.31 121.62 1req h LEU 532 Ca 0.14 -0.48 0.10 0.00 0.84 0.00 0.00 57.88 58.48 1req h LEU 532 Cb 0.18 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.03 1req h LEU 532 CO -0.01 0.78 0.22 0.50 -0.34 0.00 0.00 178.44 179.59 1req h LYS 533 N -0.03 0.38 0.00 1.25 3.11 -1.80 -0.86 116.57 118.61 1req h LYS 533 Ca 0.02 -0.02 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 1req h LYS 533 Cb 0.68 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.81 1req h LYS 533 CO 0.04 0.25 -0.52 -0.07 -2.81 0.00 0.00 179.45 176.34 1req h LEU 534 N 0.39 0.00 -0.50 5.20 3.38 -0.61 -2.54 115.31 120.62 1req h LEU 534 Ca 0.32 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 1req h LEU 534 Cb 0.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1req h LEU 534 CO -0.33 0.52 0.14 0.00 0.09 0.00 0.00 178.44 178.86 1req h ILE 536 N 0.69 0.36 -0.65 0.00 2.04 -0.93 0.39 117.51 119.41 1req h ILE 536 Ca 0.16 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.96 1req h ILE 536 Cb 0.31 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1req h ILE 536 CO -0.00 0.00 0.17 0.44 0.00 0.00 0.00 178.15 178.75 1req h ASP 537 N -0.05 0.98 -0.15 1.72 3.32 -1.28 -0.88 116.42 120.08 1req h ASP 537 Ca 0.27 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1req h ASP 537 Cb 0.46 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1req h ASP 537 CO -0.61 0.95 0.09 0.00 -1.72 0.00 0.00 179.24 177.95 1req h ALA 538 N 1.06 0.19 -0.56 3.45 0.00 -0.54 -1.84 119.26 121.03 1req h ALA 538 Ca 0.20 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1req h ALA 538 Cb 0.35 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1req h ALA 538 CO 0.00 -0.29 0.16 0.78 0.00 0.00 0.00 179.25 179.90 1req h GLY 539 N 0.17 0.90 2.00 0.00 0.00 -0.18 -1.35 103.07 104.61 1req h GLY 539 Ca 0.05 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 1req h GLY 539 CO -0.01 0.47 -0.18 -0.09 0.00 0.00 0.00 176.54 176.73 1req h ARG 540 N 0.81 0.00 -0.02 4.80 2.43 -1.02 -2.36 114.38 119.03 1req h ARG 540 Ca 0.18 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1req h ARG 540 Cb 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1req h ARG 540 CO -0.01 0.18 0.00 0.00 -1.51 0.00 0.00 179.97 178.64 1req n ALA 541 N -2.45 2.63 -2.20 2.80 0.00 -0.70 -4.90 120.51 115.69 1req n ALA 541 Ca -0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 53.44 53.16 1req n ALA 541 Cb 0.26 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1req n ALA 541 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1req n MET 542 N -0.69 -0.62 -2.23 0.00 2.81 -0.89 -4.53 117.12 110.97 1req n MET 542 Ca 0.18 0.23 -0.33 0.00 -1.81 0.00 0.00 57.70 55.97 1req n MET 542 Cb 0.13 -3.90 -0.01 0.00 -0.71 0.00 0.00 33.22 28.72 1req n MET 542 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1req s ALA 543 N -2.37 2.85 0.60 3.04 0.00 -0.60 -4.93 121.76 120.36 1req s ALA 543 Ca 0.02 0.38 -0.02 0.00 0.00 0.00 0.00 51.96 52.33 1req s ALA 543 Cb -0.01 -3.21 0.04 0.00 0.00 0.00 0.00 23.12 19.94 1req s ALA 543 CO 0.03 -0.56 0.87 0.95 0.00 0.00 0.00 175.76 177.04 1req s THR 544 N -2.41 2.73 0.09 0.00 -4.23 -1.26 -4.60 115.64 105.95 1req s THR 544 Ca 0.63 -0.43 -0.23 0.00 -1.18 0.00 0.00 61.69 60.47 1req s THR 544 Cb -0.14 -3.09 -0.15 0.00 1.34 0.00 0.00 72.50 70.46 1req s THR 544 CO 0.32 -0.08 1.73 0.58 -0.54 0.00 0.00 174.62 176.63 1req h VAL 545 N -0.18 0.99 -0.56 2.29 2.07 -0.78 -1.26 116.25 118.81 1req h VAL 545 Ca -0.44 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 67.17 1req h VAL 545 Cb 1.30 1.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.96 1req h VAL 545 CO 0.56 0.01 -0.20 1.23 0.02 0.00 0.00 177.57 179.19 1req h GLY 546 N -0.04 0.25 0.92 2.17 0.00 -1.82 -1.48 103.07 103.07 1req h GLY 546 Ca -0.00 0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.56 1req h GLY 546 CO 0.00 -0.22 0.10 0.83 0.00 0.00 0.00 176.54 177.25 1req h GLU 547 N -0.07 0.57 -0.81 4.80 5.08 -1.82 0.03 114.58 122.36 1req h GLU 547 Ca 0.26 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1req h GLU 547 Cb 0.47 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 1req h GLU 547 CO -0.61 0.60 0.49 0.52 -1.00 0.00 0.00 179.01 179.01 1req h MET 548 N 0.43 1.09 -0.42 2.33 2.86 -1.25 0.10 114.93 120.07 1req h MET 548 Ca 0.11 -0.09 -0.11 0.00 -2.06 0.00 0.00 59.70 57.56 1req h MET 548 Cb 0.28 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1req h MET 548 CO -0.00 0.76 -0.15 0.77 1.06 0.00 0.00 176.91 179.35 1req h SER 549 N 1.11 0.86 -0.49 1.22 0.02 -0.90 -2.85 113.55 112.51 1req h SER 549 Ca 0.29 -0.38 -0.11 0.00 -0.84 0.00 0.00 61.79 60.75 1req h SER 549 Cb -0.06 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1req h SER 549 CO -0.06 1.05 -0.11 0.44 -1.14 0.00 0.00 176.83 177.01 1req h ASP 550 N 0.66 0.94 -0.67 3.07 3.32 -0.77 -0.57 116.42 122.41 1req h ASP 550 Ca 0.10 -0.36 0.13 0.00 0.02 0.00 0.00 57.03 56.92 1req h ASP 550 Cb 0.70 -0.26 -0.09 0.00 0.22 0.00 0.00 39.33 39.90 1req h ASP 550 CO 0.05 1.08 0.19 0.00 -1.72 0.00 0.00 179.24 178.84 1req h ALA 551 N 0.89 0.85 -0.57 3.45 0.00 -0.84 0.32 119.26 123.37 1req h ALA 551 Ca 0.13 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1req h ALA 551 Cb 0.66 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1req h ALA 551 CO 0.05 -0.28 0.32 -0.07 0.00 0.00 0.00 179.25 179.27 1req h LEU 552 N 0.32 0.71 -1.57 0.00 3.38 -1.49 -3.32 115.31 113.34 1req h LEU 552 Ca 0.36 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 1req h LEU 552 Cb 0.54 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1req h LEU 552 CO -0.42 0.59 0.04 -0.08 0.09 0.00 0.00 178.44 178.67 1req h GLU 553 N 0.77 0.32 -0.98 1.13 4.81 0.72 -1.43 114.58 119.91 1req h GLU 553 Ca 0.20 -0.04 0.19 0.00 -0.13 0.00 0.00 59.36 59.58 1req h GLU 553 Cb 0.03 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.26 1req h GLU 553 CO -0.03 0.31 0.61 0.87 -0.73 0.00 0.00 179.01 180.04 1req h LYS 554 N 0.32 0.66 0.06 1.92 1.57 -1.47 0.59 116.57 120.22 1req h LYS 554 Ca 0.08 -0.04 -0.36 0.00 -1.87 0.00 0.00 60.65 58.46 1req h LYS 554 Cb 0.15 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1req h LYS 554 CO -0.00 0.44 -2.10 0.28 -0.57 0.00 0.00 179.45 177.49 1req n VAL 555 N -4.68 1.65 0.07 0.50 0.31 -0.98 -4.62 118.33 110.57 1req n VAL 555 Ca 0.22 -0.68 0.08 0.00 -0.01 0.00 0.00 64.34 63.95 1req n VAL 555 Cb 0.60 -1.42 -0.05 0.00 -0.91 0.00 0.00 33.84 32.06 1req n VAL 555 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1req n PHE 556 N -3.28 0.84 -0.33 3.52 3.72 -0.58 -5.02 117.46 116.33 1req n PHE 556 Ca -0.33 0.26 0.04 0.00 -0.05 0.00 0.00 57.45 57.37 1req n PHE 556 Cb 1.04 -0.94 -0.02 0.00 -0.94 0.00 0.00 39.48 38.62 1req n PHE 556 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1req n GLY 557 N 1.26 -2.77 3.89 1.37 0.00 0.20 -4.55 105.19 104.60 1req n GLY 557 Ca -0.04 