#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 0.00 -3.16 6.66 -2.24 -1.26 -5.09 114.28 109.19 1req n THR 3 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 1req n THR 3 Cb 0.00 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1req n THR 3 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1req n LEU 4 N -3.46 -5.35 -4.60 3.22 4.77 -1.26 -4.91 117.00 105.41 1req n LEU 4 Ca 0.00 0.24 -0.43 0.00 -0.03 0.00 0.00 56.01 55.79 1req n LEU 4 Cb 0.00 -2.53 -0.00 0.00 -2.33 0.00 0.00 43.42 38.56 1req n LEU 4 CO 0.00 -1.29 0.58 -2.65 -1.33 0.00 0.00 177.39 172.69 1req n PRO 5 N -0.17 1.38 -3.99 3.23 -0.02 -1.26 -5.01 135.00 129.17 1req n PRO 5 Ca 0.02 0.49 -0.30 0.00 -2.02 0.00 0.00 63.50 61.68 1req n PRO 5 Cb 0.55 -1.95 -0.16 0.00 -0.02 0.00 0.00 33.50 31.92 1req n PRO 5 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1req s ARG 6 N -1.77 1.97 -0.02 -0.52 1.81 -1.26 -5.07 118.95 114.09 1req s ARG 6 Ca 0.60 -0.83 0.04 0.00 -1.72 0.00 0.00 55.73 53.83 1req s ARG 6 Cb -0.62 -2.40 0.16 0.00 -0.45 0.00 0.00 34.95 31.63 1req s ARG 6 CO 0.59 -0.44 0.98 1.19 -0.68 0.00 0.00 175.30 176.95 1req n PHE 7 N 4.70 0.31 0.79 -0.53 3.01 -1.26 -4.29 117.46 120.19 1req n PHE 7 Ca -0.14 -0.13 0.10 0.00 1.01 0.00 0.00 57.45 58.29 1req n PHE 7 Cb 0.46 -0.07 0.47 0.00 -0.01 0.00 0.00 39.48 40.33 1req n PHE 7 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1req n ASP 8 N 0.03 0.00 -0.03 4.37 5.75 -1.26 -1.92 116.55 123.49 1req n ASP 8 Ca 0.06 0.36 0.01 0.00 -0.01 0.00 0.00 54.79 55.20 1req n ASP 8 Cb 0.26 -0.44 -0.10 0.00 -1.03 0.00 0.00 41.12 39.81 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 -1.44 2.04 -4.72 -1.12 3.41 -1.26 -5.02 113.62 105.50 1req n SER 9 Ca 0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.26 1req n SER 9 Cb 0.22 1.24 -0.03 0.00 -0.26 0.00 0.00 64.21 65.38 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 -2.63 3.15 0.35 -3.33 1.01 -0.81 -4.99 120.40 113.16 1req s VAL 10 Ca -0.05 0.86 -0.25 0.00 0.00 0.00 0.00 61.98 62.54 1req s VAL 10 Cb 0.06 -3.55 -0.10 0.00 0.00 0.00 0.00 36.38 32.79 1req s VAL 10 CO 0.52 0.08 0.97 -1.81 0.00 0.00 0.00 175.10 174.86 1req s ASP 11 N 0.91 7.18 0.05 3.32 1.01 -1.26 -4.98 116.67 122.90 1req s ASP 11 Ca 0.63 1.86 -0.21 0.00 0.71 0.00 0.00 52.55 55.54 1req s ASP 11 Cb -0.38 -2.58 -0.13 0.00 1.01 0.00 0.00 42.92 40.85 1req s ASP 11 CO 0.33 -0.18 1.45 0.25 0.21 0.00 0.00 175.17 177.22 1req h LEU 12 N 2.88 0.29 0.00 1.23 5.85 -1.97 -3.49 115.31 120.10 1req h LEU 12 Ca -0.47 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 57.89 1req h LEU 12 Cb 1.19 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1req h LEU 12 CO 0.64 0.58 0.00 0.61 -0.34 0.00 0.00 178.44 179.93 1req n GLY 13 N -0.16 0.54 1.63 3.75 0.00 -1.26 -4.68 105.19 105.00 1req n GLY 13 Ca -0.05 -2.09 0.07 0.00 0.00 0.00 0.00 46.02 43.94 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 -0.01 4.85 -3.49 1.61 5.03 -1.26 -4.98 115.26 117.00 1req n ASN 14 Ca 0.00 -2.67 -0.22 0.00 0.87 0.00 0.00 54.58 52.56 1req n ASN 14 Cb 0.00 -0.62 0.01 0.00 -1.02 0.00 0.00 39.78 38.14 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 0.70 -2.42 -1.76 5.41 0.00 -1.26 -4.87 120.51 116.30 1req n ALA 15 Ca 0.24 -0.15 -0.40 0.00 0.00 0.00 0.00 53.44 53.13 1req n ALA 15 Cb 0.98 -0.77 -0.04 0.00 0.00 0.00 0.00 19.45 19.63 1req n ALA 15 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1req s PRO 16 N -4.05 4.58 -0.32 0.00 0.04 -1.26 -4.99 135.00 129.00 1req s PRO 16 Ca 0.05 1.90 -0.15 0.00 0.04 0.00 0.00 61.00 62.84 1req s PRO 16 Cb -0.01 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.35 1req s PRO 16 CO 0.73 0.12 0.38 0.08 0.04 0.00 0.00 177.00 178.35 1req s VAL 17 N -1.15 5.16 0.90 -0.36 1.01 -1.26 -5.04 120.40 119.65 1req s VAL 17 Ca 0.45 0.25 -0.14 0.00 0.00 0.00 0.00 61.98 62.55 1req s VAL 17 Cb -0.34 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.26 1req s VAL 17 CO 0.44 -0.02 0.38 -2.65 0.00 0.00 0.00 175.10 173.24 1req n PRO 18 N 5.40 -0.13 0.21 2.72 -0.02 -1.26 -4.91 135.00 137.02 1req n PRO 18 Ca -0.09 0.01 0.07 0.00 -2.02 0.00 0.00 63.50 61.47 1req n PRO 18 Cb 0.50 -1.81 0.46 0.00 -0.02 0.00 0.00 33.50 32.63 1req n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1req h ALA 19 N -1.23 1.16 -0.64 3.55 0.00 -2.07 -2.32 119.26 117.72 1req h ALA 19 Ca -0.44 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.07 1req h ALA 19 Cb 1.30 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.96 1req h ALA 19 CO 0.36 0.36 0.16 -0.40 0.00 0.00 0.00 179.25 179.73 1req n ASP 20 N -3.67 4.94 0.08 0.00 5.75 -1.26 -4.69 116.55 117.69 1req n ASP 20 Ca -0.01 -3.15 -0.13 0.00 -0.01 0.00 0.00 54.79 51.49 1req n ASP 20 Cb 0.40 -0.71 -0.08 0.00 -1.03 0.00 0.00 41.12 39.71 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 2.91 -0.13 -0.35 2.12 0.00 -1.77 -0.93 119.26 121.11 1req h ALA 21 Ca 0.16 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1req h ALA 21 Cb 2.14 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.95 1req h ALA 21 CO 0.61 -0.54 0.17 0.00 0.00 0.00 0.00 179.25 179.48 1req h ALA 22 N 0.70 0.43 0.00 0.00 0.00 -1.84 0.39 119.26 118.93 1req h ALA 22 Ca -0.01 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1req h ALA 22 Cb 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1req h ALA 22 CO 0.02 -0.21 -0.39 0.07 0.00 0.00 0.00 179.25 178.74 1req h ARG 23 N 0.34 0.00 -0.29 0.00 0.11 -1.88 0.14 114.38 112.81 1req h ARG 23 Ca 0.15 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 60.09 1req h ARG 23 Cb 0.07 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.14 1req h ARG 23 CO -0.11 0.39 -0.40 0.00 0.10 0.00 0.00 179.97 179.95 1req h ARG 24 N 0.00 0.68 -0.13 0.08 3.08 -0.98 -2.31 114.38 114.81 1req h ARG 24 Ca -0.00 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.68 1req h ARG 24 Cb 0.98 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 1req h ARG 24 CO 0.05 0.96 0.01 0.35 -1.07 0.00 0.00 179.97 180.28 1req h PHE 25 N 0.56 0.23 -0.95 3.04 3.57 0.49 -2.60 116.94 121.28 1req h PHE 25 Ca 0.05 -0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.66 1req h PHE 25 Cb 0.93 -0.06 -0.09 0.00 2.79 0.00 0.00 35.95 39.52 1req h PHE 25 CO 0.04 0.42 0.56 1.49 -2.23 0.00 0.00 178.31 178.59 1req h GLU 26 N -0.02 0.78 -0.26 1.11 4.57 -0.56 0.20 114.58 120.39 1req h GLU 26 Ca 0.04 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1req h GLU 26 Cb 0.32 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 1req h GLU 26 CO 0.00 0.52 -0.19 1.49 -1.18 0.00 0.00 179.01 179.64 1req h GLU 27 N 0.80 0.47 -0.37 1.92 4.57 -1.25 -1.70 114.58 119.03 1req h GLU 27 Ca 0.51 -0.16 -0.13 0.00 -1.18 0.00 0.00 59.36 58.40 1req h GLU 27 Cb 0.66 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 1req h GLU 27 CO -0.33 0.65 -0.28 -0.07 -1.18 0.00 0.00 179.01 177.80 1req h LEU 28 N 0.43 0.80 -0.65 1.64 3.38 -0.97 -0.41 115.31 119.53 1req h LEU 28 Ca 0.07 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1req h LEU 28 Cb 0.58 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1req h LEU 28 CO 0.04 1.03 0.32 0.00 0.09 0.00 0.00 178.44 179.92 1req h ALA 29 N 1.02 0.83 -0.38 1.53 0.00 -0.41 -1.06 119.26 120.80 1req h ALA 29 Ca 0.08 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1req h ALA 29 Cb 0.81 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1req h ALA 29 CO 0.07 0.39 0.21 0.00 0.00 0.00 0.00 179.25 179.92 1req h ALA 30 N 1.14 0.47 0.00 0.00 0.00 -1.28 -2.22 119.26 117.37 1req h ALA 30 Ca 0.22 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1req h ALA 30 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1req h ALA 30 CO -0.03 -0.13 -0.26 0.87 0.00 0.00 0.00 179.25 179.70 1req h LYS 31 N 0.43 0.00 0.00 0.00 1.57 -0.69 -2.88 116.57 115.01 1req h LYS 31 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1req h LYS 31 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1req h LYS 31 CO -0.08 0.26 0.00 0.00 -0.57 0.00 0.00 179.45 179.06 1req h ALA 32 N 1.74 1.00 0.00 3.86 0.00 -1.03 -3.47 119.26 121.36 1req h ALA 32 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1req h ALA 32 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1req h ALA 32 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1req n GLY 33 N 0.75 1.11 3.66 0.00 0.00 -1.09 -5.04 105.19 104.58 1req n GLY 33 Ca 0.04 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.74 0.09 -1.33 2.61 -1.04 -0.85 -4.97 114.28 107.05 1req n THR 34 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1req n THR 34 Cb 0.00 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.10 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 3.38 2.90 3.90 3.41 0.00 -1.26 -4.86 105.19 112.65 1req n GLY 35 Ca 0.18 -1.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 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 3.36 2.52 0.33 1.61 2.02 -1.26 -4.99 118.70 122.28 1req s GLU 36 Ca 0.00 0.22 -0.27 0.00 0.02 0.00 0.00 54.97 54.94 1req s GLU 36 Cb 0.00 -2.05 -0.13 0.00 0.10 0.00 0.00 34.13 32.05 1req s GLU 36 CO 0.00 -1.19 0.98 0.00 0.02 0.00 0.00 175.26 175.07 1req n ALA 37 N -3.04 -0.19 -1.95 5.21 0.00 -1.26 -4.92 120.51 114.36 1req n ALA 37 Ca 0.07 0.34 -0.42 0.00 0.00 0.00 0.00 53.44 53.44 1req n ALA 37 Cb 0.59 -2.02 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 1req n ALA 37 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1req s TRP 38 N -1.13 3.11 -0.40 0.00 -0.00 -0.27 -4.72 118.94 115.53 1req s TRP 38 Ca 0.60 1.00 -0.13 0.00 -0.00 0.00 0.00 56.10 57.57 1req s TRP 38 Cb -0.66 -3.77 0.03 0.00 -0.00 0.00 0.00 33.47 29.08 1req s TRP 38 CO 0.59 -2.56 0.26 -2.00 -0.00 0.00 0.00 176.95 173.25 1req s GLU 39 N 0.09 2.87 1.28 5.86 2.56 -1.26 -0.55 118.70 129.56 1req s GLU 39 Ca 0.61 -1.12 -0.18 0.00 0.00 0.00 0.00 54.97 54.29 1req s GLU 39 Cb -0.40 -3.86 0.32 0.00 2.00 0.00 0.00 34.13 32.19 1req s GLU 39 CO 0.39 -0.77 0.99 0.95 -0.56 0.00 0.00 175.26 176.25 1req s THR 40 N 1.60 1.62 -0.20 -1.70 -4.23 -0.94 -4.93 115.64 106.86 1req s THR 40 Ca 0.03 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.83 1req s THR 40 Cb -0.20 -2.11 0.35 0.00 1.34 0.00 0.00 72.50 71.88 1req s THR 40 CO 0.08 0.00 1.83 0.00 -0.54 0.00 0.00 174.62 175.99 1req h ALA 41 N -2.98 1.00 -0.00 3.99 0.00 -1.98 -1.05 119.26 118.24 1req h ALA 41 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1req h ALA 41 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1req h ALA 41 CO 0.40 0.00 -0.05 0.39 0.00 0.00 0.00 179.25 179.99 1req n GLU 42 N -2.87 0.41 -3.29 0.00 4.71 -1.26 -4.88 120.64 113.45 1req n GLU 42 Ca 0.02 -0.06 -0.20 0.00 -0.01 0.00 0.00 57.16 56.91 1req n GLU 42 Cb 0.35 -1.50 0.06 0.00 -1.01 0.00 0.00 31.44 29.34 1req n GLU 42 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1req n GLN 43 N -1.25 -6.09 -3.79 3.49 6.02 -0.40 -4.98 117.38 110.39 1req n GLN 43 Ca 0.13 0.72 -0.37 0.00 -0.01 0.00 0.00 57.00 57.47 1req n GLN 43 Cb 0.27 -5.35 -0.13 0.00 1.02 0.00 0.00 30.24 26.05 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 -3.22 3.79 0.07 5.09 1.01 -1.26 -4.94 121.20 121.73 1req s ILE 44 Ca 0.44 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 1req s ILE 44 Cb -0.19 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.27 1req s ILE 44 CO 0.54 0.09 1.06 -2.16 0.00 0.00 0.00 174.94 174.47 1req s PRO 45 N 1.47 4.55 -0.27 2.79 0.04 -1.26 -2.22 135.00 140.10 1req s PRO 45 Ca 0.02 1.58 0.02 0.00 0.04 0.00 0.00 61.00 62.66 1req s PRO 45 Cb -0.17 -3.38 0.07 0.00 0.04 0.00 0.00 34.50 31.06 1req s PRO 45 CO 0.01 -0.05 -0.05 0.08 0.04 0.00 0.00 177.00 177.03 1req s VAL 46 N 0.64 1.91 0.00 -0.36 1.01 0.29 -4.93 120.40 118.96 1req s VAL 46 Ca 0.53 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1req s VAL 46 Cb -0.25 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1req s VAL 46 CO 0.30 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.83 1req n GLY 47 N 4.50 -0.73 0.95 4.51 0.00 -1.26 -1.11 105.19 112.05 1req n GLY 47 Ca -0.10 -1.67 0.12 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 -0.70 0.20 -3.64 2.61 -2.24 -1.26 -4.85 114.28 104.40 1req n THR 48 Ca 0.00 -0.55 -0.08 0.00 -2.27 0.00 0.00 64.05 61.15 1req n THR 48 Cb 0.00 1.10 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.77 -0.78 -0.06 3.22 2.96 -1.26 -5.16 118.68 115.84 1req s LEU 49 Ca 0.33 1.31 0.04 0.00 -0.22 0.00 0.00 54.13 55.59 1req s LEU 49 Cb 0.21 2.23 -0.02 0.00 0.50 0.00 0.00 46.19 49.11 1req s LEU 49 CO 0.31 -0.21 -0.17 -0.36 -1.32 0.00 0.00 176.35 174.59 1req s PHE 50 N 1.20 2.63 0.38 5.38 0.40 -1.26 -5.05 117.98 121.66 1req s PHE 50 Ca -0.07 -0.33 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1req s PHE 50 Cb -0.05 -1.64 -0.01 0.00 0.51 0.00 0.00 43.02 41.84 1req s PHE 50 CO -0.14 0.05 0.08 0.09 0.70 0.00 0.00 175.22 176.01 1req n ASN 51 N 2.56 1.85 0.31 1.36 4.13 -1.26 -4.76 115.26 119.45 1req n ASN 51 Ca -0.17 -2.88 0.21 0.00 1.68 0.00 0.00 54.58 53.42 1req n ASN 51 Cb 0.52 0.70 1.10 0.00 -1.54 0.00 0.00 39.78 40.55 1req n ASN 51 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 1req h GLU 52 N 0.00 0.00 0.00 3.52 9.09 -1.99 -1.98 114.58 123.22 1req h GLU 52 Ca -0.30 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.09 1req h GLU 52 Cb 1.06 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.16 1req h GLU 52 CO 0.49 0.00 -0.10 0.38 0.05 0.00 0.00 179.01 179.83 1req h ASP 53 N 0.00 0.00 -0.26 3.06 2.03 -2.02 -2.47 116.42 116.76 1req h ASP 53 Ca 0.00 0.00 0.03 0.00 -0.73 0.00 0.00 57.03 56.33 1req h ASP 53 Cb 0.02 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.51 1req h ASP 53 CO 0.00 0.10 0.17 -0.37 -1.03 0.00 0.00 179.24 178.11 1req h VAL 54 N 0.00 0.98 0.00 4.15 -1.51 -1.75 -3.24 116.25 114.88 1req h VAL 54 Ca -0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1req h VAL 54 Cb 0.20 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.12 1req h VAL 54 CO 0.01 0.04 0.00 1.88 -1.23 0.00 0.00 177.57 178.27 1req h TYR 55 N 0.20 0.00 -0.40 5.19 0.05 -1.67 -3.40 116.97 116.94 1req h TYR 55 Ca 0.11 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.97 1req h TYR 55 Cb 0.19 0.00 -0.09 0.00 1.01 0.00 0.00 36.73 37.84 1req h TYR 55 CO -0.00 0.00 -0.20 -0.22 -1.05 0.00 0.00 178.16 176.69 1req h LYS 56 N 0.00 -0.12 -0.33 4.88 1.63 -1.78 -1.93 116.57 118.93 1req h LYS 56 Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1req h LYS 56 Cb 0.31 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1req h LYS 56 CO 0.00 -0.08 0.00 -0.25 -3.45 0.00 0.00 179.45 175.67 1req n ASP 57 N -5.38 2.22 -4.66 4.20 8.00 -1.26 -4.85 116.55 114.82 1req n ASP 57 Ca 0.02 -1.89 -0.42 0.00 0.71 0.00 0.00 54.79 53.22 1req n ASP 57 Cb 0.29 -0.21 -0.04 0.00 -0.02 0.00 0.00 41.12 41.13 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 -1.57 4.27 0.00 -1.24 -1.94 -0.73 -4.96 119.30 113.12 1req s MET 58 Ca 0.32 1.02 0.21 0.00 -1.71 0.00 0.00 55.69 55.53 1req s MET 58 Cb 0.17 -3.60 0.52 0.00 2.01 0.00 0.00 34.83 33.94 1req s MET 58 CO 0.24 -0.39 1.44 -0.40 -0.01 0.00 0.00 175.02 175.90 1req n ASP 59 N 5.49 3.64 -0.73 3.03 5.68 -1.26 -4.48 116.55 127.92 1req n ASP 59 Ca 0.05 -1.98 0.07 0.00 -0.50 0.00 0.00 54.79 52.42 1req n ASP 59 Cb 0.48 -0.37 0.16 0.00 -1.14 0.00 0.00 41.12 40.25 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 1.44 0.48 0.90 2.11 2.14 -1.26 -4.69 117.44 118.55 1req n TRP 60 Ca 0.21 -0.43 0.09 0.00 2.07 0.00 0.00 57.50 59.44 1req n TRP 60 Cb 0.59 -0.02 0.48 0.00 -0.81 0.00 0.00 31.31 31.54 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 0.71 0.00 -2.70 5.67 4.77 -1.26 -2.85 117.00 121.34 1req n LEU 61 Ca 0.13 0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 56.25 1req n LEU 61 Cb 0.44 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1req n LEU 61 CO 0.09 -0.11 -0.06 -0.67 -1.33 0.00 0.00 177.39 175.32 1req n ASP 62 N -1.28 2.15 -4.76 -1.43 2.03 -1.26 -4.96 116.55 107.04 1req n ASP 62 Ca 0.09 -2.99 -0.30 0.00 0.52 0.00 0.00 54.79 52.11 1req n ASP 62 Cb 0.15 -0.53 -0.07 0.00 -0.72 0.00 0.00 41.12 39.95 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 -3.58 1.55 0.04 5.18 -4.23 -1.13 -5.15 115.64 108.32 1req s THR 63 Ca 0.34 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 59.04 1req s THR 63 Cb 0.43 -2.41 -0.02 0.00 1.34 0.00 0.00 72.50 71.84 1req s THR 63 CO -0.03 0.00 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.60 1req s TYR 64 N -2.79 1.26 0.49 3.99 1.51 -1.26 -5.01 117.35 115.54 1req s TYR 64 Ca 0.21 -0.37 -0.24 0.00 -1.01 0.00 0.00 57.07 55.67 1req s TYR 64 Cb 0.02 -0.75 -0.07 0.00 -0.11 0.00 0.00 41.96 41.06 1req s TYR 64 CO 0.12 0.04 1.40 0.00 -1.11 0.00 0.00 175.55 176.00 1req s ALA 65 N -0.89 3.07 -0.78 3.71 0.00 -1.26 -3.39 121.76 122.22 1req s ALA 65 Ca 0.02 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.39 1req s ALA 65 Cb -0.08 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1req s ALA 65 CO 0.01 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 174.91 1req n GLY 66 N 0.64 0.90 2.84 0.00 0.00 -0.28 -3.99 105.19 105.30 1req n GLY 66 Ca 0.07 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.12 -0.04 0.22 -0.61 1.01 -1.22 -4.70 121.20 113.74 1req s ILE 67 Ca 0.00 0.15 -0.32 0.00 0.00 0.00 0.00 60.65 60.48 1req s ILE 67 Cb 0.00 -0.11 -0.14 0.00 0.01 0.00 0.00 42.46 42.22 1req s ILE 67 CO 0.00 0.06 1.42 -2.65 0.00 0.00 0.00 174.94 173.77 1req n PRO 68 N 3.88 1.99 -0.85 2.79 -0.02 -1.26 -0.62 135.00 140.90 1req n PRO 68 Ca -0.23 0.71 -0.11 0.00 -2.02 0.00 0.00 63.50 61.85 1req n PRO 68 Cb 0.53 -2.38 0.19 0.00 -0.02 0.00 0.00 33.50 31.82 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 2.25 2.60 -3.92 0.52 -0.04 -1.26 -4.98 135.00 130.17 1req n PRO 69 Ca 0.13 -2.31 -0.30 0.00 -0.04 0.00 0.00 63.50 60.97 1req n PRO 69 Cb 0.30 -1.95 0.03 0.00 -0.04 0.00 0.00 33.50 31.83 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 -0.35 -2.30 -0.10 0.54 3.72 0.21 -3.51 117.46 115.67 1req n PHE 70 Ca 0.38 0.91 -0.06 0.00 -0.05 0.00 0.00 57.45 58.62 1req n PHE 70 Cb 1.26 -3.96 0.12 0.00 -0.94 0.00 0.00 39.48 35.95 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 -2.09 1.26 -0.00 -4.37 3.04 -1.84 -1.35 116.25 110.90 1req h VAL 71 Ca -0.58 -1.18 0.00 0.00 -1.01 0.00 0.00 66.70 63.93 1req h VAL 71 Cb 1.38 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 31.71 1req h VAL 71 CO 0.68 0.40 -0.09 1.41 -1.01 0.00 0.00 177.57 178.95 1req n HIS 72 N -4.16 0.00 0.00 3.17 8.25 -1.26 -4.71 115.22 116.51 1req n HIS 72 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1req n HIS 72 Cb 0.37 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1req n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1req n GLY 73 N 1.42 4.21 0.23 -1.41 0.00 -0.51 -4.39 105.19 104.74 1req n GLY 73 Ca 0.10 -1.56 -0.04 0.00 0.00 0.00 0.00 46.02 44.51 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 0.48 -6.26 1.61 0.13 -1.83 -0.74 132.00 125.39 1req h PRO 74 Ca 0.00 -0.21 -0.67 0.00 -0.87 0.00 0.00 66.00 64.25 1req h PRO 74 Cb 0.00 -0.02 -0.17 0.00 0.13 0.00 0.00 31.00 30.95 1req h PRO 74 CO 0.00 0.74 -0.69 0.71 -0.23 0.00 0.00 178.00 178.53 1req s TYR 75 N -4.37 2.92 0.35 1.56 2.02 -1.26 -3.99 117.35 114.58 1req s TYR 75 Ca -0.07 -0.02 0.12 0.00 -0.37 0.00 0.00 57.07 56.73 1req s TYR 75 Cb 0.13 -1.63 0.92 0.00 -0.40 0.00 0.00 41.96 40.98 1req s TYR 75 CO 0.80 0.38 1.77 0.00 -1.57 0.00 0.00 175.55 176.93 1req h ALA 76 N 4.57 1.92 0.00 3.71 0.00 -1.84 -3.10 119.26 124.52 1req h ALA 76 Ca -0.49 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1req h ALA 76 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1req h ALA 76 CO 0.54 -0.32 -1.04 0.25 0.00 0.00 0.00 179.25 178.68 1req n THR 77 N -4.74 0.00 -1.28 0.00 -2.24 -1.26 -4.65 114.28 100.12 1req n THR 77 Ca 0.25 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1req n THR 77 Cb 0.72 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 -1.59 0.00 0.00 -0.78 0.00 -1.18 -2.48 117.12 111.09 1req n MET 78 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.82 1req n MET 78 Cb 0.23 0.00 0.55 0.00 0.00 0.00 0.00 33.22 34.01 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 14.00 0.00 -0.32 2.03 4.01 -1.24 -1.96 117.16 133.68 1req n TYR 79 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 1req n TYR 79 Cb 0.00 -0.41 0.22 0.00 -0.31 0.00 0.00 39.34 38.84 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 2.96 1.47 0.00 -0.72 0.00 -1.17 -3.27 119.26 118.53 1req h ALA 80 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 1req h ALA 80 Cb 0.33 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1req h ALA 80 CO 0.00 0.40 -1.38 0.34 0.00 0.00 0.00 179.25 178.61 1req n PHE 81 N -4.48 0.88 -3.73 0.00 7.35 -1.06 -4.99 117.46 111.43 1req n PHE 81 Ca 0.14 0.38 -0.12 0.00 -0.76 0.00 0.00 57.45 57.09 1req n PHE 81 Cb 0.17 -1.07 -0.12 0.00 0.35 0.00 0.00 39.48 38.81 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 -2.38 0.30 0.78 -4.13 3.52 -0.83 -5.10 118.95 111.11 1req s ARG 82 Ca -0.29 0.59 -0.11 0.00 -0.13 0.00 0.00 55.73 55.78 1req s ARG 82 Cb 0.07 -0.03 0.06 0.00 -1.56 0.00 0.00 34.95 33.49 1req s ARG 82 CO 0.56 -0.14 1.09 -1.25 -0.81 0.00 0.00 175.30 174.75 1req s PRO 83 N 1.06 2.24 1.05 5.12 0.04 -1.26 -3.66 135.00 139.59 1req s PRO 83 Ca -0.07 0.67 -0.13 0.00 0.04 0.00 0.00 61.00 61.51 1req s PRO 83 Cb -0.08 -1.93 0.17 0.00 0.04 0.00 0.00 34.50 32.69 1req s PRO 83 CO -0.08 -1.52 0.74 -2.67 0.04 0.00 0.00 177.00 173.51 1req n TRP 84 N -3.37 -0.73 -2.84 0.56 2.14 -1.26 -4.95 117.44 106.99 1req n TRP 84 Ca 0.07 0.13 -0.41 0.00 2.07 0.00 0.00 57.50 59.36 1req n TRP 84 Cb 0.56 -1.78 -0.04 0.00 -0.81 0.00 0.00 31.31 29.25 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 -2.44 4.90 -0.54 -1.67 2.01 0.22 -4.92 115.64 113.19 1req s THR 85 Ca 0.63 1.78 -0.28 0.00 0.31 0.00 0.00 61.69 64.14 1req s THR 85 Cb -0.21 -4.20 0.00 0.00 0.01 0.00 0.00 72.50 68.10 1req s THR 85 CO 0.64 0.11 1.54 -0.63 -0.69 0.00 0.00 174.62 175.59 1req s ILE 86 N 1.53 3.67 -0.53 1.82 1.01 -1.26 -1.69 121.20 125.74 1req s ILE 86 Ca 0.44 0.56 0.04 0.00 0.00 0.00 0.00 60.65 61.68 1req s ILE 86 Cb -0.18 -4.25 0.16 0.00 0.01 0.00 0.00 42.46 38.20 1req s ILE 86 CO 0.19 -1.03 0.38 -0.60 0.00 0.00 0.00 174.94 173.87 1req s ARG 87 N 5.81 1.60 -0.18 2.79 3.52 -0.06 -1.34 118.95 131.08 1req s ARG 87 Ca 0.58 -2.56 -0.27 0.00 -0.13 0.00 0.00 55.73 53.35 1req s ARG 87 Cb -0.13 -2.41 -0.01 0.00 -1.56 0.00 0.00 34.95 30.85 1req s ARG 87 CO 0.25 -1.30 0.93 -0.65 -0.81 0.00 0.00 175.30 173.72 1req s GLN 88 N -0.46 4.30 0.18 5.12 -1.52 -1.26 -3.64 119.66 122.39 1req s GLN 88 Ca 0.26 1.18 -0.30 0.00 -1.95 0.00 0.00 55.36 54.55 1req s GLN 88 Cb -0.06 -3.59 -0.08 0.00 -0.22 0.00 0.00 33.01 29.06 1req s GLN 88 CO -0.14 -0.42 1.21 -0.47 -0.25 0.00 0.00 175.29 175.22 1req s TYR 89 N 2.46 3.41 0.04 0.91 5.04 -1.26 -3.80 117.35 124.15 1req s TYR 89 Ca 0.42 1.39 -0.27 0.00 -2.44 0.00 0.00 57.07 56.17 1req s TYR 89 Cb -0.16 -3.45 0.08 0.00 0.35 0.00 0.00 41.96 38.78 1req s TYR 89 CO 0.11 -1.29 0.71 0.00 -1.34 0.00 0.00 175.55 173.74 1req s ALA 90 N 0.01 -1.72 0.00 3.97 0.00 -0.25 -4.94 121.76 118.83 1req s ALA 90 Ca 0.53 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.43 1req s ALA 90 Cb -0.33 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1req s ALA 90 CO 0.37 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1req n GLY 91 N 0.14 3.14 3.53 0.00 0.00 -1.26 -1.27 105.19 109.47 1req n GLY 91 Ca -0.16 -0.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.31 -0.48 0.00 1.61 -0.71 -1.26 -3.96 117.98 111.87 1req s PHE 92 Ca 0.00 0.71 0.00 0.00 -1.04 0.00 0.00 56.93 56.60 1req s PHE 92 Cb 0.00 0.46 0.00 0.00 -1.21 0.00 0.00 43.02 42.27 1req s PHE 92 CO 0.00 -0.51 0.00 0.45 -1.34 0.00 0.00 175.22 173.82 1req n SER 93 N 0.54 0.00 -4.98 1.98 2.88 -0.88 -3.98 113.62 109.18 1req n SER 93 Ca -0.14 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.21 1req n SER 93 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 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 3.92 0.11 2.46 -4.23 -1.26 -1.40 115.64 115.24 1req s THR 94 Ca 0.00 -0.88 -0.21 0.00 -1.18 0.00 0.00 61.69 59.42 1req s THR 94 Cb 0.00 -3.37 -0.09 0.00 1.34 0.00 0.00 72.50 70.38 1req s THR 94 CO 0.00 -0.17 1.75 0.00 -0.54 0.00 0.00 174.62 175.65 1req h ALA 95 N 0.74 0.15 -0.57 3.99 0.00 -1.81 0.11 119.26 121.87 1req h ALA 95 Ca -0.45 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.52 1req h ALA 95 Cb 1.26 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1req h ALA 95 CO 0.53 -0.40 0.29 0.87 0.00 0.00 0.00 179.25 180.55 1req h LYS 96 N 0.11 0.54 -0.47 0.00 1.57 -1.92 -0.13 116.57 116.27 1req h LYS 96 Ca 0.06 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1req h LYS 96 Cb 0.03 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 1req h LYS 96 CO -0.06 0.36 -0.17 0.93 -0.57 0.00 0.00 179.45 179.95 1req h GLU 97 N 0.56 0.92 -0.34 3.15 5.08 -1.74 -1.89 114.58 120.31 1req h GLU 97 Ca 0.25 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1req h GLU 97 Cb 0.16 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1req h GLU 97 CO -0.17 1.01 0.21 0.77 -1.00 0.00 0.00 179.01 179.83 1req h SER 98 N 0.81 0.36 0.22 1.42 0.02 -0.75 -1.55 113.55 114.07 1req h SER 98 Ca 0.12 -0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.95 1req h SER 98 Cb 0.71 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 1req h SER 98 CO 0.05 0.26 -0.44 -1.13 -1.14 0.00 0.00 176.83 174.44 1req h ASN 99 N 0.44 0.29 -0.06 3.07 -0.73 -0.96 -0.74 115.58 116.88 1req h ASN 99 Ca 0.13 -0.13 -0.02 0.00 1.87 0.00 0.00 56.30 58.15 1req h ASN 99 Cb -0.02 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 38.48 1req h ASN 99 CO -0.05 0.70 -0.03 0.00 -0.37 0.00 0.00 177.43 177.68 1req h ALA 100 N 1.32 0.09 -0.44 1.57 0.00 -1.12 -1.51 119.26 119.17 1req h ALA 100 Ca 0.02 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 54.77 1req h ALA 100 Cb 0.87 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.56 1req h ALA 100 CO 0.07 -0.16 -0.06 0.35 0.00 0.00 0.00 179.25 179.45 1req h PHE 101 N -0.25 -0.14 -0.31 0.00 3.57 -0.78 -2.04 116.94 116.99 1req h PHE 101 Ca 0.01 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.62 1req h PHE 101 Cb 0.48 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 1req h PHE 101 CO 0.07 -0.15 -0.16 1.88 -2.23 0.00 0.00 178.31 177.72 1req h TYR 102 N 0.05 -0.40 -0.83 0.41 0.05 -1.13 0.17 116.97 115.28 1req h TYR 102 Ca 0.21 0.04 -0.04 0.00 0.05 0.00 0.00 58.73 58.99 1req h TYR 102 Cb 0.32 0.23 -0.04 0.00 1.01 0.00 0.00 36.73 38.25 1req h TYR 102 CO -0.34 -0.24 0.37 0.00 -1.05 0.00 0.00 178.16 176.91 1req h ARG 103 N -0.12 1.21 -0.47 4.88 3.08 -0.77 0.11 114.38 122.31 1req h ARG 103 Ca 0.16 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1req h ARG 103 Cb 0.36 