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.28 1req n GLY 557 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1req s ARG 558 N -3.25 3.54 0.35 1.61 3.52 -1.26 -4.29 118.95 119.16 1req s ARG 558 Ca 0.00 -0.15 -0.18 0.00 -0.13 0.00 0.00 55.73 55.27 1req s ARG 558 Cb 0.00 -3.07 -0.10 0.00 -1.56 0.00 0.00 34.95 30.23 1req s ARG 558 CO 0.00 0.64 0.81 -0.47 -0.81 0.00 0.00 175.30 175.47 1req s TYR 559 N -1.33 3.39 -0.11 5.12 5.04 -0.12 -4.76 117.35 124.57 1req s TYR 559 Ca 0.28 1.37 0.01 0.00 -2.44 0.00 0.00 57.07 56.29 1req s TYR 559 Cb -0.13 -2.65 0.02 0.00 0.35 0.00 0.00 41.96 39.55 1req s TYR 559 CO 0.17 0.06 -0.12 0.99 -1.34 0.00 0.00 175.55 175.31 1req s THR 560 N -1.99 1.33 0.67 4.34 2.01 -1.26 -4.97 115.64 115.77 1req s THR 560 Ca 0.55 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.92 1req s THR 560 Cb -0.11 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.14 1req s THR 560 CO 0.17 0.41 1.07 0.00 -0.69 0.00 0.00 174.62 175.58 1req s ALA 561 N 1.25 2.98 -0.20 7.40 0.00 -1.26 -5.07 121.76 126.85 1req s ALA 561 Ca -0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 51.96 51.58 1req s ALA 561 Cb -0.14 -3.04 -0.05 0.00 0.00 0.00 0.00 23.12 19.89 1req s ALA 561 CO -0.05 -0.97 0.15 -1.14 0.00 0.00 0.00 175.76 173.75 1req s GLN 562 N -5.29 4.18 -0.04 0.00 0.74 -1.26 -5.05 119.66 112.94 1req s GLN 562 Ca 0.57 -0.19 -0.26 0.00 0.05 0.00 0.00 55.36 55.54 1req s GLN 562 Cb -0.11 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.53 1req s GLN 562 CO 0.52 0.26 0.79 0.42 -0.55 0.00 0.00 175.29 176.74 1req s ILE 563 N 0.46 4.97 -0.04 -2.34 -1.09 -1.26 -5.04 121.20 116.87 1req s ILE 563 Ca 0.09 1.64 0.01 0.00 -2.23 0.00 0.00 60.65 60.16 1req s ILE 563 Cb -0.12 -4.13 0.02 0.00 -1.58 0.00 0.00 42.46 36.66 1req s ILE 563 CO -0.01 0.23 -0.02 -0.13 -1.23 0.00 0.00 174.94 173.78 1req s ARG 564 N 0.80 0.57 -0.06 2.79 0.52 -1.26 -5.14 118.95 117.17 1req s ARG 564 Ca 0.42 -0.02 0.05 0.00 -0.52 0.00 0.00 55.73 55.66 1req s ARG 564 Cb -0.19 -0.66 -0.02 0.00 0.52 0.00 0.00 34.95 34.60 1req s ARG 564 CO 0.21 -0.11 -0.22 0.99 0.02 0.00 0.00 175.30 176.20 1req s THR 565 N 0.96 2.34 0.96 0.02 2.01 -1.26 -4.99 115.64 115.68 1req s THR 565 Ca -0.11 -0.97 -0.13 0.00 0.31 0.00 0.00 61.69 60.80 1req s THR 565 Cb -0.14 -1.87 0.17 0.00 0.01 0.00 0.00 72.50 70.66 1req s THR 565 CO -0.01 0.57 1.12 0.27 -0.69 0.00 0.00 174.62 175.88 1req s ILE 566 N -0.28 1.99 -0.04 1.82 -4.36 -1.26 -5.08 121.20 113.98 1req s ILE 566 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 60.65 60.27 1req s ILE 566 Cb -0.13 -2.64 0.02 0.00 1.25 0.00 0.00 42.46 40.96 1req s ILE 566 CO 0.03 0.00 0.29 -0.94 0.24 0.00 0.00 174.94 174.56 1req s SER 567 N -3.81 -0.21 -0.68 4.36 1.04 -1.26 -4.69 113.70 108.45 1req s SER 567 Ca 0.65 0.21 0.00 0.00 0.48 0.00 0.00 55.95 57.29 1req s SER 567 Cb -0.16 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.36 1req s SER 567 CO 0.55 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.04 1req n GLY 568 N 1.77 0.74 0.11 7.32 0.00 -1.26 -4.92 105.19 108.94 1req n GLY 568 Ca -0.19 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.50 1req n GLY 568 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1req h VAL 569 N 0.00 1.19 0.55 1.61 2.07 -1.93 -3.29 116.25 116.45 1req h VAL 569 Ca -0.13 -2.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.03 1req h VAL 569 Cb 0.83 2.74 0.01 0.00 -1.52 0.00 0.00 31.29 33.35 1req h VAL 569 CO 0.19 0.57 -0.26 0.22 0.02 0.00 0.00 177.57 178.31 1req h TYR 570 N -0.67 -0.68 -0.15 1.57 5.03 -1.91 -1.52 116.97 118.64 1req h TYR 570 Ca -0.24 -0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.08 1req h TYR 570 Cb 1.45 0.23 -0.03 0.00 1.55 0.00 0.00 36.73 39.93 1req h TYR 570 CO 0.16 -0.37 -0.01 0.66 -1.32 0.00 0.00 178.16 177.27 1req h SER 571 N -0.87 -0.09 -0.68 -2.11 4.64 -1.92 -3.08 113.55 109.44 1req h SER 571 Ca -0.08 0.04 0.06 0.00 -0.47 0.00 0.00 61.79 61.34 1req h SER 571 Cb 0.62 0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 62.72 1req h SER 571 CO 0.12 -0.02 0.39 0.11 -0.87 0.00 0.00 176.83 176.56 1req h LYS 572 N 0.03 0.70 0.02 4.77 6.56 -1.62 -3.24 116.57 123.79 1req h LYS 572 Ca 0.07 -0.04 0.02 0.00 -1.06 0.00 0.00 60.65 59.64 1req h LYS 572 Cb 0.10 -0.16 -0.05 0.00 -0.57 0.00 0.00 32.23 31.54 1req h LYS 572 CO -0.13 0.46 -0.51 1.49 -2.06 0.00 0.00 179.45 178.69 1req h GLU 573 N 0.72 -0.65 -4.15 3.15 4.57 -1.17 -3.30 114.58 113.75 1req h GLU 573 Ca 0.30 0.04 -0.67 0.00 -1.18 0.00 0.00 59.36 57.85 1req h GLU 573 Cb 0.17 0.15 -0.38 0.00 -0.16 0.00 0.00 28.75 28.52 1req h GLU 573 CO -0.17 -0.43 -0.59 0.08 -1.18 0.00 0.00 179.01 176.71 1req s VAL 574 N -5.78 2.86 0.78 0.32 1.01 -1.22 -4.99 120.40 113.39 1req s VAL 574 Ca -0.16 -2.60 -0.11 0.00 0.00 0.00 0.00 61.98 59.11 1req s VAL 574 Cb 0.07 -2.99 0.06 0.00 0.00 0.00 0.00 36.38 33.52 1req s VAL 574 CO 0.62 -0.72 1.10 -0.54 0.00 0.00 0.00 175.10 175.56 1req s LYS 575 N 0.53 2.11 -1.42 2.72 3.01 -1.25 -4.36 119.74 121.08 1req s LYS 575 Ca 0.13 1.26 -0.06 0.00 -1.01 0.00 0.00 55.97 56.29 1req s LYS 575 Cb -0.22 -1.87 0.04 0.00 -1.01 0.00 0.00 37.83 34.77 1req s LYS 575 CO -0.04 -1.76 0.79 0.09 0.51 0.00 0.00 175.35 174.93 1req n ASN 576 N -3.51 -2.59 -4.82 2.83 3.02 -1.26 -5.00 115.26 103.93 1req n ASN 576 Ca 0.10 -0.83 -0.36 0.00 -0.03 0.00 0.00 54.58 53.46 1req n ASN 576 Cb 0.53 -3.84 -0.06 0.00 -0.61 0.00 0.00 39.78 35.79 1req n ASN 576 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1req s THR 577 N -3.54 4.65 0.16 3.41 2.01 -1.26 -5.00 115.64 116.06 1req s THR 577 Ca 0.29 1.17 -0.18 0.00 0.31 0.00 0.00 61.69 63.29 1req s THR 577 Cb -0.15 -3.84 0.07 0.00 0.01 0.00 0.00 72.50 68.59 1req s THR 577 CO 0.83 0.25 1.67 -0.65 -0.69 0.00 0.00 174.62 176.03 1req h PRO 578 N 3.55 -0.01 -0.02 4.92 0.11 -1.98 -2.46 132.00 136.11 1req h PRO 578 Ca -0.48 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.47 1req h PRO 578 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1req h PRO 578 CO 0.65 -0.01 -0.71 0.93 -0.21 0.00 0.00 178.00 178.65 1req h GLU 579 N -0.01 0.12 -0.18 1.05 3.07 -1.98 -2.53 114.58 114.11 1req h GLU 579 Ca 0.17 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1req h GLU 579 Cb 0.27 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 1req h GLU 579 CO -0.37 0.78 0.11 0.28 -1.40 0.00 0.00 179.01 178.41 1req h VAL 580 N 0.08 1.06 -0.46 3.13 2.07 -1.87 -1.22 116.25 119.04 1req h VAL 580 Ca -0.02 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1req h VAL 580 Cb 1.26 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1req h VAL 580 CO 0.10 0.06 0.19 -0.08 0.02 0.00 0.00 177.57 177.86 1req h GLU 581 N 0.22 0.68 -0.66 1.57 4.57 -1.46 -0.29 114.58 119.22 1req h GLU 581 Ca 0.06 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1req h GLU 581 Cb -0.00 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.44 1req