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1req h ARG 103 CO -0.39 0.95 0.12 0.00 -1.07 0.00 0.00 179.97 179.59 1req h ARG 104 N 1.19 0.74 -0.46 0.04 3.08 -0.78 -2.24 114.38 115.95 1req h ARG 104 Ca 0.28 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 60.18 1req h ARG 104 Cb 0.16 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1req h ARG 104 CO -0.03 0.72 0.27 -0.91 -1.07 0.00 0.00 179.97 178.95 1req h ASN 105 N 0.62 0.42 -0.58 7.04 2.35 0.81 -2.57 115.58 123.67 1req h ASN 105 Ca 0.15 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1req h ASN 105 Cb 0.31 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 1req h ASN 105 CO 0.00 0.30 0.32 -0.07 -1.65 0.00 0.00 177.43 176.33 1req h LEU 106 N 0.53 0.72 -1.77 1.61 3.38 -0.78 -2.61 115.31 116.39 1req h LEU 106 Ca 0.19 -0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.15 1req h LEU 106 Cb 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1req h LEU 106 CO -0.09 0.61 0.32 0.00 0.09 0.00 0.00 178.44 179.37 1req h ALA 107 N 1.15 2.09 -0.33 1.53 0.00 -1.17 -2.13 119.26 120.40 1req h ALA 107 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1req h ALA 107 Cb 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1req h ALA 107 CO -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.02 1req n ALA 108 N -2.54 2.47 0.00 0.00 0.00 -0.99 -4.94 120.51 114.50 1req n ALA 108 Ca 0.07 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1req n ALA 108 Cb 0.35 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 1.00 0.81 3.75 0.00 0.00 -0.80 -4.98 105.19 104.97 1req n GLY 109 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.39 4.46 -0.24 1.61 0.74 -1.01 -4.91 119.66 119.93 1req s GLN 110 Ca 0.00 2.01 -0.11 0.00 0.05 0.00 0.00 55.36 57.30 1req s GLN 110 Cb 0.00 -3.16 -0.16 0.00 1.10 0.00 0.00 33.01 30.78 1req s GLN 110 CO 0.00 -0.08 -0.12 1.17 -0.55 0.00 0.00 175.29 175.70 1req n LYS 111 N 1.69 0.62 -4.36 1.67 3.00 -0.72 -4.48 118.16 115.59 1req n LYS 111 Ca 0.02 0.31 -0.27 0.00 -0.00 0.00 0.00 58.31 58.37 1req n LYS 111 Cb 0.43 -1.58 -0.13 0.00 0.00 0.00 0.00 35.03 33.76 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 -5.59 1.46 0.31 3.14 0.00 -0.45 -4.84 107.32 101.35 1req s GLY 112 Ca -0.34 -1.39 -0.06 0.00 0.00 0.00 0.00 44.72 42.93 1req s GLY 112 CO 0.57 -1.38 0.60 1.08 0.00 0.00 0.00 173.10 173.97 1req s LEU 113 N -2.00 4.02 -0.15 0.66 1.43 -1.06 -4.09 118.68 117.49 1req s LEU 113 Ca 0.11 0.80 -0.05 0.00 -1.03 0.00 0.00 54.13 53.96 1req s LEU 113 Cb -0.10 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.57 1req s LEU 113 CO 0.05 -0.23 0.29 -0.55 0.23 0.00 0.00 176.35 176.14 1req s SER 114 N -3.15 0.29 -0.24 2.29 0.15 -1.25 -1.05 113.70 110.74 1req s SER 114 Ca 0.45 0.61 -0.16 0.00 0.70 0.00 0.00 55.95 57.56 1req s SER 114 Cb -0.11 0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 64.98 1req s SER 114 CO 0.30 -0.24 0.40 -0.69 1.20 0.00 0.00 173.24 174.20 1req s VAL 115 N 2.45 5.17 -0.24 4.45 1.01 -0.27 -1.09 120.40 131.89 1req s VAL 115 Ca 0.01 0.65 -0.09 0.00 0.00 0.00 0.00 61.98 62.55 1req s VAL 115 Cb -0.12 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1req s VAL 115 CO -0.10 0.18 0.13 0.00 0.00 0.00 0.00 175.10 175.32 1req s ALA 116 N 1.82 3.47 0.16 5.51 0.00 -0.40 -2.67 121.76 129.64 1req s ALA 116 Ca 0.17 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.23 1req s ALA 116 Cb -0.15 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1req s ALA 116 CO 0.09 -0.26 0.08 -0.06 0.00 0.00 0.00 175.76 175.61 1req s PHE 117 N 1.18 3.04 1.10 0.00 0.08 -1.26 -1.64 117.98 120.49 1req s PHE 117 Ca 0.06 -0.05 -0.13 0.00 0.12 0.00 0.00 56.93 56.94 1req s PHE 117 Cb -0.14 -1.48 0.25 0.00 -0.57 0.00 0.00 43.02 41.08 1req s PHE 117 CO 0.05 0.52 1.06 0.16 -0.10 0.00 0.00 175.22 176.90 1req s ASP 118 N -2.95 1.61 0.22 1.36 1.47 -0.37 -4.09 116.67 113.93 1req s ASP 118 Ca 0.29 1.33 0.01 0.00 1.18 0.00 0.00 52.55 55.36 1req s ASP 118 Cb -0.10 -2.06 0.22 0.00 -0.34 0.00 0.00 42.92 40.63 1req s ASP 118 CO 0.21 -3.78 1.55 -0.07 0.68 0.00 0.00 175.17 173.77 1req h LEU 119 N -2.34 0.42 -0.47 2.11 3.38 -1.90 -2.54 115.31 113.96 1req h LEU 119 Ca -0.59 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.20 1req h LEU 119 Cb 1.34 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.92 1req h LEU 119 CO 0.54 0.89 0.22 -0.65 0.09 0.00 0.00 178.44 179.53 1req h PRO 120 N 0.29 0.43 -0.47 1.13 0.11 -1.87 -0.99 132.00 130.63 1req h PRO 120 Ca 0.00 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.09 1req h PRO 120 Cb 1.06 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1req h PRO 120 CO 0.09 0.29 0.30 1.15 -0.21 0.00 0.00 178.00 179.62 1req h THR 121 N 0.44 1.11 -0.41 -1.15 2.02 -1.65 0.08 112.91 113.36 1req h THR 121 Ca 0.21 -0.21 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1req h THR 121 Cb 0.14 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 1req h THR 121 CO -0.16 0.11 0.19 0.45 0.37 0.00 0.00 175.52 176.48 1req h HIS 122 N 0.62 0.34 -0.19 3.16 3.86 -0.90 -2.68 115.15 119.36 1req h HIS 122 Ca 0.17 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1req h HIS 122 Cb -0.06 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.32 1req h HIS 122 CO -0.05 0.17 0.00 0.54 0.86 0.00 0.00 177.93 179.45 1req n ARG 123 N -4.94 2.00 -2.44 2.45 1.74 -0.46 -1.98 116.66 113.03 1req n ARG 123 Ca 0.02 -0.93 -0.04 0.00 -0.77 0.00 0.00 57.85 56.13 1req n ARG 123 Cb 0.12 -1.57 0.01 0.00 -1.02 0.00 0.00 32.46 30.00 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 0.40 0.49 3.36 -0.13 0.00 -0.84 -4.92 105.19 103.54 1req n GLY 124 Ca 0.08 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.70 2.40 0.74 1.61 2.02 -0.04 -4.25 117.35 117.13 1req s TYR 125 Ca 0.06 -0.38 -0.11 0.00 -0.37 0.00 0.00 57.07 56.27 1req s TYR 125 Cb -0.03 -1.48 0.04 0.00 -0.40 0.00 0.00 41.96 40.09 1req s TYR 125 CO 0.08 0.07 1.12 -0.51 -1.57 0.00 0.00 175.55 174.74 1req s ASP 126 N -0.89 5.06 0.02 2.29 1.01 -1.26 -3.89 116.67 119.02 1req s ASP 126 Ca 0.11 0.97 0.23 0.00 0.71 0.00 0.00 52.55 54.56 1req s ASP 126 Cb -0.10 -1.64 0.95 0.00 1.01 0.00 0.00 42.92 43.14 1req s ASP 126 CO 0.01 -1.57 1.72 -1.20 0.21 0.00 0.00 175.17 174.34 1req n SER 127 N -3.12 0.08 -0.32 0.27 7.64 -1.26 -2.27 113.62 114.64 1req n SER 127 Ca 0.07 0.51 0.12 0.00 1.01 0.00 0.00 58.87 60.58 1req n SER 127 Cb 0.59 -0.53 0.15 0.00 -1.01 0.00 0.00 64.21 63.40 1req n SER 127 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1req n ASP 128 N -1.58 1.45 -4.66 6.43 5.68 -1.26 -4.79 116.55 117.82 1req n ASP 128 Ca 0.05 -1.15 -0.42 0.00 -0.50 0.00 0.00 54.79 52.77 1req n ASP 128 Cb 0.27 0.38 -0.03 0.00 -1.14 0.00 0.00 41.12 40.61 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 -2.57 6.52 0.38 -1.12 3.84 -0.96 -4.89 114.94 116.14 1req s ASN 129 Ca 0.19 2.53 0.05 0.00 0.21 0.00 0.00 52.86 55.85 1req s ASN 129 Cb 0.18 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 39.10 1req s ASN 129 CO 0.59 -1.00 2.02 1.55 -2.79 0.00 0.00 177.10 177.47 1req h PRO 130 N 10.03 0.64 0.00 0.43 0.13 -1.89 -2.85 132.00 138.49 1req h PRO 130 Ca -0.46 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1req h PRO 130 Cb 1.22 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1req h PRO 130 CO 0.94 0.45 -0.08 0.00 -0.23 0.00 0.00 178.00 179.08 1req h ARG 131 N 0.66 0.00 -0.10 0.86 3.08 -1.97 -3.02 114.38 113.88 1req h ARG 131 Ca 0.17 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1req h ARG 131 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1req h ARG 131 CO -0.03 0.08 -0.10 1.33 -1.07 0.00 0.00 179.97 180.17 1req n VAL 132 N -3.77 2.13 -0.24 2.04 0.24 -1.08 -4.83 118.33 112.82 1req n VAL 132 Ca -0.02 -2.43 -0.02 0.00 -2.04 0.00 0.00 64.34 59.82 1req n VAL 132 Cb 0.18 -0.25 0.09 0.00 -1.47 0.00 0.00 33.84 32.38 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 0.71 0.90 0.00 2.33 0.00 -1.57 -2.62 119.26 119.01 1req h ALA 133 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1req h ALA 133 Cb 1.18 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1req h ALA 133 CO 0.10 0.12 -0.08 0.78 0.00 0.00 0.00 179.25 180.17 1req h GLY 134 N 0.76 0.00 -2.27 0.00 0.00 -1.88 -2.85 103.07 96.83 1req h GLY 134 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 1req h GLY 134 CO -0.15 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.61 1req n ASP 135 N -3.37 3.32 -4.61 0.19 8.00 -0.99 -4.78 116.55 114.31 1req n ASP 135 Ca -0.01 -1.99 -0.43 0.00 0.71 0.00 0.00 54.79 53.07 1req n ASP 135 Cb 0.25 -0.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 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 -1.21 3.94 -0.27 2.53 1.01 -1.08 -2.68 120.40 122.64 1req s VAL 136 Ca 0.41 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.37 1req s VAL 136 Cb 0.22 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1req s VAL 136 CO 0.29 -0.69 0.00 0.61 0.00 0.00 0.00 175.10 175.31 1req n GLY 137 N 4.92 0.56 0.13 4.51 0.00 -1.26 -4.71 105.19 109.34 1req n GLY 137 Ca 0.16 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.65 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 0.41 0.35 0.00 1.61 2.07 -1.84 -2.34 114.93 115.19 1req h MET 138 Ca -0.05 -0.60 0.00 0.00 -2.07 0.00 0.00 59.70 56.98 1req h MET 138 Cb 0.33 0.22 0.00 0.00 -1.87 0.00 0.00 31.60 30.28 1req h MET 138 CO 0.08 1.25 -1.13 0.00 1.07 0.00 0.00 176.91 178.17 1req n ALA 139 N -2.76 3.88 0.00 6.32 0.00 -1.26 -4.93 120.51 121.76 1req n ALA 139 Ca -0.20 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1req n ALA 139 Cb 1.07 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 1.43 -0.77 3.72 0.00 0.00 -1.26 -4.69 105.19 103.62 1req n GLY 140 Ca 0.01 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 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 4.50 -0.43 1.61 0.11 -0.65 -3.14 120.40 119.40 1req s VAL 141 Ca 0.00 1.84 -0.29 0.00 -2.93 0.00 0.00 61.98 60.61 1req s VAL 141 Cb 0.00 -4.18 0.01 0.00 -1.53 0.00 0.00 36.38 30.68 1req s VAL 141 CO 0.00 0.17 1.43 0.00 -3.33 0.00 0.00 175.10 173.37 1req s ALA 142 N 0.82 3.00 -0.16 1.54 0.00 -0.49 -1.24 121.76 125.22 1req s ALA 142 Ca 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 1req s ALA 142 Cb -0.24 -3.97 -0.01 0.00 0.00 0.00 0.00 23.12 18.90 1req s ALA 142 CO 0.29 -2.49 -0.13 0.42 0.00 0.00 0.00 175.76 173.85 1req s ILE 143 N 5.61 2.88 -0.01 0.00 -1.09 -1.26 -4.58 121.20 122.74 1req s ILE 143 Ca 0.61 -0.69 0.01 0.00 -2.23 0.00 0.00 60.65 58.34 1req s ILE 143 Cb -0.13 -2.24 -0.01 0.00 -1.58 0.00 0.00 42.46 38.50 1req s ILE 143 CO 0.32 0.50 -0.01 0.47 -1.23 0.00 0.00 174.94 174.99 1req n ASP 144 N 4.12 4.25 -1.50 3.58 8.00 -1.26 -4.75 116.55 128.99 1req n ASP 144 Ca -0.19 -0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.27 1req n ASP 144 Cb 0.52 0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.84 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 -2.32 -0.39 -0.23 -2.24 3.41 -1.26 -0.12 113.62 110.47 1req n SER 145 Ca -0.02 -1.47 0.11 0.00 -0.26 0.00 0.00 58.87 57.22 1req n SER 145 Cb 0.53 0.71 0.39 0.00 -0.26 0.00 0.00 64.21 65.58 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 1.26 0.89 -0.49 -1.33 6.09 -1.84 -2.33 117.51 119.77 1req h ILE 146 Ca -0.07 -0.23 0.10 0.00 -1.37 0.00 0.00 64.86 63.28 1req h ILE 146 Cb 0.31 0.16 -0.10 0.00 0.47 0.00 0.00 36.82 37.65 1req h ILE 146 CO 0.10 0.12 -0.26 1.88 -3.07 0.00 0.00 178.15 176.92 1req h TYR 147 N 0.67 -0.68 -0.47 2.19 -1.99 -1.96 -1.17 116.97 113.55 1req h TYR 147 Ca 0.39 0.06 -0.14 0.00 2.00 0.00 0.00 58.73 61.04 1req h TYR 147 Cb 0.59 0.37 -0.01 0.00 2.00 0.00 0.00 36.73 39.68 1req h TYR 147 CO -0.00 -0.33 -0.23 -0.44 -0.00 0.00 0.00 178.16 177.15 1req h ASP 148 N -0.15 1.02 -0.28 3.88 3.32 -1.80 -2.78 116.42 119.64 1req h ASP 148 Ca 0.22 -0.40 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 1req h ASP 148 Cb 0.50 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1req h ASP 148 CO -0.58 1.20 -0.29 0.24 -1.72 0.00 0.00 179.24 178.09 1req h MET 149 N 0.85 0.79 -0.49 3.56 2.86 -1.41 -1.57 114.93 119.51 1req h MET 149 Ca 0.11 -0.35 0.03 0.00 -2.06 0.00 0.00 59.70 57.43 1req h MET 149 Cb 0.82 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.42 1req h MET 149 CO 0.07 0.98 0.27 0.00 1.06 0.00 0.00 176.91 179.29 1req h ARG 150 N 0.67 0.52 -0.04 1.72 3.08 -1.23 -3.10 114.38 116.00 1req h ARG 150 Ca 0.08 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.96 1req h ARG 150 Cb 0.82 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1req h ARG 150 CO 0.07 0.34 -0.62 0.93 -1.07 0.00 0.00 179.97 179.63 1req h GLU 151 N 0.54 0.15 -0.29 0.04 5.08 -1.18 -2.49 114.58 116.43 1req h GLU 151 Ca 0.21 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1req h GLU 151 Cb 0.08 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1req h GLU 151 CO -0.12 0.72 0.11 1.25 -1.00 0.00 0.00 179.01 179.97 1req h LEU 152 N 0.11 0.14 -3.17 1.33 5.85 -1.23 -2.95 115.31 115.38 1req h LEU 152 Ca -0.01 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1req h LEU 152 Cb 1.11 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1req h LEU 152 CO 0.09 0.11 0.00 0.49 -0.34 0.00 0.00 178.44 178.79 1req n PHE 153 N -5.01 1.24 -1.70 1.25 3.72 -1.18 -4.39 117.46 111.39 1req n PHE 153 Ca -0.01 -0.67 -0.42 0.00 -0.05 0.00 0.00 57.45 56.31 1req n PHE 153 Cb 0.09 -0.25 -0.03 0.00 -0.94 0.00 0.00 39.48 38.35 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 -2.01 3.65 0.00 4.37 0.00 -0.94 -1.68 121.76 125.15 1req s ALA 154 Ca 0.45 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.77 1req s ALA 154 Cb 0.30 -3.81 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1req s ALA 154 CO 0.19 -1.43 0.00 0.41 0.00 0.00 0.00 175.76 174.92 1req n GLY 155 N 4.41 0.53 2.82 0.00 0.00 -1.26 -5.01 105.19 106.68 1req n GLY 155 Ca 0.19 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.00 1.67 -0.20 -0.61 1.01 -0.68 -5.09 121.20 115.31 1req s ILE 156 Ca 0.00 -2.43 -0.32 0.00 0.00 0.00 0.00 60.65 57.90 1req s ILE 156 Cb 0.00 -2.20 -0.09 0.00 0.01 0.00 0.00 42.46 40.18 1req s ILE 156 CO 0.00 -0.78 2.09 -2.65 0.00 0.00 0.00 174.94 173.60 1req n PRO 157 N 3.85 1.84 0.00 2.79 -0.02 -1.26 -4.88 135.00 137.32 1req n PRO 157 Ca 0.05 0.59 0.14 0.00 -2.02 0.00 0.00 63.50 62.26 1req n PRO 157 Cb 0.37 -2.82 0.68 0.00 -0.02 0.00 0.00 33.50 31.71 1req n PRO 157 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1req n LEU 158 N 9.31 0.23 0.07 2.45 4.77 -1.26 -2.16 117.00 130.41 1req n LEU 158 Ca 0.30 0.14 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 1req n LEU 158 Cb 0.34 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1req n LEU 158 CO 0.71 0.04 -0.01 -0.90 -1.33 0.00 0.00 177.39 175.91 1req n ASP 159 N -1.13 0.68 -0.00 -1.43 5.75 -1.26 -4.07 116.55 115.08 1req n ASP 159 Ca 0.14 0.13 0.08 0.00 -0.01 0.00 0.00 54.79 55.13 1req n ASP 159 Cb 0.26 0.64 -0.12 0.00 -1.03 0.00 0.00 41.12 40.87 1req n ASP 159 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1req n GLN 160 N -2.36 0.97 -4.28 0.11 6.02 -0.92 -4.94 117.38 111.97 1req n GLN 160 Ca 0.01 -0.09 -0.27 0.00 -0.01 0.00 0.00 57.00 56.64 1req n GLN 160 Cb 0.51 -1.35 -0.09 0.00 1.02 0.00 0.00 30.24 30.32 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 -2.91 2.09 -0.25 -1.09 -1.94 -0.96 -5.08 119.30 109.16 1req s MET 161 Ca -0.01 -1.25 -0.05 0.00 -1.71 0.00 0.00 55.69 52.67 1req s MET 161 Cb 0.12 -2.18 -0.00 0.00 2.01 0.00 0.00 34.83 34.78 1req s MET 161 CO 0.70 0.44 0.01 0.45 -0.01 0.00 0.00 175.02 176.60 1req s SER 162 N -2.82 4.67 -0.14 3.03 0.15 -1.26 -4.32 113.70 113.01 1req s SER 162 Ca 0.25 -0.51 0.02 0.00 0.70 0.00 0.00 55.95 56.41 1req s SER 162 Cb -0.09 -1.80 0.01 0.00 -1.71 0.00 0.00 66.02 62.44 1req s SER 162 CO 0.15 -0.08 -0.19 -0.69 1.20 0.00 0.00 173.24 173.63 1req s VAL 163 N 1.49 1.82 0.03 4.45 1.01 -1.00 -2.56 120.40 125.64 1req s VAL 163 Ca 0.04 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 1req s VAL 163 Cb -0.15 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1req s VAL 163 CO -0.01 0.50 0.16 -0.55 0.00 0.00 0.00 175.10 175.21 1req s SER 164 N 1.01 6.15 -0.09 3.32 0.15 -0.21 -1.60 113.70 122.42 1req s SER 164 Ca -0.04 0.24 -0.03 0.00 0.70 0.00 0.00 55.95 56.82 1req s SER 164 Cb -0.15 -1.86 0.04 0.00 -1.71 0.00 0.00 66.02 62.35 1req s SER 164 CO -0.04 0.22 0.06 -0.04 1.20 0.00 0.00 173.24 174.63 1req s MET 165 N -2.18 0.11 -0.75 5.44 -1.94 0.04 -1.12 119.30 118.90 1req s MET 165 Ca 0.30 0.15 -0.21 0.00 -1.71 0.00 0.00 55.69 54.22 1req s MET 165 Cb -0.13 -1.07 0.09 0.00 2.01 0.00 0.00 34.83 35.73 1req s MET 165 CO 0.22 -0.45 1.03 0.99 -0.01 0.00 0.00 175.02 176.80 1req s THR 166 N 2.11 4.42 -0.23 2.05 2.01 -1.09 -1.29 115.64 123.62 1req s THR 166 Ca 0.04 -0.73 -0.11 0.00 0.31 0.00 0.00 61.69 61.21 1req s THR 166 Cb -0.14 -4.73 0.09 0.00 0.01 0.00 0.00 72.50 67.74 1req s THR 166 CO -0.05 -1.49 0.54 -0.32 -0.69 0.00 0.00 174.62 172.60 1req s MET 167 N 3.71 0.50 0.05 4.92 0.00 -1.26 -4.57 119.30 122.64 1req s MET 167 Ca 0.26 1.11 0.00 0.00 0.00 0.00 0.00 55.69 57.06 1req s MET 167 Cb -0.13 0.31 0.00 0.00 0.00 0.00 0.00 34.83 35.01 1req s MET 167 CO 0.04 -0.19 0.00 0.09 0.00 0.00 0.00 175.02 174.96 1req n ASN 168 N 4.82 0.51 0.19 1.11 3.02 -1.26 -1.35 115.26 122.30 1req n ASN 168 Ca -0.16 0.07 -0.08 0.00 -0.03 0.00 0.00 54.58 54.38 1req n ASN 168 Cb 0.53 -0.15 -0.04 0.00 -0.61 0.00 0.00 39.78 39.52 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 0.00 -0.54 -3.02 7.41 0.00 -1.69 -3.32 103.07 101.91 1req h GLY 169 Ca 0.00 0.20 -0.12 0.00 0.00 0.00 0.00 47.33 47.41 1req h GLY 169 CO 0.00 -0.20 0.15 0.00 0.00 0.00 0.00 176.54 176.50 1req n ALA 170 N -2.43 4.15 -0.15 3.60 0.00 -0.84 -4.61 120.51 120.23 1req n ALA 170 Ca -0.06 -0.62 -0.11 0.00 0.00 0.00 0.00 53.44 52.64 1req n ALA 170 Cb 0.20 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 0.83 1.27 0.83 0.00 3.04 -1.86 -2.82 116.25 117.55 1req h VAL 171 Ca 0.11 -1.24 -0.04 0.00 -1.01 0.00 0.00 66.70 64.52 1req h VAL 171 Cb 1.04 1.15 -0.00 0.00 -2.01 0.00 0.00 31.29 31.47 1req h VAL 171 CO 0.28 0.42 -0.48 -0.07 -1.01 0.00 0.00 177.57 176.72 1req h LEU 172 N 0.71 -1.18 -0.71 3.16 3.38 -1.90 0.34 115.31 119.10 1req h LEU 172 Ca 0.11 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1req h LEU 172 Cb 0.67 0.33 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1req h LEU 172 CO 0.05 -0.75 0.42 1.55 0.09 0.00 0.00 178.44 179.80 1req h PRO 173 N -1.21 0.97 0.07 1.13 0.13 -1.92 0.41 132.00 131.58 1req h PRO 173 Ca -0.11 -0.09 -0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1req h PRO 173 Cb 0.96 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1req h PRO 173 CO 0.13 0.70 -0.03 0.82 -0.23 0.00 0.00 178.00 179.39 1req h ILE 174 N 0.97 1.00 -0.76 -3.56 1.08 -1.44 -0.18 117.51 114.63 1req h ILE 174 Ca 0.25 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 1req h ILE 174 Cb -0.02 1.16 -0.04 0.00 -3.07 0.00 0.00 36.82 34.86 1req h ILE 174 CO -0.05 0.06 0.48 0.25 -0.69 0.00 0.00 178.15 178.20 1req h LEU 175 N -0.21 0.89 -0.63 1.44 5.85 -0.91 -1.24 115.31 120.51 1req h LEU 175 Ca -0.01 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1req h LEU 175 Cb 0.18 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1req h LEU 175 CO 0.02 0.67 0.11 0.00 -0.34 0.00 0.00 178.44 178.90 1req h ALA 176 N 1.26 0.84 -0.66 1.25 0.00 -0.87 -2.02 119.26 119.06 1req h ALA 176 Ca 0.27 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1req h ALA 176 Cb -0.07 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1req h ALA 176 CO -0.06 0.60 0.41 -0.07 0.00 0.00 0.00 179.25 180.13 1req h LEU 177 N 0.96 0.77 -0.28 0.00 3.38 -0.72 -0.79 115.31 118.64 1req h LEU 177 Ca 0.19 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1req h LEU 177 Cb 0.43 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1req h LEU 177 CO 0.01 0.58 0.11 0.22 0.09 0.00 0.00 178.44 179.46 1req h TYR 178 N 0.90 0.42 -0.83 1.13 3.20 -0.98 -1.20 116.97 119.61 1req h TYR 178 Ca 0.24 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.14 1req h TYR 178 Cb -0.06 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.03 1req h TYR 178 CO 0.00 0.42 0.51 0.28 -1.64 0.00 0.00 178.16 177.73 1req h VAL 179 N 0.30 1.02 -0.19 1.81 2.07 -1.00 -1.39 116.25 118.87 1req h VAL 179 Ca 0.09 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1req h VAL 179 Cb 0.18 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 1req h VAL 179 CO -0.01 0.17 0.05 0.58 0.02 0.00 0.00 177.57 178.38 1req h VAL 180 N 0.93 1.20 -0.30 2.57 2.07 -1.16 -0.51 116.25 121.05 1req h VAL 180 Ca 0.37 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.31 1req h VAL 180 Cb 0.19 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 1req h VAL 180 CO -0.18 0.19 -0.01 0.74 0.02 0.00 0.00 177.57 178.34 1req h THR 181 N 0.12 0.77 -0.57 2.57 2.02 -0.64 -2.24 112.91 114.95 1req h THR 181 Ca 0.06 -0.03 0.06 0.00 0.77 0.00 0.00 66.41 67.28 1req h THR 181 Cb 0.25 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 1req h THR 181 CO -0.00 0.01 0.27 0.00 0.37 0.00 0.00 175.52 176.18 1req h ALA 182 N 1.26 0.75 -0.84 6.16 0.00 -1.12 -2.92 119.26 122.55 1req h ALA 182 Ca 0.14 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1req h ALA 182 Cb 0.19 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.87 1req h ALA 182 CO -0.25 -0.09 0.50 1.49 0.00 0.00 0.00 179.25 180.90 1req h GLU 183 N 0.51 0.84 0.00 0.00 4.81 -0.50 -0.52 114.58 119.73 1req h GLU 183 Ca 0.27 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1req h GLU 183 Cb 0.22 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1req h GLU 183 CO -0.21 0.56 0.00 0.93 -0.73 0.00 0.00 179.01 179.56 1req h GLU 184 N 0.87 0.00 0.00 1.92 5.08 -1.29 0.54 114.58 121.70 1req h GLU 184 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 1req h GLU 184 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1req h GLU 184 CO -0.22 0.00 -0.57 1.04 -1.00 0.00 0.00 179.01 178.26 1req n GLN 185 N -2.59 0.16 -0.32 2.33 6.02 -0.83 -4.95 117.38 117.20 1req n GLN 185 Ca -0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1req n GLN 185 Cb 0.17 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 29.83 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 1.41 0.81 3.39 1.08 0.00 0.18 -5.05 105.19 107.01 1req n GLY 186 Ca 0.04 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 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 4.36 0.99 1.61 1.01 -0.27 -4.99 120.40 121.12 1req s VAL 187 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 1req s VAL 187 Cb 0.00 -3.30 0.19 0.00 0.00 0.00 0.00 36.38 33.27 1req s VAL 187 CO 0.00 -0.01 1.08 -1.59 0.00 0.00 0.00 175.10 174.58 1req s LYS 188 N 1.55 0.44 0.38 2.72 0.00 -1.26 -3.44 119.74 120.12 1req s LYS 188 Ca 0.03 0.99 0.09 0.00 0.00 0.00 0.00 55.97 57.08 1req s LYS 188 Cb -0.18 -1.70 0.75 0.00 0.00 0.00 0.00 37.83 36.70 1req s LYS 188 CO 0.05 -2.85 1.90 -1.35 0.00 0.00 0.00 175.35 173.10 1req h PRO 189 N -2.00 0.27 0.00 1.78 0.11 -1.92 -3.08 132.00 127.16 1req h PRO 189 Ca -0.52 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.52 1req h PRO 189 Cb 1.30 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1req h PRO 189 CO 0.50 0.41 0.00 -0.85 -0.21 0.00 0.00 178.00 177.85 1req n GLU 190 N -4.27 0.21 0.00 1.05 0.00 -1.12 -2.91 120.64 113.61 1req n GLU 190 Ca -0.00 0.34 0.13 0.00 0.00 0.00 0.00 57.16 57.62 1req n GLU 190 Cb 0.27 -1.83 0.38 0.00 0.00 0.00 0.00 31.44 30.26 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 -2.21 1.01 -2.80 3.44 6.02 -1.16 -4.51 117.38 117.16 1req n GLN 191 Ca 0.03 -0.61 -0.42 0.00 -0.01 0.00 0.00 57.00 55.99 1req n GLN 191 Cb 0.30 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 30.03 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 -2.41 4.03 -0.10 1.08 1.43 -1.14 -4.60 118.68 116.96 1req s LEU 192 Ca 0.26 0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 54.20 1req s LEU 192 Cb 0.19 -3.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.09 1req s LEU 192 CO 0.49 -0.73 0.01 0.00 0.23 0.00 0.00 176.35 176.35 1req s ALA 193 N 3.26 3.31 0.00 4.21 0.00 -1.26 -3.33 121.76 127.94 1req s ALA 193 Ca 0.38 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1req s ALA 193 Cb -0.13 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1req s ALA 193 CO 0.13 0.53 0.00 0.41 0.00 0.00 0.00 175.76 176.83 1req n GLY 194 N 2.35 0.07 3.23 0.00 0.00 -1.25 -2.37 105.19 107.23 1req n GLY 194 Ca -0.18 -1.48 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.91 0.02 -0.11 2.61 2.01 -0.63 -0.33 115.64 116.30 1req s THR 195 Ca 0.00 -0.15 0.03 0.00 0.31 0.00 0.00 61.69 61.87 1req s THR 195 Cb 0.00 -0.52 -0.00 0.00 0.01 0.00 0.00 72.50 71.99 1req s THR 195 CO 0.00 -0.08 -0.21 -0.51 -0.69 0.00 0.00 174.62 173.13 1req s ILE 196 N -0.30 2.35 0.04 1.82 1.10 -1.18 -0.78 121.20 124.24 1req s ILE 196 Ca -0.04 -0.92 -0.21 0.00 -0.51 0.00 0.00 60.65 58.97 1req s ILE 196 Cb -0.03 -1.93 -0.11 0.00 0.15 0.00 0.00 42.46 40.54 1req s ILE 196 CO 0.02 0.55 1.32 -0.61 -2.11 0.00 0.00 174.94 174.10 1req h GLN 197 N 6.73 -0.71 -3.61 3.50 4.15 -1.23 -3.24 115.11 120.70 1req h GLN 197 Ca -0.21 0.05 -0.35 0.00 0.77 0.00 0.00 58.65 58.91 1req h GLN 197 Cb 1.23 0.16 0.04 0.00 0.21 0.00 0.00 27.48 29.12 1req h GLN 197 CO 0.50 -0.47 -0.50 -1.71 -1.93 0.00 0.00 178.83 174.71 1req n ASN 198 N -4.06 -5.39 -3.97 -0.69 4.05 -0.46 -0.74 115.26 104.00 1req n ASN 198 Ca -0.09 -0.20 -0.31 0.00 0.45 0.00 0.00 54.58 54.43 1req n ASN 198 Cb 0.30 -4.27 -0.14 0.00 1.23 0.00 0.00 39.78 36.89 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 -2.66 4.44 0.33 1.20 -1.08 -1.26 -4.76 116.67 112.87 1req s ASP 199 Ca 0.21 -2.88 0.19 0.00 -0.52 0.00 0.00 52.55 49.56 1req s ASP 199 Cb -0.09 -1.65 0.16 0.00 -1.46 0.00 0.00 42.92 39.87 1req s ASP 199 CO 0.26 -0.26 1.45 -0.29 0.52 0.00 0.00 175.17 176.84 1req h ILE 200 N 5.65 0.42 -0.67 4.11 6.09 -1.90 -3.31 117.51 127.90 1req h ILE 200 Ca -0.07 -1.61 -0.01 0.00 -1.37 0.00 0.00 64.86 61.80 1req h ILE 200 Cb 0.91 2.16 -0.03 0.00 0.47 0.00 0.00 36.82 40.33 1req h ILE 200 CO 0.67 0.24 0.38 -0.07 -3.07 0.00 0.00 178.15 176.30 1req h LEU 201 N 0.00 0.81 -0.26 2.19 3.38 -1.99 0.39 115.31 119.84 1req h LEU 201 Ca -0.01 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1req h LEU 201 Cb 1.21 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1req h LEU 201 CO 0.03 0.64 -0.12 0.07 0.09 0.00 0.00 178.44 179.15 1req h LYS 202 N 0.93 0.00 -0.60 1.13 5.09 -1.91 -2.33 116.57 118.88 1req h LYS 202 Ca 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 60.91 1req h LYS 202 Cb -0.00 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.30 1req h LYS 202 CO -0.04 0.12 0.09 0.93 -2.09 0.00 0.00 179.45 178.46 1req h GLU 203 N 0.00 0.99 -0.53 0.07 4.39 -1.02 0.19 114.58 118.67 1req h GLU 203 Ca -0.00 