h GLU 581 CO -0.01 0.61 0.38 1.49 -1.18 0.00 0.00 179.01 180.29 1req h GLU 582 N 0.60 0.91 -0.07 1.92 4.81 -1.33 -1.28 114.58 120.15 1req h GLU 582 Ca 0.15 -0.10 -0.18 0.00 -0.13 0.00 0.00 59.36 59.11 1req h GLU 582 Cb 0.17 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1req h GLU 582 CO -0.01 0.67 -0.73 0.00 -0.73 0.00 0.00 179.01 178.21 1req h ALA 583 N 1.19 0.62 -0.32 2.92 0.00 -1.06 -1.96 119.26 120.65 1req h ALA 583 Ca 0.24 -0.61 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1req h ALA 583 Cb 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1req h ALA 583 CO -0.04 0.77 0.10 0.00 0.00 0.00 0.00 179.25 180.08 1req h ARG 584 N 0.25 0.50 -0.13 0.00 3.08 -0.91 -1.58 114.38 115.58 1req h ARG 584 Ca -0.03 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1req h ARG 584 Cb 1.30 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.25 1req h ARG 584 CO 0.12 0.54 -0.01 0.93 -1.07 0.00 0.00 179.97 180.48 1req h GLU 585 N 0.36 0.03 -1.00 0.04 5.08 -1.19 -0.85 114.58 117.05 1req h GLU 585 Ca 0.10 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.51 1req h GLU 585 Cb 0.25 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.43 1req h GLU 585 CO -0.00 0.02 0.65 -0.07 -1.00 0.00 0.00 179.01 178.61 1req h LEU 586 N 0.03 1.07 -0.53 1.33 3.38 -1.32 0.16 115.31 119.43 1req h LEU 586 Ca 0.06 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1req h LEU 586 Cb 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1req h LEU 586 CO -0.11 0.71 0.21 0.58 0.09 0.00 0.00 178.44 179.91 1req h VAL 587 N 1.23 1.22 -0.57 1.22 2.07 -0.90 -0.85 116.25 119.67 1req h VAL 587 Ca 0.41 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1req h VAL 587 Cb 0.08 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1req h VAL 587 CO -0.15 0.26 0.26 -0.33 0.02 0.00 0.00 177.57 177.64 1req h GLU 588 N 0.72 0.82 -0.99 1.57 5.08 -0.63 -1.90 114.58 119.26 1req h GLU 588 Ca 0.18 -0.13 0.09 0.00 -1.00 0.00 0.00 59.36 58.50 1req h GLU 588 Cb 0.21 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 1req h GLU 588 CO -0.01 0.68 0.63 0.93 -1.00 0.00 0.00 179.01 180.24 1req h GLU 589 N 0.77 1.05 -0.17 2.33 5.08 -0.95 -1.09 114.58 121.60 1req h GLU 589 Ca 0.19 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1req h GLU 589 Cb 0.14 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1req h GLU 589 CO -0.02 0.69 0.08 0.35 -1.00 0.00 0.00 179.01 179.11 1req h PHE 590 N 1.08 0.14 -0.58 4.33 3.04 -0.83 0.75 116.94 124.87 1req h PHE 590 Ca 0.46 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.47 1req h PHE 590 Cb 0.31 -0.04 -0.05 0.00 2.56 0.00 0.00 35.95 38.73 1req h PHE 590 CO -0.01 0.08 0.30 1.49 -2.02 0.00 0.00 178.31 178.16 1req h GLU 591 N 0.17 0.56 -0.55 1.11 4.81 -0.41 0.14 114.58 120.40 1req h GLU 591 Ca 0.07 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1req h GLU 591 Cb 0.02 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1req h GLU 591 CO -0.05 0.37 0.15 1.96 -0.73 0.00 0.00 179.01 180.70 1req h GLN 592 N 0.57 0.88 0.05 1.92 4.20 -1.27 0.71 115.11 122.17 1req h GLN 592 Ca 0.26 -0.21 -0.23 0.00 0.06 0.00 0.00 58.65 58.53 1req h GLN 592 Cb 0.17 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1req h GLN 592 CO -0.18 0.82 -1.03 0.00 -0.67 0.00 0.00 178.83 177.77 1req h ALA 593 N 1.02 0.32 0.00 3.87 0.00 -0.68 -3.38 119.26 120.42 1req h ALA 593 Ca 0.18 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1req h ALA 593 Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1req h ALA 593 CO -0.00 0.96 -1.45 0.39 0.00 0.00 0.00 179.25 179.15 1req n GLU 594 N -3.59 0.86 -0.10 0.00 -0.58 0.48 -5.03 120.64 112.68 1req n GLU 594 Ca -0.05 -0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 1req n GLU 594 Cb 0.91 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.46 1req n GLU 594 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1req n GLY 595 N 1.59 0.54 3.53 0.62 0.00 0.25 -5.02 105.19 106.70 1req n GLY 595 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1req n GLY 595 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1req s ARG 596 N -0.85 0.76 0.66 1.61 1.70 -1.17 -5.01 118.95 116.66 1req s ARG 596 Ca 0.00 -0.12 -0.18 0.00 -0.47 0.00 0.00 55.73 54.97 1req s ARG 596 Cb 0.00 0.36 -0.00 0.00 -0.57 0.00 0.00 34.95 34.73 1req s ARG 596 CO 0.00 -0.30 1.27 0.54 -1.08 0.00 0.00 175.30 175.73 1req n ARG 597 N 0.15 1.02 -1.89 3.89 1.74 -1.26 -3.86 116.66 116.45 1req n ARG 597 Ca -0.10 0.41 -0.42 0.00 -0.77 0.00 0.00 57.85 56.97 1req n ARG 597 Cb 0.60 -2.51 -0.03 0.00 -1.02 0.00 0.00 32.46 29.50 1req n ARG 597 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1req s PRO 598 N -3.42 4.19 -0.18 5.56 0.04 -1.26 -4.76 135.00 135.18 1req s PRO 598 Ca 0.82 2.38 -0.06 0.00 0.04 0.00 0.00 61.00 64.18 1req s PRO 598 Cb -0.37 -3.56 -0.03 0.00 0.04 0.00 0.00 34.50 30.57 1req s PRO 598 CO 0.41 -0.74 0.03 0.50 0.04 0.00 0.00 177.00 177.24 1req s ARG 599 N 2.53 3.84 -0.04 4.56 3.52 -1.26 -1.51 118.95 130.58 1req s ARG 599 Ca 0.75 -0.42 0.04 0.00 -0.13 0.00 0.00 55.73 55.97 1req s ARG 599 Cb -0.41 -3.11 -0.00 0.00 -1.56 0.00 0.00 34.95 29.86 1req s ARG 599 CO 0.33 0.22 -0.17 -1.50 -0.81 0.00 0.00 175.30 173.37 1req s ILE 600 N 0.47 1.40 -0.31 4.11 2.07 0.73 -1.07 121.20 128.60 1req s ILE 600 Ca 0.01 -0.70 -0.14 0.00 -1.41 0.00 0.00 60.65 58.41 1req s ILE 600 Cb -0.13 -1.21 -0.03 0.00 0.13 0.00 0.00 42.46 41.22 1req s ILE 600 CO 0.01 0.41 0.30 -0.22 -1.91 0.00 0.00 174.94 173.54 1req s LEU 601 N 0.06 4.26 -0.49 8.50 2.96 -0.73 -0.69 118.68 132.55 1req s LEU 601 Ca -0.04 -0.08 -0.20 0.00 -0.22 0.00 0.00 54.13 53.59 1req s LEU 601 Cb -0.11 -2.28 0.05 0.00 0.50 0.00 0.00 46.19 44.35 1req s LEU 601 CO 0.02 -0.22 0.65 -0.76 -1.32 0.00 0.00 176.35 174.72 1req s LEU 602 N 1.92 4.79 -0.03 -0.68 1.43 -0.53 -0.18 118.68 125.41 1req s LEU 602 Ca 0.11 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 1req s LEU 602 Cb -0.16 -2.53 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 1req s LEU 602 CO 0.11 -0.88 -0.02 0.00 0.23 0.00 0.00 176.35 175.79 1req s ALA 603 N 2.76 3.21 -0.31 4.21 0.00 -0.31 -0.72 121.76 130.60 1req s ALA 603 Ca 0.18 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 1req s ALA 603 Cb -0.17 -1.33 0.06 0.00 0.00 0.00 0.00 23.12 21.67 1req s ALA 603 CO 0.14 0.62 0.01 0.15 0.00 0.00 0.00 175.76 176.68 1req s LYS 604 N -1.29 2.31 0.09 0.00 -0.14 -1.26 -2.07 119.74 117.38 1req s LYS 604 Ca 0.17 -1.37 0.05 0.00 -1.36 0.00 0.00 55.97 53.46 1req s LYS 604 Cb -0.11 -3.18 -0.04 0.00 -1.68 0.00 0.00 37.83 32.81 1req s LYS 604 CO 0.07 -0.68 -0.01 -1.64 -0.76 0.00 0.00 175.35 172.33 1req s MET 605 N 1.20 2.51 1.56 1.68 -1.94 -1.26 -2.77 119.30 120.28 1req s MET 605 Ca -0.03 -0.86 0.00 0.00 -1.71 0.00 0.00 55.69 53.09 1req s MET 605 Cb -0.20 -2.52 0.00 0.00 2.01 0.00 0.00 34.83 34.12 1req s MET 605 CO -0.02 0.54 0.00 0.41 -0.01 0.00 0.00 175.02 175.93 1req n GLY 606 N 0.56 -1.53 0.03 -0.03 0.00 -0.38 -4.20 105.19 99.63 1req n GLY 606 Ca -0.11 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.56 1req n GLY 606 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1req n GLN 607 N 0.00 0.16 -0.71 1.61 1.13 -1.26 -3.88 117.38 114.42 1req n GLN 607 Ca 0.00 0.02 -0.32 0.00 -1.94 0.00 0.00 57.00 54.77 1req n GLN 607 Cb 0.00 -1.58 -0.06 0.00 0.11 0.00 0.00 30.24 28.71 1req n GLN 607 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1req n ASP 608 N -1.80 0.45 -1.10 1.08 -0.08 -1.26 -4.85 116.55 108.99 1req n ASP 608 Ca 0.04 0.43 0.08 0.00 -1.51 0.00 0.00 54.79 53.83 1req n ASP 608 Cb 0.39 -0.45 0.26 0.00 2.34 0.00 0.00 41.12 43.67 1req n ASP 608 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1req n GLY 609 N 3.21 2.94 3.75 0.27 0.00 -1.26 -4.63 105.19 109.46 1req n GLY 609 Ca 0.24 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1req n GLY 609 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1req s HIS 610 N -1.58 3.10 0.00 1.61 3.76 -1.26 -4.69 115.29 116.23 1req s HIS 610 Ca 0.39 1.25 0.00 0.00 -0.15 0.00 0.00 55.06 56.55 1req s HIS 610 Cb 0.25 -3.70 0.00 0.00 1.11 0.00 0.00 32.58 30.24 1req s HIS 610 CO 0.20 -2.09 0.00 -0.40 -0.85 0.00 0.00 174.74 171.61 1req n ASP 611 N 1.76 0.00 0.04 1.40 5.68 -1.26 -4.83 116.55 119.34 1req n ASP 611 Ca 0.04 -1.00 -0.11 0.00 -0.50 0.00 0.00 54.79 53.22 1req n ASP 611 Cb 0.42 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.35 1req n ASP 611 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1req h ARG 612 N 0.00 -0.39 -0.08 0.11 2.43 -1.92 0.11 114.38 114.64 1req h ARG 612 Ca 0.00 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1req h ARG 612 Cb 0.51 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.10 1req h ARG 612 CO 0.00 -0.26 -0.14 0.78 -1.51 0.00 0.00 179.97 178.84 1req h GLY 613 N -0.40 -0.10 0.96 2.80 0.00 -1.98 -1.52 103.07 102.82 1req h GLY 613 Ca 0.08 0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.58 1req h GLY 613 CO -0.28 -0.14 0.14 -1.61 0.00 0.00 0.00 176.54 174.65 1req h GLN 614 N -0.19 0.29 -0.47 4.80 4.15 -1.83 -2.00 115.11 119.86 1req h GLN 614 Ca 0.08 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.39 1req h GLN 614 Cb 0.30 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 1req h GLN 614 CO -0.20 0.19 -0.07 0.87 -1.93 0.00 0.00 178.83 177.69 1req h LYS 615 N 0.30 0.88 -0.02 1.69 1.79 -0.71 -1.21 116.57 119.29 1req h LYS 615 Ca 0.09 -0.31 -0.17 0.00 -2.18 0.00 0.00 60.65 58.07 1req h LYS 615 Cb -0.01 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 1req h LYS 615 CO -0.04 0.95 -0.77 -0.24 -1.08 0.00 0.00 179.45 178.28 1req h VAL 616 N 0.72 1.46 0.21 0.50 3.04 -1.19 -1.24 116.25 119.75 1req h VAL 616 Ca 0.12 -2.39 -0.01 0.00 -1.01 0.00 0.00 66.70 63.41 1req h VAL 616 Cb 0.60 2.29 0.00 0.00 -2.01 0.00 0.00 31.29 32.18 1req h VAL 616 CO 0.04 0.70 -0.10 0.40 -1.01 0.00 0.00 177.57 177.59 1req h ILE 617 N 0.12 0.81 -0.33 3.17 1.08 -1.41 -1.62 117.51 119.32 1req h ILE 617 Ca -0.03 -0.07 0.07 0.00 -0.39 0.00 0.00 64.86 64.44 1req h ILE 617 Cb 1.35 0.85 -0.06 0.00 -3.07 0.00 0.00 36.82 35.88 1req h ILE 617 CO 0.12 0.02 -0.08 0.00 -0.69 0.00 0.00 178.15 177.51 1req h ALA 618 N 0.48 0.22 -0.24 1.87 0.00 -1.03 0.11 119.26 120.67 1req h ALA 618 Ca -0.03 0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1req h ALA 618 Cb 0.24 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1req h ALA 618 CO 0.05 -0.46 -0.38 0.00 0.00 0.00 0.00 179.25 178.46 1req h THR 619 N 0.00 1.31 -0.13 0.00 1.03 -1.28 -2.22 112.91 111.64 1req h THR 619 Ca 0.16 -1.58 -0.11 0.00 -0.01 0.00 0.00 66.41 64.87 1req h THR 619 Cb 0.24 1.74 -0.01 0.00 -1.07 0.00 0.00 68.15 69.05 1req h THR 619 CO -0.34 0.50 -0.43 0.00 -0.01 0.00 0.00 175.52 175.24 1req h ALA 620 N 0.65 1.05 -0.12 0.00 0.00 -1.19 -1.79 119.26 117.86 1req h ALA 620 Ca 0.02 -0.43 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1req h ALA 620 Cb 0.97 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1req h ALA 620 CO 0.09 0.61 -0.66 1.88 0.00 0.00 0.00 179.25 181.17 1req h TYR 621 N 0.24 0.61 -0.52 0.00 -1.99 -1.02 -2.27 116.97 112.02 1req h TYR 621 Ca 0.02 -0.25 -0.09 0.00 2.00 0.00 0.00 58.73 60.41 1req h TYR 621 Cb 0.85 -0.10 -0.02 0.00 2.00 0.00 0.00 36.73 39.46 1req h TYR 621 CO 0.02 0.99 -0.04 0.00 -0.00 0.00 0.00 178.16 179.13 1req h ALA 622 N 0.95 0.96 0.00 3.88 0.00 -1.22 -1.04 119.26 122.78 1req h ALA 622 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1req h ALA 622 Cb 1.22 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1req h ALA 622 CO 0.12 0.62 0.00 -0.44 0.00 0.00 0.00 179.25 179.55 1req h ASP 623 N 0.83 0.00 0.11 0.00 3.32 -1.14 -2.22 116.42 117.32 1req h ASP 623 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1req h ASP 623 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1req h ASP 623 CO 0.03 0.00 -0.54 0.18 -1.72 0.00 0.00 179.24 177.19 1req n LEU 624 N -3.07 1.36 0.00 1.55 4.77 -0.87 -4.96 117.00 115.78 1req n LEU 624 Ca -0.02 -0.48 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1req n LEU 624 Cb 0.16 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1req n LEU 624 CO 0.23 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1req n GLY 625 N 1.43 1.04 3.82 -0.72 0.00 -0.84 -4.31 105.19 105.62 1req n GLY 625 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1req n GLY 625 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1req s PHE 626 N -2.00 3.26 -0.31 1.61 0.40 -0.44 -4.64 117.98 115.86 1req s PHE 626 Ca 0.00 1.52 -0.21 0.00 -0.60 0.00 0.00 56.93 57.64 1req s PHE 626 Cb 0.00 -2.89 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1req s PHE 626 CO 0.00 -0.56 0.66 -0.51 0.70 0.00 0.00 175.22 175.51 1req s ASP 627 N -2.71 6.52 -0.20 1.36 1.01 -0.57 -4.34 116.67 117.74 1req s ASP 627 Ca 0.62 0.43 -0.04 0.00 0.71 0.00 0.00 52.55 54.27 1req s ASP 627 Cb -0.12 -2.35 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 1req s ASP 627 CO 0.28 -0.53 -0.05 -0.69 0.21 0.00 0.00 175.17 174.40 1req s VAL 628 N 2.70 3.48 -0.20 -1.27 1.01 -1.26 -0.19 120.40 124.67 1req s VAL 628 Ca 0.27 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 1req s VAL 628 Cb -0.15 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 1req s VAL 628 CO 0.12 0.44 0.11 -1.81 0.00 0.00 0.00 175.10 173.97 1req s ASP 629 N 1.14 5.98 -0.42 3.32 1.01 0.14 -4.98 116.67 122.86 1req s ASP 629 Ca 0.02 0.16 -0.16 0.00 0.71 0.00 0.00 52.55 53.27 1req s ASP 629 Cb -0.15 -2.05 0.02 0.00 1.01 0.00 0.00 42.92 41.76 1req s ASP 629 CO -0.00 0.16 0.39 -0.69 0.21 0.00 0.00 175.17 175.24 1req s VAL 630 N 0.46 5.15 0.69 -1.27 1.01 -1.26 -1.46 120.40 123.72 1req s VAL 630 Ca 0.06 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.42 1req s VAL 630 Cb -0.12 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.27 