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.38 1req h GLU 203 Cb 1.00 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 1req h GLU 203 CO 0.02 0.94 0.14 0.74 -1.16 0.00 0.00 179.01 179.68 1req h PHE 204 N 0.90 0.88 0.02 4.33 0.04 -1.26 -0.29 116.94 121.56 1req h PHE 204 Ca 0.18 -0.10 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 1req h PHE 204 Cb 0.43 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1req h PHE 204 CO 0.03 0.76 -0.01 1.98 -0.60 0.00 0.00 178.31 180.47 1req h MET 205 N 0.74 -0.03 0.00 1.51 4.05 -1.38 -3.44 114.93 116.38 1req h MET 205 Ca 0.17 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.59 1req h MET 205 Cb 0.32 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 1req h MET 205 CO -0.00 0.41 0.00 1.33 0.23 0.00 0.00 176.91 178.88 1req n VAL 206 N -4.89 0.00 0.05 -5.77 0.24 0.51 -4.53 118.33 103.94 1req n VAL 206 Ca -0.08 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.28 1req n VAL 206 Cb 0.23 0.05 -0.06 0.00 -1.47 0.00 0.00 33.84 32.59 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 0.00 0.62 -2.34 7.34 0.00 -0.33 -4.88 116.66 117.07 1req n ARG 207 Ca 0.00 0.12 -0.16 0.00 -0.00 0.00 0.00 57.85 57.81 1req n ARG 207 Cb 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 32.46 30.68 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 -2.72 -4.77 -0.48 6.15 3.02 -0.15 -4.80 115.26 111.51 1req n ASN 208 Ca -0.06 -0.03 0.07 0.00 -0.03 0.00 0.00 54.58 54.53 1req n ASN 208 Cb 0.69 -3.87 0.18 0.00 -0.61 0.00 0.00 39.78 36.17 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 -4.03 2.02 -1.04 3.41 -2.24 -1.26 -4.73 114.28 106.42 1req n THR 209 Ca -0.18 -2.87 -0.30 0.00 -2.27 0.00 0.00 64.05 58.43 1req n THR 209 Cb 0.64 -0.19 0.15 0.00 -2.10 0.00 0.00 70.33 68.83 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 -3.00 2.12 0.05 4.78 -0.85 -1.26 -3.26 117.35 115.93 1req s TYR 210 Ca 0.36 1.43 0.00 0.00 -0.52 0.00 0.00 57.07 58.33 1req s TYR 210 Cb 0.34 -3.16 0.00 0.00 0.38 0.00 0.00 41.96 39.52 1req s TYR 210 CO -0.04 -2.52 0.00 -0.89 -1.52 0.00 0.00 175.55 170.58 1req n ILE 211 N -4.00 0.48 -2.60 -3.49 5.41 -1.26 -4.88 119.36 109.03 1req n ILE 211 Ca 0.08 0.16 -0.29 0.00 1.00 0.00 0.00 62.75 63.70 1req n ILE 211 Cb 0.54 -1.16 -0.01 0.00 -0.71 0.00 0.00 39.64 38.29 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 3.53 0.95 1.39 2.02 -1.26 -1.25 117.35 121.30 1req s TYR 212 Ca 0.00 1.01 -0.11 0.00 -0.37 0.00 0.00 57.07 57.60 1req s TYR 212 Cb 0.00 -2.44 0.13 0.00 -0.40 0.00 0.00 41.96 39.25 1req s TYR 212 CO 0.00 -0.27 0.97 -2.30 -1.57 0.00 0.00 175.55 172.38 1req n PRO 213 N -1.90 -0.58 -0.18 -1.71 -0.02 -1.26 -4.57 135.00 124.78 1req n PRO 213 Ca 0.02 -0.11 -0.08 0.00 -2.02 0.00 0.00 63.50 61.32 1req n PRO 213 Cb 0.54 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.76 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 -1.89 -0.22 0.46 0.52 0.11 -1.98 -0.77 132.00 128.22 1req h PRO 214 Ca -0.44 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1req h PRO 214 Cb 1.28 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 1req h PRO 214 CO 0.40 -0.15 -0.51 0.37 -0.21 0.00 0.00 178.00 177.90 1req h GLN 215 N -0.23 -0.95 -0.06 1.05 -0.00 -1.99 -1.19 115.11 111.73 1req h GLN 215 Ca 0.19 0.06 -0.06 0.00 -0.00 0.00 0.00 58.65 58.84 1req h GLN 215 Cb 0.56 0.21 -0.01 0.00 0.00 0.00 0.00 27.48 28.25 1req h GLN 215 CO -0.64 -0.63 -0.24 -1.00 0.00 0.00 0.00 178.83 176.32 1req h PRO 216 N -0.98 0.11 -0.51 -2.39 0.13 -1.94 -1.46 132.00 124.96 1req h PRO 216 Ca -0.06 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.06 1req h PRO 216 Cb 0.87 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.95 1req h PRO 216 CO -0.09 0.35 0.31 0.77 -0.23 0.00 0.00 178.00 179.10 1req h SER 217 N 0.10 0.50 -0.78 1.44 0.02 -0.64 -1.09 113.55 113.11 1req h SER 217 Ca 0.02 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1req h SER 217 Cb 0.48 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 1req h SER 217 CO 0.03 0.36 0.44 -0.03 -1.14 0.00 0.00 176.83 176.49 1req h MET 218 N 0.62 1.09 -0.59 3.45 1.85 -1.06 -2.17 114.93 118.12 1req h MET 218 Ca 0.20 -0.12 -0.08 0.00 -0.61 0.00 0.00 59.70 59.09 1req h MET 218 Cb 0.00 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 31.79 1req h MET 218 CO -0.08 0.79 0.04 -0.09 -0.40 0.00 0.00 176.91 177.17 1req h ARG 219 N 1.10 1.01 -0.87 0.39 2.43 -1.05 -1.65 114.38 115.74 1req h ARG 219 Ca 0.28 -0.30 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1req h ARG 219 Cb 0.01 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.42 1req h ARG 219 CO -0.05 0.98 0.58 0.82 -1.51 0.00 0.00 179.97 180.79 1req h ILE 220 N 0.90 1.21 0.13 1.20 2.04 -0.67 -2.30 117.51 120.01 1req h ILE 220 Ca 0.17 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1req h ILE 220 Cb 0.50 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1req h ILE 220 CO 0.02 0.21 -0.18 0.40 0.00 0.00 0.00 178.15 178.60 1req h ILE 221 N 1.16 0.59 -0.52 -0.67 1.08 -1.09 -2.12 117.51 115.94 1req h ILE 221 Ca 0.33 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.81 1req h ILE 221 Cb -0.10 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 34.20 1req h ILE 221 CO -0.08 0.00 0.35 0.77 -0.69 0.00 0.00 178.15 178.50 1req h SER 222 N -0.37 0.56 0.54 1.72 4.64 -1.08 -1.14 113.55 118.42 1req h SER 222 Ca 0.02 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1req h SER 222 Cb 0.37 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1req h SER 222 CO -0.08 0.40 -0.49 -0.33 -0.87 0.00 0.00 176.83 175.46 1req h GLU 223 N 0.66 0.00 -0.13 4.77 5.08 -1.19 0.66 114.58 124.43 1req h GLU 223 Ca 0.20 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.34 1req h GLU 223 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1req h GLU 223 CO -0.05 0.49 -0.79 0.82 -1.00 0.00 0.00 179.01 178.48 1req h ILE 224 N 0.00 1.30 -0.01 3.13 2.04 -0.56 -1.86 117.51 121.54 1req h ILE 224 Ca -0.00 -2.03 0.03 0.00 1.00 0.00 0.00 64.86 63.86 1req h ILE 224 Cb 0.89 2.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.96 1req h ILE 224 CO 0.06 0.64 -0.20 -0.26 0.00 0.00 0.00 178.15 178.39 1req h PHE 225 N 0.48 -0.52 -0.65 1.37 0.04 -1.06 0.18 116.94 116.78 1req h PHE 225 Ca -0.05 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.71 1req h PHE 225 Cb 1.41 0.24 -0.03 0.00 2.20 0.00 0.00 35.95 39.77 1req h PHE 225 CO 0.08 -0.28 0.30 0.00 -0.60 0.00 0.00 178.31 177.81 1req h ALA 226 N 0.59 0.84 0.06 2.45 0.00 -0.83 -1.43 119.26 120.94 1req h ALA 226 Ca 0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1req h ALA 226 Cb 0.40 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1req h ALA 226 CO -0.20 0.41 -0.03 -0.92 0.00 0.00 0.00 179.25 178.52 1req h TYR 227 N 0.90 -0.08 0.00 0.00 5.03 -1.18 -2.65 116.97 118.99 1req h TYR 227 Ca 0.22 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.45 1req h TYR 227 Cb 0.14 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 1req h TYR 227 CO 0.00 0.20 -0.38 1.79 -1.32 0.00 0.00 178.16 178.45 1req h THR 228 N -0.36 1.01 -0.56 1.81 1.35 -0.62 0.10 112.91 115.64 1req h THR 228 Ca -0.01 -1.46 -0.06 0.00 -0.55 0.00 0.00 66.41 64.34 1req h THR 228 Cb 0.32 1.85 -0.03 0.00 -1.73 0.00 0.00 68.15 68.56 1req h THR 228 CO 0.01 0.38 0.13 -1.28 -0.25 0.00 0.00 175.52 174.51 1req h SER 229 N 0.00 0.82 0.20 5.36 0.87 -1.21 0.06 113.55 119.65 1req h SER 229 Ca -0.00 -0.15 -0.31 0.00 -1.23 0.00 0.00 61.79 60.09 1req h SER 229 Cb 0.82 -0.21 0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1req h SER 229 CO 0.05 0.81 -1.47 0.00 -0.53 0.00 0.00 176.83 175.69 1req h ALA 230 N 1.30 -0.01 0.00 6.23 0.00 -1.31 -3.43 119.26 122.04 1req h ALA 230 Ca 0.18 -0.95 -0.08 0.00 0.00 0.00 0.00 54.91 54.05 1req h ALA 230 Cb 0.32 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1req h ALA 230 CO 0.00 0.77 -1.61 0.09 0.00 0.00 0.00 179.25 178.50 1req n ASN 231 N -3.76 2.40 -3.61 0.00 3.02 0.01 -4.90 115.26 108.42 1req n ASN 231 Ca -0.20 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.07 1req n ASN 231 Cb 1.03 1.19 -0.11 0.00 -0.61 0.00 0.00 39.78 41.28 1req n ASN 231 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1req s MET 232 N -2.56 1.40 0.32 3.52 -1.94 -0.00 -2.77 119.30 117.26 1req s MET 232 Ca -0.05 -2.37 0.26 0.00 -1.71 0.00 0.00 55.69 51.82 1req s MET 232 Cb 0.05 -2.17 1.04 0.00 2.01 0.00 0.00 34.83 35.76 1req s MET 232 CO 0.45 -1.30 1.77 -1.00 -0.01 0.00 0.00 175.02 174.94 1req h PRO 233 N 5.92 0.00 -0.01 2.03 0.13 -1.79 -2.57 132.00 135.71 1req h PRO 233 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1req h PRO 233 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1req h PRO 233 CO 0.48 0.00 -0.51 1.63 -0.23 0.00 0.00 178.00 179.37 1req n LYS 234 N -2.44 0.90 -3.06 0.86 5.02 -1.26 -4.95 118.16 113.24 1req n LYS 234 Ca 0.02 -0.71 -0.40 0.00 -2.02 0.00 0.00 58.31 55.20 1req n LYS 234 Cb 0.27 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.74 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 -2.58 3.42 -0.21 2.13 -0.11 -0.97 -3.74 118.94 116.87 1req s TRP 235 Ca 0.18 1.05 -0.29 0.00 1.22 0.00 0.00 56.10 58.27 1req s TRP 235 Cb 0.18 -2.84 0.00 0.00 -1.50 0.00 0.00 33.47 29.31 1req s TRP 235 CO 0.61 -0.14 1.01 -0.80 -4.62 0.00 0.00 176.95 173.01 1req s ASN 236 N 1.11 7.10 0.04 5.86 0.01 0.55 -4.83 114.94 124.78 1req s ASN 236 Ca 0.32 1.37 0.26 0.00 -0.71 0.00 0.00 52.86 54.10 1req s ASN 236 Cb -0.16 -2.53 0.68 0.00 0.41 0.00 0.00 41.25 39.64 1req s ASN 236 CO 0.12 -0.61 1.55 -1.54 -1.51 0.00 0.00 177.10 175.10 1req n SER 237 N 6.06 0.44 -3.56 -1.22 3.41 -0.73 -3.09 113.62 114.93 1req n SER 237 Ca 0.11 0.08 -0.17 0.00 -0.26 0.00 0.00 58.87 58.63 1req n SER 237 Cb 0.47 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.32 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 -3.05 0.01 -0.50 -1.33 2.07 -1.22 -4.75 121.20 112.43 1req s ILE 238 Ca 0.11 -0.07 0.03 0.00 -1.41 0.00 0.00 60.65 59.31 1req s ILE 238 Cb 0.17 -0.94 0.13 0.00 0.13 0.00 0.00 42.46 41.95 1req s ILE 238 CO 0.65 -0.04 0.27 -0.55 -1.91 0.00 0.00 174.94 173.36 1req s SER 239 N -1.15 4.08 -0.45 4.50 0.15 0.08 -1.33 113.70 119.58 1req s SER 239 Ca -0.11 -2.94 -0.27 0.00 0.70 0.00 0.00 55.95 53.33 1req s SER 239 Cb -0.01 -1.42 -0.04 0.00 -1.71 0.00 0.00 66.02 62.85 1req s SER 239 CO 0.09 -0.23 2.04 -0.63 1.20 0.00 0.00 173.24 175.70 1req s ILE 240 N -0.15 3.25 -0.12 6.45 1.01 0.14 -4.61 121.20 127.17 1req s ILE 240 Ca 0.18 0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.98 1req s ILE 240 Cb -0.24 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 1req s ILE 240 CO -0.01 -0.42 0.05 -0.44 0.00 0.00 0.00 174.94 174.12 1req s SER 241 N 8.68 5.57 -0.04 3.58 0.01 -1.26 -0.99 113.70 129.25 1req s SER 241 Ca 0.83 0.19 0.06 0.00 1.31 0.00 0.00 55.95 58.34 1req s SER 241 Cb -0.19 -1.75 -0.09 0.00 0.21 0.00 0.00 66.02 64.19 1req s SER 241 CO 0.27 0.32 0.09 0.61 0.41 0.00 0.00 173.24 174.94 1req n GLY 242 N 2.55 -0.31 0.32 3.44 0.00 0.99 -4.71 105.19 107.48 1req n GLY 242 Ca -0.18 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.83 -0.73 1.61 3.20 -1.69 -2.15 116.97 116.37 1req h TYR 243 Ca -0.08 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.84 1req h TYR 243 Cb 0.84 0.39 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 1req h TYR 243 CO 0.00 -0.38 0.48 0.45 -1.64 0.00 0.00 178.16 177.07 1req h HIS 244 N -0.36 0.91 -0.90 -3.82 -0.00 -1.89 -1.59 115.15 107.50 1req h HIS 244 Ca 0.11 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.51 1req h HIS 244 Cb 0.53 -0.31 -0.05 0.00 -0.00 0.00 0.00 27.41 27.58 1req h HIS 244 CO -0.41 0.57 0.59 0.52 -0.00 0.00 0.00 177.93 179.20 1req h MET 245 N 0.98 1.16 0.00 2.45 2.86 -1.72 -0.59 114.93 120.07 1req h MET 245 Ca 0.27 -0.07 -0.23 0.00 -2.06 0.00 0.00 59.70 57.61 1req h MET 245 Cb -0.09 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.31 1req h MET 245 CO -0.06 0.77 -0.95 0.37 1.06 0.00 0.00 176.91 178.10 1req h GLN 246 N 1.20 0.42 0.00 1.72 4.15 -0.89 0.49 115.11 122.20 1req h GLN 246 Ca 0.33 -0.46 -0.03 0.00 0.77 0.00 0.00 58.65 59.27 1req h GLN 246 Cb -0.11 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.70 1req h GLN 246 CO -0.08 1.12 -0.14 0.93 -1.93 0.00 0.00 178.83 178.73 1req h GLU 247 N 0.24 0.00 0.00 1.69 4.39 -1.15 -1.14 114.58 118.61 1req h GLU 247 Ca -0.08 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 1req h GLU 247 Cb 1.59 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.23 1req h GLU 247 CO 0.17 0.14 -0.33 0.00 -1.16 0.00 0.00 179.01 177.82 1req h ALA 248 N 1.86 0.83 0.00 3.43 0.00 -0.93 -3.47 119.26 120.98 1req h ALA 248 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1req h ALA 248 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1req h ALA 248 CO 0.02 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.89 1req n GLY 249 N 1.16 -0.03 3.77 0.00 0.00 -0.43 -4.58 105.19 105.07 1req n GLY 249 Ca 0.02 0.00 -0.38 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 -0.30 3.15 0.67 4.61 0.00 0.16 -4.15 121.76 125.90 1req s ALA 250 Ca 0.00 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.71 1req s ALA 250 Cb 0.00 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 1req s ALA 250 CO 0.00 -0.39 1.07 0.95 0.00 0.00 0.00 175.76 177.39 1req s THR 251 N -1.48 3.95 0.38 0.00 -4.23 -1.26 -4.54 115.64 108.47 1req s THR 251 Ca 0.56 0.63 0.08 0.00 -1.18 0.00 0.00 61.69 61.79 1req s THR 251 Cb -0.28 -3.62 0.30 0.00 1.34 0.00 0.00 72.50 70.24 1req s THR 251 CO 0.35 -0.83 1.97 0.00 -0.54 0.00 0.00 174.62 175.57 1req h ALA 252 N -0.53 1.79 -0.01 3.99 0.00 -1.95 -1.40 119.26 121.14 1req h ALA 252 Ca -0.45 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.32 1req h ALA 252 Cb 1.