1req s VAL 630 CO -0.00 -0.40 1.11 -0.83 0.00 0.00 0.00 175.10 174.98 1req s GLY 631 N 1.80 2.04 0.55 4.51 0.00 0.10 -4.96 107.32 111.36 1req s GLY 631 Ca 0.09 0.48 -0.15 0.00 0.00 0.00 0.00 44.72 45.15 1req s GLY 631 CO 0.12 0.84 1.01 2.56 0.00 0.00 0.00 173.10 177.62 1req s PRO 632 N -4.29 3.76 0.99 2.90 0.04 -1.26 -4.71 135.00 132.42 1req s PRO 632 Ca 0.66 0.94 -0.13 0.00 0.04 0.00 0.00 61.00 62.51 1req s PRO 632 Cb -0.20 -2.11 0.18 0.00 0.04 0.00 0.00 34.50 32.42 1req s PRO 632 CO 0.45 -0.43 1.11 -0.51 0.04 0.00 0.00 177.00 177.66 1req s LEU 633 N -4.41 1.64 -1.55 -3.56 1.43 -1.26 -4.04 118.68 106.93 1req s LEU 633 Ca 0.59 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 1req s LEU 633 Cb -0.11 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 42.90 1req s LEU 633 CO 0.38 -3.04 0.00 0.49 0.23 0.00 0.00 176.35 174.40 1req n PHE 634 N -4.10 -0.25 -2.15 0.29 3.72 -1.25 -5.02 117.46 108.69 1req n PHE 634 Ca 0.06 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.08 1req n PHE 634 Cb 0.58 -2.90 -0.01 0.00 -0.94 0.00 0.00 39.48 36.21 1req n PHE 634 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1req s GLN 635 N -3.82 3.84 0.69 -1.08 -0.21 -1.11 -4.53 119.66 113.43 1req s GLN 635 Ca 0.00 1.96 -0.07 0.00 0.02 0.00 0.00 55.36 57.26 1req s GLN 635 Cb 0.00 -2.57 0.05 0.00 1.00 0.00 0.00 33.01 31.48 1req s GLN 635 CO 0.00 -0.54 1.01 0.95 -2.12 0.00 0.00 175.29 174.59 1req s THR 636 N -1.39 2.71 0.33 -0.19 -4.23 -1.26 -1.25 115.64 110.35 1req s THR 636 Ca 0.60 -0.10 0.04 0.00 -1.18 0.00 0.00 61.69 61.05 1req s THR 636 Cb -0.33 -3.16 0.29 0.00 1.34 0.00 0.00 72.50 70.64 1req s THR 636 CO 0.41 -0.18 1.91 -0.65 -0.54 0.00 0.00 174.62 175.58 1req h PRO 637 N -0.54 0.85 -0.31 3.99 0.11 -1.93 -1.98 132.00 132.19 1req h PRO 637 Ca -0.45 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 1req h PRO 637 Cb 1.30 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1req h PRO 637 CO 0.61 0.57 -0.28 1.49 -0.21 0.00 0.00 178.00 180.18 1req h GLU 638 N 0.88 0.63 -0.13 1.05 4.81 -1.93 -0.78 114.58 119.10 1req h GLU 638 Ca 0.39 -0.26 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 1req h GLU 638 Cb 0.35 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1req h GLU 638 CO -0.16 0.84 -0.61 0.93 -0.73 0.00 0.00 179.01 179.29 1req h GLU 639 N 0.54 0.43 -0.22 1.92 5.08 -1.87 -0.72 114.58 119.74 1req h GLU 639 Ca 0.07 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1req h GLU 639 Cb 0.76 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1req h GLU 639 CO 0.06 0.91 0.07 1.15 -1.00 0.00 0.00 179.01 180.20 1req h THR 640 N 0.32 1.18 0.01 1.13 2.02 -1.25 -0.41 112.91 115.92 1req h THR 640 Ca -0.01 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 1req h THR 640 Cb 1.15 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1req h THR 640 CO 0.11 0.18 -0.01 0.00 0.37 0.00 0.00 175.52 176.17 1req h ALA 641 N 0.90 -0.02 -0.50 6.16 0.00 -0.94 -0.85 119.26 124.00 1req h ALA 641 Ca 0.07 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1req h ALA 641 Cb 0.22 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 1req h ALA 641 CO -0.00 -0.51 0.08 -0.09 0.00 0.00 0.00 179.25 178.72 1req h ARG 642 N -0.03 0.20 -0.44 0.00 2.43 -1.07 -1.70 114.38 113.76 1req h ARG 642 Ca -0.00 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 1req h ARG 642 Cb 0.02 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1req h ARG 642 CO -0.00 0.13 -0.06 0.37 -1.51 0.00 0.00 179.97 178.90 1req h GLN 643 N 0.21 0.77 -0.16 0.20 4.15 -0.94 -0.95 115.11 118.39 1req h GLN 643 Ca 0.25 -0.23 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1req h GLN 643 Cb 0.35 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 1req h GLN 643 CO -0.35 0.82 0.09 0.00 -1.93 0.00 0.00 178.83 177.46 1req h ALA 644 N 1.22 0.21 -0.46 3.38 0.00 -0.37 -2.00 119.26 121.24 1req h ALA 644 Ca 0.13 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1req h ALA 644 Cb 0.52 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1req h ALA 644 CO 0.03 -0.27 0.17 0.28 0.00 0.00 0.00 179.25 179.46 1req h VAL 645 N 0.17 1.22 -0.34 0.00 2.07 -1.21 -0.62 116.25 117.54 1req h VAL 645 Ca 0.06 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 1req h VAL 645 Cb 0.05 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1req h VAL 645 CO -0.01 0.25 0.03 -0.33 0.02 0.00 0.00 177.57 177.53 1req h GLU 646 N 0.61 0.52 0.00 1.57 5.08 -1.10 0.24 114.58 121.50 1req h GLU 646 Ca 0.15 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1req h GLU 646 Cb 0.23 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1req h GLU 646 CO -0.01 0.53 -0.33 0.00 -1.00 0.00 0.00 179.01 178.20 1req n ALA 647 N -2.48 2.83 -3.63 3.43 0.00 -0.76 -4.96 120.51 114.94 1req n ALA 647 Ca 0.02 -0.20 -0.23 0.00 0.00 0.00 0.00 53.44 53.02 1req n ALA 647 Cb 0.22 -1.28 0.04 0.00 0.00 0.00 0.00 19.45 18.43 1req n ALA 647 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1req n ASP 648 N -1.84 -3.22 -4.86 0.00 2.03 0.07 -4.95 116.55 103.78 1req n ASP 648 Ca 0.05 -0.87 -0.30 0.00 0.52 0.00 0.00 54.79 54.20 1req n ASP 648 Cb 0.39 -4.02 0.06 0.00 -0.72 0.00 0.00 41.12 36.83 1req n ASP 648 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1req s VAL 649 N -3.58 3.25 -0.15 5.18 -7.23 -0.97 -4.92 120.40 111.99 1req s VAL 649 Ca 0.21 0.41 0.17 0.00 -1.81 0.00 0.00 61.98 60.96 1req s VAL 649 Cb -0.06 -3.31 -0.07 0.00 0.56 0.00 0.00 36.38 33.49 1req s VAL 649 CO 0.82 -0.53 0.99 0.45 -0.31 0.00 0.00 175.10 176.52 1req h HIS 650 N -0.83 0.00 -2.50 2.82 3.86 -1.47 -3.46 115.15 113.57 1req h HIS 650 Ca -0.46 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.66 1req h HIS 650 Cb 1.26 0.00 -0.22 0.00 1.06 0.00 0.00 27.41 29.51 1req h HIS 650 CO 0.48 0.49 -0.10 0.54 0.86 0.00 0.00 177.93 180.19 1req s VAL 651 N -2.99 0.01 -0.38 2.45 0.11 -1.18 -1.67 120.40 116.74 1req s VAL 651 Ca -0.01 -0.04 -0.15 0.00 -2.93 0.00 0.00 61.98 58.85 1req s VAL 651 Cb 0.08 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 34.21 1req s VAL 651 CO 0.79 -0.02 0.31 -0.69 -3.33 0.00 0.00 175.10 172.16 1req s VAL 652 N 0.02 5.23 -0.72 2.04 1.01 0.79 -1.77 120.40 127.00 1req s VAL 652 Ca -0.02 -0.40 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 1req s VAL 652 Cb -0.03 -3.87 0.09 0.00 0.00 0.00 0.00 36.38 32.56 1req s VAL 652 CO 0.02 -0.22 0.97 -0.83 0.00 0.00 0.00 175.10 175.04 1req s GLY 653 N 1.72 1.55 0.02 4.51 0.00 0.75 -1.47 107.32 114.41 1req s GLY 653 Ca 0.07 -2.12 -0.30 0.00 0.00 0.00 0.00 44.72 42.37 1req s GLY 653 CO 0.11 1.99 1.16 0.14 0.00 0.00 0.00 173.10 176.51 1req s VAL 654 N 3.57 4.22 -0.35 1.40 1.01 0.79 -1.16 120.40 129.88 1req s VAL 654 Ca 0.23 1.59 -0.03 0.00 0.00 0.00 0.00 61.98 63.77 1req s VAL 654 Cb -0.15 -4.02 0.07 0.00 0.00 0.00 0.00 36.38 32.29 1req s VAL 654 CO 0.05 0.09 0.10 -0.55 0.00 0.00 0.00 175.10 174.79 1req s SER 655 N 1.16 5.11 -0.23 3.32 0.15 -0.88 0.19 113.70 122.52 1req s SER 655 Ca 0.57 -1.58 0.02 0.00 0.70 0.00 0.00 55.95 55.66 1req s SER 655 Cb -0.27 -1.79 0.05 0.00 -1.71 0.00 0.00 66.02 62.30 1req s SER 655 CO 0.27 -0.39 -0.13 -0.55 1.20 0.00 0.00 173.24 173.63 1req s SER 656 N 1.52 3.95 0.00 5.45 0.15 0.75 -4.67 113.70 120.85 1req s SER 656 Ca 0.01 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.54 1req s SER 656 Cb -0.21 -1.49 0.00 0.00 -1.71 0.00 0.00 66.02 62.61 1req s SER 656 CO -0.02 -0.13 0.48 0.18 1.20 0.00 0.00 173.24 174.95 1req n LEU 657 N 4.52 0.89 -1.40 3.45 4.32 -1.26 -1.82 117.00 125.69 1req n LEU 657 Ca -0.16 -0.89 0.10 0.00 -0.02 0.00 0.00 56.01 55.04 1req n LEU 657 Cb 0.45 0.00 0.32 0.00 -1.62 0.00 0.00 43.42 42.57 1req n LEU 657 CO 0.22 0.22 0.78 0.00 -1.22 0.00 0.00 177.39 177.40 1req n ALA 658 N -0.09 2.77 -1.04 -1.18 0.00 -1.26 -4.79 120.51 114.93 1req n ALA 658 Ca 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 53.44 51.93 1req n ALA 658 Cb 0.13 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 1req n ALA 658 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 659 N 1.17 0.49 1.79 0.00 0.00 -1.26 -4.69 105.19 102.68 1req n GLY 659 Ca 0.24 -0.25 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 1req n GLY 659 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 660 N -2.28 3.78 0.32 -0.02 0.00 -1.26 -4.58 105.19 101.14 1req n GLY 660 Ca -0.01 -1.02 -0.01 0.00 0.00 0.00 0.00 46.02 44.98 1req n GLY 660 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1req h HIS 661 N 2.51 0.84 -0.18 1.61 2.07 -1.94 -0.85 115.15 119.22 1req h HIS 661 Ca 0.21 -0.04 -0.06 0.00 -2.85 0.00 0.00 60.37 57.64 1req h HIS 661 Cb 2.15 -0.26 -0.01 0.00 2.57 0.00 0.00 27.41 31.86 1req h HIS 661 CO 1.16 0.64 -0.16 -0.07 -3.07 0.00 0.00 177.93 176.42 1req h LEU 662 N 0.84 0.29 0.08 6.12 3.38 -1.98 -2.47 115.31 121.57 1req h LEU 662 Ca 0.20 -0.07 -0.30 0.00 0.09 0.00 0.00 57.88 57.81 1req h LEU 662 Cb 0.13 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1req h LEU 662 CO -0.02 0.48 -1.61 0.71 0.09 0.00 0.00 178.44 178.09 1req h THR 663 N 0.28 0.81 -0.20 0.22 1.35 -1.80 -3.42 112.91 110.16 1req h THR 663 Ca 0.05 -2.29 0.02 0.00 -0.55 0.00 0.00 66.41 63.64 1req h THR 663 Cb 0.46 2.44 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 1req h THR 663 CO 0.03 0.64 0.04 -0.07 -0.25 0.00 0.00 175.52 175.91 1req h LEU 664 N -0.40 0.02 0.15 3.87 3.38 -1.20 -2.80 115.31 118.33 1req h LEU 664 Ca -0.37 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 1req h LEU 664 Cb 1.71 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.50 1req h LEU 664 CO -0.03 0.04 -0.07 0.58 0.09 0.00 0.00 178.44 179.05 1req h VAL 665 N 0.12 0.90 -0.62 1.22 2.07 -1.69 -1.89 116.25 116.36 1req h VAL 665 Ca 0.09 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 1req h VAL 665 Cb 0.08 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1req h VAL 665 CO -0.11 0.05 0.18 1.55 0.02 0.00 0.00 177.57 179.26 1req h PRO 666 N -0.31 0.94 -0.78 1.57 0.13 -1.72 -1.69 132.00 130.15 1req h PRO 666 Ca -0.02 -0.19 0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1req h PRO 666 Cb 0.24 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 31.19 1req h PRO 666 CO 0.03 0.82 0.51 0.00 -0.23 0.00 0.00 178.00 179.13 1req h ALA 667 N 1.28 1.00 0.13 -0.56 0.00 -1.36 -1.42 119.26 118.33 1req h ALA 667 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1req h ALA 667 Cb 0.28 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1req h ALA 667 CO -0.01 0.37 -0.11 1.25 0.00 0.00 0.00 179.25 180.76 1req h LEU 668 N 1.03 -0.28 -0.18 0.00 6.46 -0.95 -1.95 115.31 119.44 1req h LEU 668 Ca 0.29 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 58.12 1req h LEU 668 Cb -0.08 0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 39.90 1req h LEU 668 CO -0.08 -0.17 -0.11 -0.09 -0.62 0.00 0.00 178.44 177.37 1req h ARG 669 N -0.25 -0.10 -0.84 1.25 9.65 -0.99 -0.86 114.38 122.24 1req h ARG 669 Ca -0.00 0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1req h ARG 669 Cb 0.23 0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.79 1req h ARG 669 CO -0.01 -0.07 0.52 0.87 2.80 0.00 0.00 179.97 184.08 1req h LYS 670 N -0.10 1.14 -0.37 0.20 1.57 -1.25 -2.22 116.57 115.54 1req h LYS 670 Ca 0.11 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 1req h LYS 670 Cb 0.26 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1req h LYS 670 CO -0.25 0.79 -0.10 0.93 -0.57 0.00 0.00 179.45 180.25 1req h GLU 671 N 1.15 0.72 -0.34 3.15 4.39 -0.93 0.45 114.58 123.18 1req h GLU 671 Ca 0.30 -0.28 0.02 0.00 0.34 0.00 0.00 59.36 59.74 1req h GLU 671 Cb -0.07 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 1req h GLU 671 CO -0.06 0.88 0.20 -0.07 -1.16 0.00 0.00 179.01 178.79 1req h LEU 672 N 0.52 0.31 -0.61 1.33 3.38 -1.09 -0.88 115.31 118.28 1req h LEU 672 Ca 0.09 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1req h LEU 672 Cb 0.61 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1req h LEU 672 CO 0.04 0.23 0.39 0.44 0.09 0.00 0.00 178.44 179.62 1req h ASP 673 N 0.40 0.72 0.77 -0.43 5.19 -1.36 -0.91 116.42 120.80 1req h ASP 673 Ca 0.14 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.50 1req h ASP 673 Cb 0.01 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.34 1req h ASP 673 CO -0.07 0.55 -0.01 0.50 -3.12 0.00 0.00 179.24 177.09 1req h LYS 674 N 0.83 0.00 -0.11 3.56 3.64 -0.60 -2.00 116.57 121.89 1req h LYS 674 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1req h LYS 674 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1req h LYS 674 CO -0.04 0.01 0.00 1.28 -2.27 0.00 0.00 179.45 178.43 1req n LEU 675 N -3.12 1.00 0.00 5.20 4.77 -0.36 -4.89 117.00 119.60 1req n LEU 675 Ca -0.00 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 1req n LEU 675 Cb 0.25 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1req n LEU 675 CO 0.26 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1req n GLY 676 N 0.97 0.48 2.57 -0.72 0.00 -0.75 -5.01 105.19 102.73 1req n GLY 676 Ca 0.14 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1req n GLY 676 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1req s ARG 677 N -3.53 1.38 0.17 1.61 1.81 -0.36 -4.90 118.95 115.13 1req s ARG 677 Ca 0.00 -2.44 0.26 0.00 -1.72 0.00 0.00 55.73 51.82 1req s ARG 677 Cb 0.00 -2.07 0.67 0.00 -0.45 0.00 0.00 34.95 33.09 1req s ARG 677 CO 0.00 -1.34 1.63 -0.35 -0.68 0.00 0.00 175.30 174.56 1req n PRO 678 N 2.67 0.26 0.20 3.54 -0.04 -1.26 -2.43 135.00 137.93 1req n PRO 678 Ca 0.25 0.16 0.08 0.00 -0.04 0.00 0.00 63.50 63.95 1req n PRO 678 Cb 0.43 -1.75 0.28 0.00 -0.04 0.00 0.00 33.50 32.42 1req n PRO 678 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1req h ASP 679 N 0.00 0.00 -2.98 3.54 2.03 -1.94 -3.43 116.42 113.63 1req h ASP 679 Ca 0.00 