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1req h ALA 252 CO 0.63 0.10 -0.59 0.38 0.00 0.00 0.00 179.25 179.77 1req h ASP 253 N 0.65 0.05 0.15 0.00 2.03 -1.94 -1.55 116.42 115.81 1req h ASP 253 Ca 0.29 -0.03 -0.20 0.00 -0.73 0.00 0.00 57.03 56.36 1req h ASP 253 Cb 0.32 -0.01 0.02 0.00 -0.83 0.00 0.00 39.33 38.82 1req h ASP 253 CO -0.09 0.63 -0.91 0.40 -1.03 0.00 0.00 179.24 178.23 1req h ILE 254 N 0.03 1.45 -0.06 4.15 1.08 -1.80 -1.87 117.51 120.50 1req h ILE 254 Ca -0.01 -2.54 0.04 0.00 -0.39 0.00 0.00 64.86 61.97 1req h ILE 254 Cb 1.05 3.15 -0.06 0.00 -3.07 0.00 0.00 36.82 37.89 1req h ILE 254 CO 0.08 0.72 -0.32 -0.08 -0.69 0.00 0.00 178.15 177.86 1req h GLU 255 N -0.34 -0.42 0.22 2.37 4.81 -1.30 0.87 114.58 120.79 1req h GLU 255 Ca -0.17 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1req h GLU 255 Cb 1.68 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 31.12 1req h GLU 255 CO 0.15 -0.28 -0.40 0.52 -0.73 0.00 0.00 179.01 178.26 1req h MET 256 N -0.44 -0.68 -0.70 1.92 2.86 -1.37 -1.64 114.93 114.89 1req h MET 256 Ca 0.08 0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1req h MET 256 Cb 0.55 0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 1req h MET 256 CO -0.30 -0.45 0.36 0.00 1.06 0.00 0.00 176.91 177.58 1req h ALA 257 N -0.25 0.90 -0.23 6.32 0.00 -1.04 -1.46 119.26 123.50 1req h ALA 257 Ca 0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.58 1req h ALA 257 Cb 0.69 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1req h ALA 257 CO -0.18 0.44 -0.64 1.88 0.00 0.00 0.00 179.25 180.75 1req h TYR 258 N 0.97 1.08 -0.11 0.00 0.05 -0.88 -0.31 116.97 117.77 1req h TYR 258 Ca 0.24 -0.42 -0.01 0.00 0.05 0.00 0.00 58.73 58.60 1req h TYR 258 Cb 0.07 -0.19 -0.00 0.00 1.01 0.00 0.00 36.73 37.62 1req h TYR 258 CO 0.00 1.25 0.04 1.15 -1.05 0.00 0.00 178.16 179.56 1req h THR 259 N 0.61 1.14 -0.51 -2.88 2.02 -1.31 0.23 112.91 112.22 1req h THR 259 Ca -0.01 -0.43 -0.12 0.00 0.77 0.00 0.00 66.41 66.62 1req h THR 259 Cb 1.26 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 1req h THR 259 CO 0.14 0.13 -0.17 -0.07 0.37 0.00 0.00 175.52 175.92 1req h LEU 260 N 0.02 1.04 -0.87 2.58 3.38 -1.20 -1.56 115.31 118.69 1req h LEU 260 Ca 0.04 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.54 1req h LEU 260 Cb 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1req h LEU 260 CO -0.00 1.18 -0.16 0.00 0.09 0.00 0.00 178.44 179.54 1req h ALA 261 N 0.89 1.05 -0.55 1.53 0.00 -0.99 -1.06 119.26 120.13 1req h ALA 261 Ca 0.12 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.78 1req h ALA 261 Cb 0.74 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 1req h ALA 261 CO 0.06 0.58 0.25 -0.44 0.00 0.00 0.00 179.25 179.69 1req h ASP 262 N 0.59 0.32 -0.59 0.00 3.32 -0.14 -2.24 116.42 117.68 1req h ASP 262 Ca 0.10 0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.32 1req h ASP 262 Cb 0.61 -0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.06 1req h ASP 262 CO 0.04 0.21 -0.01 1.23 -1.72 0.00 0.00 179.24 178.99 1req h GLY 263 N 0.47 0.60 0.82 2.75 0.00 -0.59 -0.59 103.07 106.53 1req h GLY 263 Ca 0.26 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.71 1req h GLY 263 CO -0.22 -0.19 0.25 -2.08 0.00 0.00 0.00 176.54 174.30 1req h VAL 264 N 0.10 1.00 -0.70 4.60 2.07 -0.66 -1.22 116.25 121.44 1req h VAL 264 Ca 0.30 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.66 1req h VAL 264 Cb 0.49 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1req h VAL 264 CO -0.52 0.09 0.46 0.44 0.02 0.00 0.00 177.57 178.07 1req h ASP 265 N 0.49 0.81 -0.25 0.57 5.19 -0.85 -1.69 116.42 120.69 1req h ASP 265 Ca 0.19 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.55 1req h ASP 265 Cb 0.07 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.36 1req h ASP 265 CO -0.12 0.59 0.08 1.88 -3.12 0.00 0.00 179.24 178.55 1req h TYR 266 N 0.95 0.46 -0.33 4.55 0.05 -0.78 -0.25 116.97 121.62 1req h TYR 266 Ca 0.26 -0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.94 1req h TYR 266 Cb -0.11 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.48 1req h TYR 266 CO -0.02 0.40 -0.08 0.82 -1.05 0.00 0.00 178.16 178.23 1req h ILE 267 N 0.46 1.28 -0.89 -2.88 2.04 -0.87 -1.18 117.51 115.47 1req h ILE 267 Ca 0.11 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.84 1req h ILE 267 Cb 0.17 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1req h ILE 267 CO -0.00 0.37 0.57 0.03 0.00 0.00 0.00 178.15 179.11 1req h ARG 268 N 0.43 1.18 -0.54 2.37 3.08 -0.98 -0.56 114.38 119.37 1req h ARG 268 Ca 0.08 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1req h ARG 268 Cb 0.58 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 1req h ARG 268 CO 0.03 0.80 0.35 0.00 -1.07 0.00 0.00 179.97 180.09 1req h ALA 269 N 1.31 0.68 -0.52 0.04 0.00 -0.87 -0.51 119.26 119.40 1req h ALA 269 Ca 0.32 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1req h ALA 269 Cb -0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1req h ALA 269 CO -0.07 0.11 -0.14 0.78 0.00 0.00 0.00 179.25 179.94 1req h GLY 270 N 0.72 1.08 1.55 0.00 0.00 -0.83 -2.41 103.07 103.18 1req h GLY 270 Ca 0.20 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 1req h GLY 270 CO -0.05 0.81 0.23 0.83 0.00 0.00 0.00 176.54 178.37 1req h GLU 271 N 0.88 0.59 0.00 4.80 5.08 -0.52 -2.49 114.58 122.92 1req h GLU 271 Ca 0.13 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1req h GLU 271 Cb 0.70 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1req h GLU 271 CO 0.05 0.44 0.00 0.66 -1.00 0.00 0.00 179.01 179.16 1req h SER 272 N 0.60 0.00 -0.64 1.42 4.64 -0.59 -2.40 113.55 116.58 1req h SER 272 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1req h SER 272 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1req h SER 272 CO -0.03 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.26 1req n VAL 273 N -2.58 1.96 -0.57 0.95 0.24 -1.08 -4.95 118.33 112.32 1req n VAL 273 Ca 0.01 -1.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 1req n VAL 273 Cb 0.20 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 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 1.06 0.72 3.79 7.63 0.00 -0.90 -4.90 105.19 112.58 1req n GLY 274 Ca 0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 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 4.47 0.46 0.99 1.43 -0.96 -5.00 118.68 120.07 1req s LEU 275 Ca 0.00 1.62 -0.20 0.00 -1.03 0.00 0.00 54.13 54.53 1req s LEU 275 Cb 0.00 -3.55 -0.10 0.00 0.03 0.00 0.00 46.19 42.58 1req s LEU 275 CO 0.00 0.10 0.98 0.21 0.23 0.00 0.00 176.35 177.86 1req s ASN 276 N -1.41 6.72 0.31 2.29 3.84 -1.26 -4.08 114.94 121.36 1req s ASN 276 Ca 0.41 1.71 0.08 0.00 0.21 0.00 0.00 52.86 55.27 1req s ASN 276 Cb -0.20 -2.54 0.83 0.00 -0.55 0.00 0.00 41.25 38.79 1req s ASN 276 CO 0.24 -0.51 1.74 1.62 -2.79 0.00 0.00 177.10 177.40 1req h VAL 277 N 1.58 0.58 0.00 -5.21 3.04 -1.95 -1.01 116.25 113.28 1req h VAL 277 Ca -0.49 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1req h VAL 277 Cb 1.19 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.38 1req h VAL 277 CO 0.61 0.11 0.00 0.47 -1.01 0.00 0.00 177.57 177.75 1req n ASP 278 N -4.86 0.63 -0.01 3.17 8.00 -1.26 -0.91 116.55 121.30 1req n ASP 278 Ca 0.25 0.64 0.14 0.00 0.71 0.00 0.00 54.79 56.53 1req n ASP 278 Cb 0.68 -0.78 0.57 0.00 -0.02 0.00 0.00 41.12 41.58 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 -2.18 0.14 0.00 -1.24 6.02 -0.38 -4.46 117.38 115.28 1req n GLN 279 Ca 0.03 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1req n GLN 279 Cb 0.25 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.01 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 -1.40 0.00 0.14 1.08 -1.74 -0.93 -4.69 117.46 109.91 1req n PHE 280 Ca 0.09 0.00 -0.00 0.00 -0.56 0.00 0.00 57.45 56.97 1req n PHE 280 Cb 0.32 0.00 0.26 0.00 1.52 0.00 0.00 39.48 41.58 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 1.17 0.00 1.98 0.00 -1.24 -1.76 119.26 119.41 1req h ALA 281 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1req h ALA 281 Cb 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1req h ALA 281 CO 0.00 0.59 -0.02 -1.35 0.00 0.00 0.00 179.25 178.47 1req h PRO 282 N 0.08 0.00 -0.27 0.00 0.11 -1.81 -1.57 132.00 128.54 1req h PRO 282 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1req h PRO 282 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1req h PRO 282 CO 0.06 0.02 0.00 0.54 -0.21 0.00 0.00 178.00 178.41 1req n ARG 283 N -3.17 2.13 -2.63 1.05 5.12 -0.68 -4.96 116.66 113.52 1req n ARG 283 Ca -0.01 -1.98 -0.39 0.00 -1.93 0.00 0.00 57.85 53.54 1req n ARG 283 Cb 0.20 -1.40 -0.05 0.00 -1.16 0.00 0.00 32.46 30.05 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 -1.30 4.45 0.13 0.55 1.43 -0.59 -1.77 118.68 121.57 1req s LEU 284 Ca 0.29 2.04 0.02 0.00 -1.03 0.00 0.00 54.13 55.45 1req s LEU 284 Cb 0.18 -3.82 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 1req s LEU 284 CO 0.25 -0.12 -0.04 -0.94 0.23 0.00 0.00 176.35 175.73 1req s SER 285 N -1.26 1.16 0.42 2.29 1.04 -0.44 -4.67 113.70 112.25 1req s SER 285 Ca 0.47 -1.07 0.07 0.00 0.48 0.00 0.00 55.95 55.90 1req s SER 285 Cb -0.25 0.11 -0.05 0.00 0.10 0.00 0.00 66.02 65.93 1req s SER 285 CO 0.32 -0.50 0.18 -0.36 0.98 0.00 0.00 173.24 173.86 1req s PHE 286 N -3.64 2.52 -0.24 5.02 0.40 -0.10 0.25 117.98 122.19 1req s PHE 286 Ca 0.17 -0.62 -0.05 0.00 -0.60 0.00 0.00 56.93 55.83 1req s PHE 286 Cb 0.05 -1.94 0.13 0.00 0.51 0.00 0.00 43.02 41.77 1req s PHE 286 CO -0.01 0.16 0.45 0.12 0.70 0.00 0.00 175.22 176.64 1req s PHE 287 N -2.62 -0.99 0.14 0.36 5.36 -0.16 -0.23 117.98 119.83 1req s PHE 287 Ca 0.39 1.35 0.04 0.00 -0.96 0.00 0.00 56.93 57.76 1req s PHE 287 Cb 0.04 0.28 -0.04 0.00 -0.34 0.00 0.00 43.02 42.96 1req s PHE 287 CO 0.22 -0.66 0.13 -1.58 -1.46 0.00 0.00 175.22 171.86 1req s TRP 288 N 2.65 3.17 0.18 10.12 0.52 -0.46 -0.00 118.94 135.12 1req s TRP 288 Ca 0.07 0.01 -0.01 0.00 0.02 0.00 0.00 56.10 56.20 1req s TRP 288 Cb -0.14 -1.54 -0.04 0.00 -1.15 0.00 0.00 33.47 30.59 1req s TRP 288 CO -0.16 0.52 0.37 0.20 0.02 0.00 0.00 176.95 177.91 1req s GLY 289 N -2.93 1.86 -0.31 0.98 0.00 -1.26 -1.26 107.32 104.39 1req s GLY 289 Ca 0.31 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 44.20 1req s GLY 289 CO 0.23 -0.76 0.12 -0.42 0.00 0.00 0.00 173.10 172.27 1req s ILE 290 N -1.82 0.51 0.00 0.90 -1.09 -0.75 -4.85 121.20 114.10 1req s ILE 290 Ca 0.38 -1.23 0.00 0.00 -2.23 0.00 0.00 60.65 57.57 1req s ILE 290 Cb -0.11 -1.40 0.00 0.00 -1.58 0.00 0.00 42.46 39.37 1req s ILE 290 CO 0.28 -0.72 0.00 0.61 -1.23 0.00 0.00 174.94 173.88 1req n GLY 291 N 4.90 0.85 0.03 6.18 0.00 -1.26 -0.26 105.19 115.62 1req n GLY 291 Ca -0.02 -1.86 0.14 0.00 0.00 0.00 0.00 46.02 44.28 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 0.00 0.32 -3.02 1.61 2.81 -1.26 -4.51 117.12 113.07 1req n MET 292 Ca 0.00 -0.05 -0.44 0.00 -1.81 0.00 0.00 57.70 55.39 1req n MET 292 Cb 0.00 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 30.99 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 -2.72 6.79 0.14 7.83 3.84 -1.26 -4.86 114.94 124.70 1req s ASN 293 Ca 0.23 -2.45 -0.31 0.00 0.21 0.00 0.00 52.86 50.54 1req s ASN 293 Cb 0.20 -2.36 -0.06 0.00 -0.55 0.00 0.00 41.25 38.48 1req s ASN 293 CO 0.51 -0.87 1.56 0.15 -2.79 0.00 0.00 177.10 175.66 1req h PHE 294 N 8.17 -1.55 0.00 0.43 3.04 -1.93 -0.74 116.94 124.36 1req h PHE 294 Ca 0.18 0.08 -0.12 0.00 3.98 0.00 0.00 57.97 62.09 1req h PHE 294 Cb 0.99 0.74 -0.02 0.00 2.56 0.00 0.00 35.95 40.21 1req h PHE 294 CO 1.11 -0.47 -0.59 0.74 -2.02 0.00 0.00 178.31 177.08 1req h PHE 295 N -0.36 0.00 -0.60 0.41 0.04 -1.97 -1.90 116.94 112.56 1req h PHE 295 Ca 0.10 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.81 1req h PHE 295 Cb 0.59 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.71 1req h PHE 295 CO -0.71 0.59 0.12 1.98 -0.60 0.00 0.00 178.31 179.70 1req h MET 296 N 0.00 0.98 -0.47 1.51 4.05 -1.86 -2.32 114.93 116.82 1req h MET 296 Ca -0.01 -0.25 -0.08 0.00 -0.28 0.00 0.00 59.70 59.09 1req h MET 296 Cb 1.06 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 1req h MET 296 CO 0.08 0.91 -0.01 0.93 0.23 0.00 0.00 176.91 179.05 1req h GLU 297 N 0.89 0.84 -0.40 0.39 4.39 -0.89 0.40 114.58 120.20 1req h GLU 297 Ca 0.19 -0.27 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1req h GLU 297 Cb 0.38 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 1req h GLU 297 CO 0.01 0.90 0.25 0.28 -1.16 0.00 0.00 179.01 179.29 1req h VAL 298 N 0.70 1.11 -0.20 3.13 2.07 -1.32 -2.43 116.25 119.31 1req h VAL 298 Ca 0.13 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1req h VAL 298 Cb 0.52 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1req h VAL 298 CO 0.03 0.11 -0.28 0.00 0.02 0.00 0.00 177.57 177.45 1req h ALA 299 N 1.13 1.16 -0.17 1.67 0.00 -1.20 -2.94 119.26 118.90 1req h ALA 299 Ca 0.14 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1req h ALA 299 Cb -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1req h ALA 299 CO -0.03 0.54 0.03 -0.22 0.00 0.00 0.00 179.25 179.57 1req h LYS 300 N 0.33 0.10 -0.87 0.00 3.64 0.28 0.34 116.57 120.39 1req h LYS 300 Ca 0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1req h LYS 300 Cb 0.67 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 1req h LYS 300 CO 0.05 0.07 0.56 -0.07 -2.27 0.00 0.00 179.45 177.78 1req h LEU 301 N 0.10 1.02 -0.07 5.20 4.07 -1.47 0.24 115.31 124.41 1req h LEU 301 Ca 0.08 -0.04 -0.05 0.00 0.08 0.00 0.00 57.88 57.95 1req h LEU 301 Cb 0.07 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.56 1req h LEU 301 CO -0.11 0.75 -0.17 0.03 -1.08 0.00 0.00 178.44 177.87 1req h ARG 302 N 1.19 0.23 -0.78 1.13 3.08 -1.32 -2.91 114.38 115.00 1req h ARG 302 Ca 0.32 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 1req h ARG 302 Cb -0.10 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 1req h ARG 302 CO -0.07 0.77 0.28 0.00 -1.07 0.00 0.00 179.97 179.89 1req h ALA 303 N 0.46 1.03 -0.95 0.04 0.00 -0.80 -2.76 119.26 116.29 1req h ALA 303 Ca -0.00 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1req h ALA 303 Cb 0.77 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1req h ALA 303 CO 0.04 0.67 0.62 0.00 0.00 0.00 0.00 179.25 180.57 1req h ALA 304 N 1.16 1.43 -0.31 0.00 0.00 -0.56 -1.06 119.26 119.92 1req h ALA 304 Ca 0.26 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1req h ALA 304 Cb 0.25 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1req h ALA 304 CO -0.02 0.46 0.05 0.00 0.00 0.00 0.00 179.25 179.75 1req h ARG 305 N 1.15 0.16 -0.45 0.00 3.08 -1.28 0.08 114.38 117.11 1req h ARG 305 Ca 0.39 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.32 1req h ARG 305 Cb 0.09 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1req h ARG 305 CO -0.13 0.11 -0.16 0.52 -1.07 0.00 0.00 179.97 179.23 1req h MET 306 N 0.16 0.90 -0.66 0.04 2.86 -1.22 -2.16 114.93 114.86 1req h MET 306 Ca 0.15 -0.37 -0.07 0.00 -2.06 0.00 0.00 59.70 57.35 1req h MET 306 Cb 0.16 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 1req h MET 306 CO -0.20 1.02 0.15 -0.07 1.06 0.00 0.00 176.91 178.88 1req h LEU 307 N 0.74 1.01 -0.88 1.22 3.38 -0.94 -2.18 115.31 117.65 1req h LEU 307 Ca 0.11 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1req h LEU 307 Cb 0.72 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1req h LEU 307 CO 0.06 0.98 0.36 -0.25 0.09 0.00 0.00 178.44 179.68 1req h TRP 308 N 0.98 1.18 -0.43 1.13 2.91 -0.98 0.22 115.95 120.97 1req h TRP 308 Ca 0.21 -0.07 -0.00 0.00 1.13 0.00 0.00 58.89 60.16 1req h TRP 308 Cb 0.38 -0.36 -0.02 0.00 -0.51 0.00 0.00 29.16 28.64 1req h TRP 308 CO 0.03 0.87 0.26 0.00 -1.03 0.00 0.00 178.44 178.57 1req h ALA 309 N 1.24 0.55 -0.12 2.65 0.00 -1.19 -0.55 119.26 121.84 1req h ALA 309 Ca 0.27 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1req h ALA 309 Cb 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1req h ALA 309 CO -0.03 0.04 0.07 -0.22 0.00 0.00 0.00 179.25 179.11 1req h LYS 310 N 0.57 0.16 -0.21 0.00 3.64 -1.05 -0.75 116.57 118.93 1req h LYS 310 Ca 0.16 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1req h LYS 310 Cb -0.01 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1req h LYS 310 CO -0.03 0.15 0.12 -0.07 -2.27 0.00 0.00 179.45 177.35 1req h LEU 311 N 0.12 0.26 -1.10 5.20 3.38 -0.22 -3.10 115.31 119.85 1req h LEU 311 Ca 0.04 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1req h LEU 311 Cb 0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1req h LEU 311 CO -0.01 0.25 -0.40 0.58 0.09 0.00 0.00 178.44 178.95 1req h VAL 312 N 0.25 1.30 -0.92 1.22 2.07 -1.07 -2.93 116.25 116.17 1req h VAL 312 Ca 0.08 -1.43 0.15 0.00 0.82 0.00 0.00 66.70 66.32 1req h VAL 312 Cb 0.04 1.71 -0.08 0.00 -1.52 0.00 0.00 31.29 31.44 1req h VAL 312 CO -0.01 0.42 0.59 -0.74 0.02 0.00 0.00 177.57 177.84 1req h HIS 313 N 0.08 0.85 -0.82 1.57 6.17 -1.05 -2.04 115.15 119.92 1req h HIS 313 Ca 0.01 0.03 0.20 0.00 0.71 0.00 0.00 60.37 61.32 1req h HIS 313 Cb 0.75 -0.27 -0.05 0.00 2.52 0.00 0.00 27.41 30.36 1req h HIS 313 CO 0.01 0.29 0.56 1.96 0.71 0.00 0.00 177.93 181.46 1req h GLN 314 N 0.70 0.22 0.00 5.26 4.20 -1.56 -2.31 115.11 121.62 1req h GLN 314 Ca 0.47 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.17 1req h GLN 314 Cb 0.77 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1req h GLN 314 CO -0.23 0.14 0.00 1.19 -0.67 0.00 0.00 178.83 179.26 1req n PHE 315 N -4.42 0.00 -2.91 2.96 3.72 -0.77 -4.96 117.46 111.08 1req n PHE 315 Ca 0.17 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.45 1req n PHE 315 Cb 0.74 -0.21 0.06 0.00 -0.94 0.00 0.00 39.48 39.12 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 0.94 -0.37 3.77 1.37 0.00 -0.87 -4.90 105.19 105.14 1req n GLY 316 Ca 0.15 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 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 -4.51 3.84 -0.04 1.61 0.04 -1.26 -4.92 135.00 129.75 1req s PRO 317 Ca 0.17 1.71 0.16 0.00 0.04 0.00 0.00 61.00 63.07 1req s PRO 317 Cb -0.02 -2.42 -0.24 0.00 0.04 0.00 0.00 34.50 31.86 1req s PRO 317 CO 0.54 -0.47 0.30 1.63 0.04 0.00 0.00 177.00 179.04 1req n LYS 318 N -0.42 0.66 -3.67 4.56 4.76 -1.26 -4.86 118.16 117.93 1req n LYS 318 Ca 0.07 -0.12 -0.36 0.00 -2.87 0.00 0.00 58.31 55.02 1req n LYS 318 Cb 0.48 -1.38 -0.09 0.00 -1.84 0.00 0.00 35.03 32.20 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 -4.01 6.14 0.45 4.39 3.84 -1.26 -4.98 114.94 119.50 1req s ASN 319 Ca -0.06 0.14 0.19 0.00 0.21 0.00 0.00 52.86 53.33 1req s ASN 319 Cb 0.09 -2.10 1.07 0.00 -0.55 0.00 0.00 41.25 39.76 1req s ASN 319 CO 0.66 0.09 1.97 1.55 -2.79 0.00 0.00 177.10 178.57 1req h PRO 320 N 7.35 0.00 0.00 0.43 0.13 -2.02 -1.60 132.00 136.29 1req h PRO 320 Ca -0.39 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.74 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 0.68 0.22 -0.02 0.87 -0.23 0.00 0.00 178.00 179.51 1req h LYS 321 N 0.00 0.00 -0.65 0.86 1.57 -1.96 -2.17 116.57 114.22 1req h LYS 321 Ca -0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1req h LYS 321 Cb 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1req h LYS 321 CO 0.03 0.02 0.43 0.77 -0.57 0.00 0.00 179.45 180.13 1req h SER 322 N 0.00 0.72 0.59 0.86 0.02 -1.57 -2.42 113.55 111.76 1req h SER 322 Ca -0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1req h SER 322 Cb 0.07 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1req h SER 322 CO 0.00 0.51 -0.02 0.23 -1.14 0.00 0.00 176.83 176.41 1req n MET 323 N -4.45 0.41 -2.91 3.45 2.81 -0.82 -4.58 117.12 111.03 1req n MET 323 Ca 0.07 -0.03 -0.40 0.00 -1.81 0.00 0.00 57.70 55.53 1req n MET 323 Cb 0.07 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.03 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 -2.61 7.24 -0.46 7.83 1.04 -0.91 -3.53 113.70 122.29 1req s SER 324 Ca 0.27 1.48 -0.20 0.00 0.48 0.00 0.00 55.95 57.98 1req s SER 324 Cb 0.20 -2.49 0.03 0.00 0.10 0.00 0.00 66.02 63.86 1req s SER 324 CO 0.47 -0.07 0.62 -0.22 0.98 0.00 0.00 173.24 175.02 1req s LEU 325 N 0.30 4.68 -0.20 2.42 0.20 -1.26 -4.99 118.68 119.84 1req s LEU 325 Ca 0.42 -0.57 -0.07 0.00 0.69 0.00 0.00 54.13 54.60 1req s LEU 325 Cb -0.20 -2.59 -0.04 0.00 -0.43 0.00 0.00 46.19 42.93 1req s LEU 325 CO 0.24 -0.80 0.07 -0.13 -0.29 0.00 0.00 176.35 175.43 1req s ARG 326 N 2.70 3.89 0.01 1.98 0.52 -1.26 -4.68 118.95 122.11 1req s ARG 326 Ca 0.19 -0.38 -0.03 0.00 -0.52 0.00 0.00 55.73 54.99 1req s ARG 326 Cb -0.16 -3.25 -0.01 0.00 0.52 0.00 0.00 34.95 32.05 1req s ARG 326 CO 0.16 0.14 0.04 -0.08 0.02 0.00 0.00 175.30 175.58 1req s THR 327 N 0.73 0.09 0.42 0.02 -1.32 -1.26 -0.92 115.64 113.39 1req s THR 327 Ca 0.03 -0.78 -0.00 0.00 -1.21 0.00 0.00 61.69 59.73 1req s THR 327 Cb -0.13 -0.32 -0.02 0.00 -1.51 0.00 0.00 72.50 70.52 1req s THR 327 CO 0.02 -0.43 0.64 -2.28 -2.21 0.00 0.00 174.62 170.36 1req s HIS 328 N -1.36 3.38 0.00 9.09 2.46 0.68 0.67 115.29 130.22 1req s HIS 328 Ca -0.15 0.37 -0.06 0.00 0.47 0.00 0.00 55.06 55.69 1req s HIS 328 Cb -0.09 -2.15 -0.00 0.00 -0.13 0.00 0.00 32.58 30.21 1req s HIS 328 CO 0.00 -0.16 0.11 -1.12 -2.47 0.00 0.00 174.74 171.09 1req s SER 329 N -4.13 0.05 -0.01 9.88 0.01 -0.48 -1.35 113.70 117.67 1req s SER 329 Ca 0.45 -0.23 0.02 0.00 1.31 0.00 0.00 55.95 57.50 1req s SER 329 Cb -0.10 0.19 -0.00 0.00 0.21 0.00 0.00 66.02 66.32 1req s SER 329 CO 0.38 -0.33 -0.07 -1.58 0.41 0.00 0.00 173.24 172.05 1req s GLN 330 N -1.29 0.60 0.64 12.44 0.74 -0.39 -1.67 119.66 130.73 1req s GLN 330 Ca -0.14 -0.23 -0.17 0.00 0.05 0.00 0.00 55.36 54.88 1req s GLN 330 Cb -0.08 -0.58 -0.01 0.00 1.10 0.00 0.00 33.01 33.44 1req s GLN 330 CO 0.01 0.12 1.16 0.95 -0.55 0.00 0.00 175.29 176.98 1req s THR 331 N -0.02 2.84 -0.28 -0.34 -4.23 -0.85 -1.81 115.64 110.96 1req s THR 331 Ca 0.01 0.45 -0.29 0.00 -1.18 0.00 0.00 61.69 60.68 1req s THR 331 Cb -0.04 -3.05 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 1req s THR 331 CO -0.00 -0.18 1.38 -0.55 -0.54 0.00 0.00 174.62 174.72 1req s SER 332 N -2.06 6.60 0.14 3.99 0.15 0.64 -4.73 113.70 118.44 1req s SER 332 Ca 0.72 1.32 -0.18 0.00 0.70 0.00 0.00 55.95 58.52 1req s SER 332 Cb -0.26 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.51 1req s SER 332 CO 0.38 -1.12 1.78 1.23 1.20 0.00 0.00 173.24 176.71 1req h GLY 333 N 11.05 0.42 1.04 9.45 0.00 -1.90 -2.79 103.07 120.34 1req h GLY 333 Ca -0.28 -0.13 0.11 0.00 0.00 0.00 0.00 47.33 47.03 1req h GLY 333 CO 1.02 0.12 0.38 -0.25 0.00 0.00 0.00 176.54 177.81 1req h TRP 334 N 0.36 0.28 0.00 5.60 7.01 -1.91 -2.55 115.95 124.73 1req h TRP 334 Ca 0.12 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.13 1req h TRP 334 Cb 0.01 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 26.98 1req h TRP 334 CO -0.08 0.13 0.00 0.66 -2.79 0.00 0.00 178.44 176.36 1req h SER 335 N 0.25 0.00 -3.37 2.65 4.64 -1.90 -3.44 113.55 112.38 1req h SER 335 Ca 0.26 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 61.03 1req h SER 335 Cb 0.68 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.74 1req h SER 335 CO -0.05 0.00 -0.06 -0.76 -0.87 0.00 0.00 176.83 175.08 1req s LEU 336 N -4.91 4.31 0.29 5.97 1.43 -0.96 -5.03 118.68 119.77 1req s LEU 336 Ca 0.04 1.10 0.09 0.00 -1.03 0.00 0.00 54.13 54.32 1req s LEU 336 Cb 0.09 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 1req s LEU 336 CO 0.45 0.07 0.06 0.42 0.23 0.00 0.00 176.35 177.58 1req s THR 337 N -1.52 3.44 -1.37 5.49 -4.23 -1.26 -4.73 115.64 111.45 1req s THR 337 Ca 0.40 -1.79 0.27 0.00 -1.18 0.00 0.00 61.69 59.39 1req s THR 337 Cb -0.15 -2.95 0.20 0.00 1.34 0.00 0.00 72.50 70.94 1req s THR 337 CO 0.19 -0.31 1.60 0.00 -0.54 0.00 0.00 174.62 175.56 1req n ALA 338 N -1.01 3.13 -2.73 3.99 0.00 -1.26 -4.56 120.51 118.07 1req n ALA 338 Ca -0.06 -0.33 -0.34 0.00 0.00 0.00 0.00 53.44 52.72 1req n ALA 338 Cb 0.60 -1.20 -0.11 0.00 0.00 0.00 0.00 19.45 18.74 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 -2.73 3.11 -0.77 0.00 1.11 -1.26 -4.68 119.66 114.43 1req s GLN 339 Ca 0.19 -0.51 -0.02 0.00 0.01 0.00 0.00 55.36 55.03 1req s GLN 339 Cb 0.19 -2.74 0.00 0.00 -1.01 0.00 0.00 33.01 29.45 1req s GLN 339 CO 0.58 0.53 0.63 -3.47 0.01 0.00 0.00 175.29 173.58 1req n ASP 340 N 2.65 -5.85 0.22 5.90 2.03 -1.26 -4.85 116.55 115.39 1req n ASP 340 Ca -0.18 -0.62 0.08 0.00 0.52 0.00 0.00 54.79 54.59 1req n ASP 340 Cb 0.53 -2.86 0.50 0.00 -0.72 0.00 0.00 41.12 38.57 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 0.11 0.81 0.00 5.18 -1.51 -1.83 -2.20 116.25 116.80 1req h VAL 341 Ca -0.43 -1.04 0.00 0.00 -1.23 0.00 0.00 66.70 64.00 1req h VAL 341 Cb 1.27 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 32.07 1req h VAL 341 CO 0.34 0.25 0.00 -1.22 -1.23 0.00 0.00 177.57 175.71 1req n TYR 342 N -3.68 0.00 0.29 5.19 4.02 -1.26 -1.62 117.16 120.10 1req n TYR 342 Ca -0.01 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.02 1req n TYR 342 Cb 0.37 -0.49 0.88 0.00 -0.02 0.00 0.00 39.34 40.09 1req n TYR 342 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1req h ASN 343 N 0.00 0.00 0.41 7.72 2.35 -1.74 -1.76 115.58 122.56 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 0.27 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 1req h ASN 343 CO 0.00 0.02 -0.09 0.78 -1.65 0.00 0.00 177.43 176.49 1req h ASN 344 N 0.00 0.00 -0.38 5.81 2.35 -1.52 -2.57 115.58 119.28 1req h ASN 344 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1req h ASN 344 Cb 0.