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.75 1req h ASP 679 Cb 0.73 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.22 1req h ASP 679 CO 0.00 0.28 0.78 -0.63 -1.03 0.00 0.00 179.24 178.65 1req s ILE 680 N -3.36 3.97 0.42 4.15 1.01 -1.02 -4.93 121.20 121.45 1req s ILE 680 Ca 0.03 1.32 -0.04 0.00 0.00 0.00 0.00 60.65 61.95 1req s ILE 680 Cb 0.09 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1req s ILE 680 CO 0.67 -0.01 0.71 -0.76 0.00 0.00 0.00 174.94 175.55 1req s LEU 681 N 2.40 3.78 -0.07 2.97 1.43 -0.67 -4.91 118.68 123.60 1req s LEU 681 Ca 0.60 0.82 0.05 0.00 -1.03 0.00 0.00 54.13 54.58 1req s LEU 681 Cb -0.28 -3.74 -0.01 0.00 0.03 0.00 0.00 46.19 42.19 1req s LEU 681 CO 0.24 -0.46 -0.24 -0.63 0.23 0.00 0.00 176.35 175.49 1req s ILE 682 N -2.54 2.11 0.30 -0.59 1.01 -1.26 -0.15 121.20 120.08 1req s ILE 682 Ca 0.46 -1.03 0.10 0.00 0.00 0.00 0.00 60.65 60.18 1req s ILE 682 Cb -0.10 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 1req s ILE 682 CO 0.40 0.57 -0.09 0.42 0.00 0.00 0.00 174.94 176.23 1req s THR 683 N -0.01 2.66 -0.03 2.92 -4.23 -0.54 -0.53 115.64 115.87 1req s THR 683 Ca -0.08 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.26 1req s THR 683 Cb -0.15 -2.59 0.03 0.00 1.34 0.00 0.00 72.50 71.13 1req s THR 683 CO 0.05 -0.31 0.01 -0.69 -0.54 0.00 0.00 174.62 173.14 1req s VAL 684 N -2.49 0.16 0.40 2.29 1.01 -0.82 -0.15 120.40 120.80 1req s VAL 684 Ca 0.32 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.46 1req s VAL 684 Cb -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 1req s VAL 684 CO 0.17 0.15 0.04 -0.83 0.00 0.00 0.00 175.10 174.64 1req s GLY 685 N 1.17 2.48 0.00 4.51 0.00 0.13 -0.81 107.32 114.80 1req s GLY 685 Ca -0.08 -1.66 0.00 0.00 0.00 0.00 0.00 44.72 42.98 1req s GLY 685 CO -0.02 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.71 1req n GLY 686 N -0.92 0.22 3.45 0.20 0.00 -0.59 -0.18 105.19 107.37 1req n GLY 686 Ca -0.07 -2.00 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 1req n GLY 686 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 687 N 0.00 4.41 -0.22 1.61 1.01 -0.76 -3.91 120.40 122.54 1req s VAL 687 Ca 0.00 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 1req s VAL 687 Cb 0.00 -4.70 0.09 0.00 0.00 0.00 0.00 36.38 31.77 1req s VAL 687 CO 0.00 -1.47 0.18 -0.63 0.00 0.00 0.00 175.10 173.18 1req s ILE 688 N 3.77 -0.22 0.52 2.22 1.01 -1.26 -4.70 121.20 122.54 1req s ILE 688 Ca 0.24 -0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.40 1req s ILE 688 Cb -0.15 -0.74 -0.08 0.00 0.01 0.00 0.00 42.46 41.50 1req s ILE 688 CO 0.06 -0.36 0.82 -2.65 0.00 0.00 0.00 174.94 172.81 1req n PRO 689 N 5.29 0.89 0.24 2.79 -0.02 -1.26 -4.91 135.00 138.03 1req n PRO 689 Ca -0.06 0.33 0.11 0.00 -2.02 0.00 0.00 63.50 61.87 1req n PRO 689 Cb 0.48 -1.94 0.59 0.00 -0.02 0.00 0.00 33.50 32.61 1req n PRO 689 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1req h GLU 690 N 0.75 0.00 -0.89 -0.52 4.81 -1.98 -2.54 114.58 114.21 1req h GLU 690 Ca -0.46 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 58.79 1req h GLU 690 Cb 1.37 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.70 1req h GLU 690 CO 0.52 0.19 0.59 1.96 -0.73 0.00 0.00 179.01 181.53 1req h GLN 691 N 0.00 1.15 0.00 1.92 4.20 -1.99 -2.91 115.11 117.48 1req h GLN 691 Ca -0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1req h GLN 691 Cb 0.53 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1req h GLN 691 CO 0.02 0.76 0.00 -0.25 -0.67 0.00 0.00 178.83 178.69 1req n ASP 692 N -4.41 0.00 0.22 1.46 8.00 -0.96 -4.34 116.55 116.52 1req n ASP 692 Ca 0.11 -0.47 -0.14 0.00 0.71 0.00 0.00 54.79 54.99 1req n ASP 692 Cb 0.04 -0.11 -0.08 0.00 -0.02 0.00 0.00 41.12 40.95 1req n ASP 692 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1req h PHE 693 N 0.00 -0.52 -0.97 1.24 -1.00 -1.63 -2.41 116.94 111.66 1req h PHE 693 Ca 0.00 -0.01 0.02 0.00 2.81 0.00 0.00 57.97 60.79 1req h PHE 693 Cb 0.09 0.17 -0.05 0.00 3.61 0.00 0.00 35.95 39.76 1req h PHE 693 CO 0.00 -0.21 0.64 -0.44 -1.61 0.00 0.00 178.31 176.69 1req h ASP 694 N -0.79 1.08 -0.30 2.17 3.32 -1.81 -0.43 116.42 119.68 1req h ASP 694 Ca -0.06 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 1req h ASP 694 Cb 0.53 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1req h ASP 694 CO 0.09 0.76 0.05 -0.08 -1.72 0.00 0.00 179.24 178.35 1req h GLU 695 N 1.27 0.49 -0.63 3.56 4.81 -1.84 -2.37 114.58 119.86 1req h GLU 695 Ca 0.37 -0.13 0.10 0.00 -0.13 0.00 0.00 59.36 59.57 1req h GLU 695 Cb -0.07 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.17 1req h GLU 695 CO -0.10 0.58 0.25 -0.07 -0.73 0.00 0.00 179.01 178.94 1req h LEU 696 N 0.31 0.25 -1.35 1.64 3.38 -0.61 0.73 115.31 119.67 1req h LEU 696 Ca 0.09 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 1req h LEU 696 Cb 0.33 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1req h LEU 696 CO 0.00 0.14 0.05 0.03 0.09 0.00 0.00 178.44 178.75 1req h ARG 697 N 0.43 0.48 0.00 1.13 3.08 -1.11 -1.50 114.38 116.89 1req h ARG 697 Ca 0.32 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.20 1req h ARG 697 Cb 0.40 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1req h ARG 697 CO -0.31 0.48 -0.42 0.87 -1.07 0.00 0.00 179.97 179.51 1req h LYS 698 N 0.47 0.00 0.00 0.04 6.56 -0.77 -2.97 116.57 119.91 1req h LYS 698 Ca 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1req h LYS 698 Cb 0.24 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.90 1req h LYS 698 CO 0.00 0.42 0.00 -0.44 -2.06 0.00 0.00 179.45 177.37 1req h ASP 699 N 0.00 0.00 0.00 0.86 3.32 -0.44 -3.47 116.42 116.69 1req h ASP 699 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1req h ASP 699 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1req h ASP 699 CO 0.05 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.18 1req n GLY 700 N 0.72 0.49 3.67 2.75 0.00 -0.97 -4.17 105.19 107.67 1req n GLY 700 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1req n GLY 700 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 701 N -1.27 3.62 -0.18 4.61 0.00 -0.61 -4.17 121.76 123.77 1req s ALA 701 Ca 0.00 0.71 0.21 0.00 0.00 0.00 0.00 51.96 52.88 1req s ALA 701 Cb 0.00 -3.64 -0.08 0.00 0.00 0.00 0.00 23.12 19.40 1req s ALA 701 CO 0.00 -1.15 0.90 1.33 0.00 0.00 0.00 175.76 176.84 1req n VAL 702 N 5.18 0.73 -3.84 0.00 0.24 0.31 -4.12 118.33 116.82 1req n VAL 702 Ca 0.14 -0.59 -0.12 0.00 -2.04 0.00 0.00 64.34 61.74 1req n VAL 702 Cb 0.44 -0.41 -0.10 0.00 -1.47 0.00 0.00 33.84 32.30 1req n VAL 702 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1req s GLU 703 N -3.24 0.50 -0.08 7.34 0.41 -1.26 -5.06 118.70 117.31 1req s GLU 703 Ca -0.02 -0.28 -0.01 0.00 -0.41 0.00 0.00 54.97 54.24 1req s GLU 703 Cb 0.10 0.21 0.03 0.00 -1.78 0.00 0.00 34.13 32.69 1req s GLU 703 CO 0.81 -0.12 -0.01 0.42 -0.49 0.00 0.00 175.26 175.87 1req s ILE 704 N -1.21 0.48 -0.18 -1.63 1.01 -1.26 -1.94 121.20 116.46 1req s ILE 704 Ca -0.13 0.06 -0.02 0.00 0.00 0.00 0.00 60.65 60.56 1req s ILE 704 Cb -0.06 -0.61 -0.00 0.00 0.01 0.00 0.00 42.46 41.79 1req s ILE 704 CO 0.02 0.28 -0.11 -0.31 0.00 0.00 0.00 174.94 174.82 1req s TYR 705 N 1.91 2.87 0.50 3.97 2.02 0.01 -4.99 117.35 123.64 1req s TYR 705 Ca 0.05 -0.97 0.02 0.00 -0.37 0.00 0.00 57.07 55.80 1req s TYR 705 Cb -0.12 -1.98 -0.02 0.00 -0.40 0.00 0.00 41.96 39.45 1req s TYR 705 CO -0.06 -0.48 0.05 0.95 -1.57 0.00 0.00 175.55 174.45 1req s THR 706 N 1.04 1.33 0.30 -0.71 -4.23 -1.26 -1.54 115.64 110.58 1req s THR 706 Ca -0.00 -1.93 -0.28 0.00 -1.18 0.00 0.00 61.69 58.29 1req s THR 706 Cb -0.15 -2.27 -0.14 0.00 1.34 0.00 0.00 72.50 71.29 1req s THR 706 CO -0.02 0.00 1.07 -2.65 -0.54 0.00 0.00 174.62 172.48 1req n PRO 707 N -1.29 1.53 0.00 3.99 -0.02 -1.25 -2.25 135.00 135.70 1req n PRO 707 Ca -0.15 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1req n PRO 707 Cb 0.67 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1req n PRO 707 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1req n GLY 708 N 1.12 0.53 3.60 -1.23 0.00 -1.26 -4.78 105.19 103.17 1req n GLY 708 Ca 0.08 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.62 1req n GLY 708 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1req n THR 709 N -2.00 0.80 -3.30 2.61 -1.04 -0.96 -4.95 114.28 105.43 1req n THR 709 Ca 0.00 -0.20 -0.38 0.00 -2.04 0.00 0.00 64.05 61.43 1req n THR 709 Cb 0.00 -0.99 -0.06 0.00 -1.82 0.00 0.00 70.33 67.46 1req n THR 709 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1req s VAL 710 N -0.07 5.01 0.09 12.58 1.01 -1.26 -4.99 120.40 132.77 1req s VAL 710 Ca 0.73 1.07 -0.24 0.00 0.00 0.00 0.00 61.98 63.54 1req s VAL 710 Cb -0.81 -3.85 -0.13 0.00 0.00 0.00 0.00 36.38 31.58 1req s VAL 710 CO 0.51 0.43 1.71 0.40 0.00 0.00 0.00 175.10 178.15 1req h ILE 711 N 4.19 0.82 -0.49 2.22 2.04 -1.93 -2.69 117.51 121.68 1req h ILE 711 Ca -0.45 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.41 1req h ILE 711 Cb 1.20 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1req h ILE 711 CO 0.69 0.00 0.32 1.55 0.00 0.00 0.00 178.15 180.72 1req h PRO 712 N -0.18 0.64 -0.72 2.37 0.13 -1.94 -2.09 132.00 130.20 1req h PRO 712 Ca 0.00 -0.04 0.09 0.00 -0.87 0.00 0.00 66.00 65.18 1req h PRO 712 Cb 0.17 -0.14 -0.07 0.00 0.13 0.00 0.00 31.00 31.09 1req h PRO 712 CO -0.01 0.42 0.37 0.93 -0.23 0.00 0.00 178.00 179.48 1req h GLU 713 N 0.65 0.62 -0.51 0.86 5.08 -1.83 -1.86 114.58 117.60 1req h GLU 713 Ca 0.18 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1req h GLU 713 Cb -0.07 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1req h GLU 713 CO -0.04 0.41 0.10 0.66 -1.00 0.00 0.00 179.01 179.13 1req h SER 714 N 0.64 0.73 -0.36 1.42 4.64 -1.13 -2.16 113.55 117.34 1req h SER 714 Ca 0.35 -0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1req h SER 714 Cb 0.34 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1req h SER 714 CO -0.25 0.74 0.21 0.00 -0.87 0.00 0.00 176.83 176.66 1req h ALA 715 N 1.35 0.46 0.25 5.18 0.00 -0.69 0.25 119.26 126.07 1req h ALA 715 Ca 0.16 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1req h ALA 715 Cb 0.32 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1req h ALA 715 CO 0.00 -0.04 -0.22 0.82 0.00 0.00 0.00 179.25 179.82 1req h ILE 716 N 0.46 0.53 -0.11 0.00 2.04 -1.23 -0.05 117.51 119.16 1req h ILE 716 Ca 0.13 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.86 1req h ILE 716 Cb 0.02 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1req h ILE 716 CO -0.02 0.00 -0.48 0.77 0.00 0.00 0.00 178.15 178.41 1req h SER 717 N -0.49 0.31 -0.30 1.72 4.64 -1.37 -2.04 113.55 116.02 1req h SER 717 Ca -0.01 -0.15 -0.08 0.00 -0.47 0.00 0.00 61.79 61.09 1req h SER 717 Cb 0.44 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1req h SER 717 CO -0.03 0.74 -0.12 0.25 -0.87 0.00 0.00 176.83 176.81 1req h LEU 718 N 0.23 0.62 -0.14 5.97 5.85 -0.11 -2.45 115.31 125.28 1req h LEU 718 Ca 0.01 -0.39 0.03 0.00 0.84 0.00 0.00 57.88 58.37 1req h LEU 718 Cb 0.94 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.76 1req h LEU 718 CO 0.08 0.87 -0.07 0.58 -0.34 0.00 0.00 178.44 179.56 1req h VAL 719 N 0.37 0.77 -0.86 1.05 2.07 -1.04 0.18 116.25 118.79 1req h VAL 719 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.66 1req h VAL 719 Cb 0.62 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1req h VAL 719 CO 0.04 0.00 0.53 0.50 0.02 0.00 0.00 177.57 178.66 1req h LYS 720 N -0.06 0.92 -0.48 1.57 3.64 -1.43 0.13 116.57 120.86 1req h LYS 720 Ca 0.08 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1req h LYS 720 Cb 0.18 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1req h LYS 720 CO -0.18 0.61 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.25 1req h LYS 721 N 0.95 0.91 0.39 1.90 1.63 -1.01 -2.54 116.57 118.80 1req h LYS 721 Ca 0.39 -0.34 -0.01 0.00 -0.85 0.00 0.00 60.65 59.84 1req h LYS 721 Cb 0.22 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1req h LYS 721 CO -0.19 0.99 -0.30 -0.07 -3.45 0.00 0.00 179.45 176.43 1req h LEU 722 N 0.81 -0.78 -0.39 5.20 3.38 0.24 -2.32 115.31 121.45 1req h LEU 722 Ca 0.12 0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1req h LEU 722 Cb 0.67 0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.60 1req h LEU 722 CO 0.05 -0.45 -0.09 0.03 0.09 0.00 0.00 178.44 178.07 1req h ARG 723 N -0.68 0.01 -0.51 1.13 2.47 -0.99 0.54 114.38 116.34 1req h ARG 723 Ca -0.03 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1req h ARG 723 Cb 0.59 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.89 1req h ARG 723 CO -0.01 0.01 0.33 0.00 0.56 0.00 0.00 179.97 180.86 1req h ALA 724 N 1.39 1.62 -0.12 0.04 0.00 -1.50 0.25 119.26 120.93 1req h ALA 724 Ca 0.19 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.88 1req h ALA 724 Cb 0.28 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1req h ALA 724 CO -0.39 0.35 -0.67 1.03 0.00 0.00 0.00 179.25 179.56 1req h SER 725 N 0.69 0.56 0.75 0.00 0.87 -0.81 -3.36 113.55 112.26 1req h SER 725 Ca 0.19 -0.35 -0.25 0.00 -1.23 0.00 0.00 61.79 60.15 1req h SER 725 Cb -0.06 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.71 1req h SER 725 CO -0.04 1.08 -1.26 -0.07 -0.53 0.00 0.00 176.83 176.01 1req h LEU 726 N 0.35 0.14 -7.09 2.23 3.38 0.36 -3.39 115.31 111.29 1req h LEU 726 Ca -0.02 -0.17 -0.80 0.00 0.09 0.00 0.00 57.88 56.98 1req h LEU 726 Cb 1.24 -0.05 -0.26 0.00 0.09 0.00 0.00 40.66 41.68 1req h LEU 726 CO 0.12 1.14 0.82 0.47 0.09 0.00 0.00 178.44 181.09 1req n ASP 727 N -3.35 6.01 0.00 -0.43 8.00 0.74 -5.07 116.55 122.46 1req n ASP 727 Ca -0.07 -3.26 0.00 0.00 0.71 0.00 0.00 54.79 52.16 1req n ASP 727 Cb 0.99 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 1req n ASP 727 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81