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1req h ASN 344 CO 0.00 0.09 0.11 0.58 -1.65 0.00 0.00 177.43 176.56 1req h VAL 345 N 0.00 1.22 -0.30 2.81 2.07 -1.48 -1.18 116.25 119.39 1req h VAL 345 Ca -0.00 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1req h VAL 345 Cb 0.31 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1req h VAL 345 CO 0.01 0.25 0.07 0.58 0.02 0.00 0.00 177.57 178.50 1req h VAL 346 N 0.46 1.22 -0.49 2.57 2.07 -1.61 -2.54 116.25 117.92 1req h VAL 346 Ca 0.12 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 1req h VAL 346 Cb 0.27 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1req h VAL 346 CO -0.00 0.24 0.26 0.03 0.02 0.00 0.00 177.57 178.11 1req h ARG 347 N 0.32 0.69 -0.17 1.57 3.08 -1.31 -1.60 114.38 116.96 1req h ARG 347 Ca 0.09 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1req h ARG 347 Cb 0.29 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1req h ARG 347 CO 0.00 0.56 -0.47 1.15 -1.07 0.00 0.00 179.97 180.14 1req h THR 348 N 0.65 1.32 -0.14 2.04 2.02 -1.26 -1.90 112.91 115.65 1req h THR 348 Ca 0.17 -1.67 0.01 0.00 0.77 0.00 0.00 66.41 65.69 1req h THR 348 Cb 0.08 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1req h THR 348 CO -0.03 0.51 0.05 0.00 0.37 0.00 0.00 175.52 176.43 1req h ILE 350 N 0.13 1.24 -0.61 0.00 1.08 -1.19 -1.48 117.51 116.67 1req h ILE 350 Ca 0.06 -0.73 -0.08 0.00 -0.39 0.00 0.00 64.86 63.72 1req h ILE 350 Cb 0.03 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.22 1req h ILE 350 CO -0.06 0.29 0.07 -0.33 -0.69 0.00 0.00 178.15 177.44 1req h GLU 351 N 0.95 1.02 -0.47 2.37 5.08 -1.16 -1.44 114.58 120.93 1req h GLU 351 Ca 0.23 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1req h GLU 351 Cb 0.19 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1req h GLU 351 CO -0.02 0.96 0.15 0.00 -1.00 0.00 0.00 179.01 179.10 1req h ALA 352 N 1.12 1.40 -0.43 3.43 0.00 -0.27 -1.53 119.26 122.97 1req h ALA 352 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 352 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1req h ALA 352 CO 0.02 0.45 0.28 0.52 0.00 0.00 0.00 179.25 180.52 1req h MET 353 N 0.67 0.57 -0.59 0.00 2.86 -0.88 -1.98 114.93 115.58 1req h MET 353 Ca 0.16 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1req h MET 353 Cb 0.19 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1req h MET 353 CO -0.01 0.38 0.29 0.00 1.06 0.00 0.00 176.91 178.63 1req h ALA 354 N 1.15 0.75 -0.33 6.32 0.00 -0.75 0.26 119.26 126.66 1req h ALA 354 Ca 0.16 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1req h ALA 354 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1req h ALA 354 CO -0.03 0.31 0.20 0.00 0.00 0.00 0.00 179.25 179.72 1req h ALA 355 N 1.12 0.42 -0.03 0.00 0.00 -1.06 -1.39 119.26 118.33 1req h ALA 355 Ca 0.20 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 1req h ALA 355 Cb 0.10 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1req h ALA 355 CO -0.03 -0.08 -0.60 1.79 0.00 0.00 0.00 179.25 180.34 1req h THR 356 N 0.43 1.41 0.00 0.00 1.35 -1.32 -1.18 112.91 113.60 1req h THR 356 Ca 0.12 -2.01 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 1req h THR 356 Cb 0.02 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1req h THR 356 CO -0.02 0.58 -0.12 0.00 -0.25 0.00 0.00 175.52 175.71 1req n GLN 357 N -3.85 0.24 -0.15 4.72 6.02 0.07 -1.31 117.38 123.12 1req n GLN 357 Ca -0.02 0.17 0.10 0.00 -0.01 0.00 0.00 57.00 57.24 1req n GLN 357 Cb 0.60 -1.75 0.28 0.00 1.02 0.00 0.00 30.24 30.40 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 1.34 0.83 2.99 1.08 0.00 -0.53 -4.67 105.19 106.23 1req n GLY 358 Ca 0.05 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 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 0.71 -2.06 -1.95 1.61 8.25 -0.43 -4.52 115.22 116.83 1req n HIS 359 Ca 0.16 0.74 -0.33 0.00 -0.26 0.00 0.00 57.72 58.03 1req n HIS 359 Cb 0.40 -3.98 0.03 0.00 1.12 0.00 0.00 29.99 27.56 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 -3.33 3.42 -0.14 1.59 -1.32 -0.48 -4.90 115.64 110.48 1req s THR 360 Ca 0.34 0.70 0.17 0.00 -1.21 0.00 0.00 61.69 61.70 1req s THR 360 Cb -0.04 -3.23 -0.11 0.00 -1.51 0.00 0.00 72.50 67.61 1req s THR 360 CO 0.63 -0.37 0.89 1.56 -2.21 0.00 0.00 174.62 175.12 1req h GLN 361 N 0.39 0.00 -3.92 7.08 7.50 -0.10 -3.43 115.11 122.62 1req h GLN 361 Ca -0.47 0.00 -0.11 0.00 0.50 0.00 0.00 58.65 58.57 1req h GLN 361 Cb 1.24 0.00 -0.12 0.00 0.05 0.00 0.00 27.48 28.65 1req h GLN 361 CO 0.56 0.27 -0.30 -1.54 -1.50 0.00 0.00 178.83 176.31 1req s SER 362 N -5.77 0.01 -0.26 1.46 1.04 -0.95 -0.61 113.70 108.61 1req s SER 362 Ca -0.02 -0.98 -0.24 0.00 0.48 0.00 0.00 55.95 55.19 1req s SER 362 Cb 0.09 0.48 0.07 0.00 0.10 0.00 0.00 66.02 66.76 1req s SER 362 CO 0.80 -0.97 0.70 -0.22 0.98 0.00 0.00 173.24 174.53 1req s LEU 363 N -3.02 -0.70 -0.09 2.42 2.96 -0.68 -1.38 118.68 118.19 1req s LEU 363 Ca 0.23 1.42 0.03 0.00 -0.22 0.00 0.00 54.13 55.59 1req s LEU 363 Cb 0.02 2.41 -0.02 0.00 0.50 0.00 0.00 46.19 49.11 1req s LEU 363 CO 0.05 -0.24 -0.17 -2.28 -1.32 0.00 0.00 176.35 172.39 1req s HIS 364 N 0.44 2.66 -0.17 5.38 5.65 -0.67 -0.89 115.29 127.70 1req s HIS 364 Ca -0.01 -0.56 -0.02 0.00 0.25 0.00 0.00 55.06 54.72 1req s HIS 364 Cb -0.05 -1.71 -0.01 0.00 -1.18 0.00 0.00 32.58 29.63 1req s HIS 364 CO -0.00 -0.12 -0.10 0.95 -0.65 0.00 0.00 174.74 174.81 1req s THR 365 N -0.08 3.07 0.95 0.89 -4.23 -1.26 -2.01 115.64 112.97 1req s THR 365 Ca -0.04 -0.62 -0.11 0.00 -1.18 0.00 0.00 61.69 59.74 1req s THR 365 Cb -0.14 -2.34 0.16 0.00 1.34 0.00 0.00 72.50 71.53 1req s THR 365 CO 0.04 0.49 1.09 0.20 -0.54 0.00 0.00 174.62 175.90 1req s ASN 366 N 0.91 2.81 0.27 3.99 0.01 -1.26 -4.80 114.94 116.85 1req s ASN 366 Ca -0.02 1.72 0.06 0.00 -0.71 0.00 0.00 52.86 53.91 1req s ASN 366 Cb -0.15 -2.35 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 1req s ASN 366 CO -0.00 -3.09 0.33 -0.44 -1.51 0.00 0.00 177.10 172.39 1req s SER 367 N -2.99 5.99 0.46 -1.22 0.01 -1.26 -4.57 113.70 110.11 1req s SER 367 Ca 0.65 -0.10 0.19 0.00 1.31 0.00 0.00 55.95 58.00 1req s SER 367 Cb -0.21 -1.58 1.10 0.00 0.21 0.00 0.00 66.02 65.55 1req s SER 367 CO 0.59 -0.14 1.99 0.17 0.41 0.00 0.00 173.24 176.26 1req h LEU 368 N 1.21 0.00 -1.77 2.44 8.10 -1.89 -2.45 115.31 120.96 1req h LEU 368 Ca -0.50 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.47 1req h LEU 368 Cb 1.24 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.44 1req h LEU 368 CO 0.59 0.20 0.03 -0.90 -4.11 0.00 0.00 178.44 174.25 1req n ASP 369 N -4.05 2.31 0.19 0.17 5.68 -1.26 -4.62 116.55 114.97 1req n ASP 369 Ca -0.02 -2.24 0.13 0.00 -0.50 0.00 0.00 54.79 52.16 1req n ASP 369 Cb 0.27 -0.55 0.70 0.00 -1.14 0.00 0.00 41.12 40.41 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 0.71 0.00 0.00 0.11 4.57 -1.62 -1.59 114.58 116.76 1req h GLU 370 Ca 0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1req h GLU 370 Cb 0.96 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.55 1req h GLU 370 CO 0.14 0.00 -0.59 0.00 -1.18 0.00 0.00 179.01 177.38 1req h ALA 371 N 1.91 0.61 0.00 2.92 0.00 -1.82 -3.40 119.26 119.49 1req h ALA 371 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 1req h ALA 371 Cb 0.31 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1req h ALA 371 CO -0.00 0.00 -1.98 -0.89 0.00 0.00 0.00 179.25 176.38 1req n ILE 372 N -2.17 1.42 -3.73 0.00 5.41 -0.67 -4.78 119.36 114.84 1req n ILE 372 Ca 0.03 -0.20 -0.09 0.00 1.00 0.00 0.00 62.75 63.49 1req n ILE 372 Cb 0.45 -1.97 0.01 0.00 -0.71 0.00 0.00 39.64 37.41 1req n ILE 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1req n ALA 373 N -4.21 -1.14 -1.31 -1.39 0.00 -0.80 -4.72 120.51 106.94 1req n ALA 373 Ca -0.39 -1.11 -0.32 0.00 0.00 0.00 0.00 53.44 51.61 1req n ALA 373 Cb 0.74 0.89 0.08 0.00 0.00 0.00 0.00 19.45 21.17 1req n ALA 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1req s LEU 374 N 0.00 3.18 0.57 0.00 1.43 -1.26 -4.29 118.68 118.32 1req s LEU 374 Ca 0.16 1.98 -0.20 0.00 -1.03 0.00 0.00 54.13 55.04 1req s LEU 374 Cb -0.03 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 1req s LEU 374 CO 0.12 -2.00 1.31 -2.84 0.23 0.00 0.00 176.35 173.17 1req s PRO 375 N -4.46 2.99 0.71 1.29 0.02 -1.26 -3.80 135.00 130.48 1req s PRO 375 Ca 0.65 2.11 0.02 0.00 0.02 0.00 0.00 61.00 63.81 1req s PRO 375 Cb -0.20 -2.11 0.13 0.00 0.02 0.00 0.00 34.50 32.34 1req s PRO 375 CO 0.49 -1.27 0.97 0.95 -0.33 0.00 0.00 177.00 177.82 1req s THR 376 N -1.38 2.05 0.05 0.99 -4.23 -1.26 -4.78 115.64 107.07 1req s THR 376 Ca 0.75 -0.70 -0.24 0.00 -1.18 0.00 0.00 61.69 60.31 1req s THR 376 Cb -0.38 -2.34 -0.17 0.00 1.34 0.00 0.00 72.50 70.95 1req s THR 376 CO 0.43 0.00 1.55 0.44 -0.54 0.00 0.00 174.62 176.50 1req h ASP 377 N -0.42 0.01 -0.18 3.99 3.32 -1.98 0.66 116.42 121.82 1req h ASP 377 Ca -0.33 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 56.55 1req h ASP 377 Cb 1.27 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.78 1req h ASP 377 CO 0.38 0.21 -0.02 0.15 -1.72 0.00 0.00 179.24 178.24 1req h PHE 378 N -0.18 -0.05 -0.32 4.55 3.57 -2.00 -1.77 116.94 120.74 1req h PHE 378 Ca 0.00 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 1req h PHE 378 Cb 0.20 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1req h PHE 378 CO -0.01 -0.05 -0.08 0.66 -2.23 0.00 0.00 178.31 176.60 1req h SER 379 N 0.03 0.63 -0.93 0.41 4.64 -1.90 -2.80 113.55 113.64 1req h SER 379 Ca 0.08 -0.37 0.08 0.00 -0.47 0.00 0.00 61.79 61.12 1req h SER 379 Cb 0.12 -0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 61.96 1req h SER 379 CO -0.16 0.85 0.58 0.00 -0.87 0.00 0.00 176.83 177.23 1req h ALA 380 N 0.80 1.32 -0.48 5.18 0.00 -0.90 -1.70 119.26 123.48 1req h ALA 380 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1req h ALA 380 Cb 0.58 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1req h ALA 380 CO 0.03 0.28 0.25 -0.09 0.00 0.00 0.00 179.25 179.72 1req h ARG 381 N 1.00 0.67 -0.29 0.00 2.43 -1.13 -0.26 114.38 116.80 1req h ARG 381 Ca 0.43 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.52 1req h ARG 381 Cb 0.28 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 1req h ARG 381 CO -0.21 0.54 0.17 0.82 -1.51 0.00 0.00 179.97 179.78 1req h ILE 382 N 0.63 1.03 -0.54 1.20 2.04 -1.31 0.21 117.51 120.77 1req h ILE 382 Ca 0.17 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.95 1req h ILE 382 Cb 0.07 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.76 1req h ILE 382 CO -0.03 0.06 0.29 0.00 0.00 0.00 0.00 178.15 178.47 1req h ALA 383 N 1.13 0.70 -0.02 1.87 0.00 -1.19 0.15 119.26 121.91 1req h ALA 383 Ca 0.11 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1req h ALA 383 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1req h ALA 383 CO -0.06 -0.05 -0.65 -0.09 0.00 0.00 0.00 179.25 178.41 1req h ARG 384 N 0.55 0.07 0.00 0.00 2.43 -0.71 -2.92 114.38 113.81 1req h ARG 384 Ca 0.24 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 1req h ARG 384 Cb 0.13 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1req h ARG 384 CO -0.16 0.69 -0.14 -0.91 -1.51 0.00 0.00 179.97 177.95 1req h ASN 385 N 0.05 0.00 -0.23 -3.80 -0.26 -0.01 -1.76 115.58 109.57 1req h ASN 385 Ca -0.01 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.78 1req h ASN 385 Cb 1.16 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.37 1req h ASN 385 CO 0.09 0.14 -0.08 0.74 -1.06 0.00 0.00 177.43 177.26 1req h THR 386 N 0.00 0.72 -0.05 2.81 2.02 -0.51 0.13 112.91 118.03 1req h THR 386 Ca -0.00 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.98 1req h THR 386 Cb 0.72 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1req h THR 386 CO 0.02 0.00 -0.79 1.56 0.37 0.00 0.00 175.52 176.67 1req h GLN 387 N -0.03 0.38 -0.49 6.66 4.20 -1.43 -2.43 115.11 121.97 1req h GLN 387 Ca 0.12 -0.34 -0.08 0.00 0.06 0.00 0.00 58.65 58.41 1req h GLN 387 Cb 0.21 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1req h GLN 387 CO -0.26 1.00 0.01 -0.07 -0.67 0.00 0.00 178.83 178.84 1req h LEU 388 N 0.24 0.84 -0.85 1.46 3.38 -1.02 -1.17 115.31 118.19 1req h LEU 388 Ca -0.04 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.69 1req h LEU 388 Cb 1.39 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 1req h LEU 388 CO 0.13 0.94 0.52 0.15 0.09 0.00 0.00 178.44 180.27 1req h PHE 389 N 0.72 0.96 -0.33 1.13 3.57 -1.02 0.72 116.94 122.69 1req h PHE 389 Ca 0.14 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.55 1req h PHE 389 Cb 0.50 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1req h PHE 389 CO 0.04 0.48 -0.29 -0.07 -2.23 0.00 0.00 178.31 176.24 1req h LEU 390 N 0.94 0.72 -0.34 0.59 3.38 -1.01 0.24 115.31 119.83 1req h LEU 390 Ca 0.37 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1req h LEU 390 Cb 0.19 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1req h LEU 390 CO -0.18 0.96 -0.28 1.56 0.09 0.00 0.00 178.44 180.59 1req h GLN 391 N 0.60 0.80 0.08 1.13 4.20 -0.77 -3.30 115.11 117.85 1req h GLN 391 Ca 0.07 -0.40 -0.29 0.00 0.06 0.00 0.00 58.65 58.09 1req h GLN 391 Cb 0.79 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 1req h GLN 391 CO 0.07 1.03 -1.55 1.96 -0.67 0.00 0.00 178.83 179.66 1req h GLN 392 N 0.58 0.17 0.00 1.46 4.20 -0.37 -3.44 115.11 117.71 1req h GLN 392 Ca 0.06 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 1req h GLN 392 Cb 0.85 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.74 1req h GLN 392 CO 0.07 1.14 -1.63 0.39 -0.67 0.00 0.00 178.83 178.14 1req n GLU 393 N -3.94 0.45 0.09 1.46 1.02 0.81 -4.74 120.64 115.79 1req n GLU 393 Ca -0.29 -0.12 -0.02 0.00 -0.02 0.00 0.00 57.16 56.70 1req n GLU 393 Cb 0.88 -1.32 0.22 0.00 -0.02 0.00 0.00 31.44 31.20 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 0.26 -0.63 1.62 4.64 -1.59 -3.46 113.55 114.39 1req h SER 394 Ca -0.01 -0.11 -0.16 0.00 -0.47 0.00 0.00 61.79 61.04 1req h SER 394 Cb 0.65 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 62.62 1req h SER 394 CO 0.00 0.64 -0.17 0.61 -0.87 0.00 0.00 176.83 177.04 1req n GLY 395 N -0.20 0.69 0.87 -0.77 0.00 -1.26 -4.88 105.19 99.64 1req n GLY 395 Ca -0.01 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.17 0.33 0.82 2.61 -2.24 -1.26 -3.60 114.28 107.76 1req n THR 396 Ca -0.09 -0.55 0.11 0.00 -2.27 0.00 0.00 64.05 61.26 1req n THR 396 Cb 0.36 0.75 0.12 0.00 -2.10 0.00 0.00 70.33 69.46 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 0.96 0.09 0.22 4.28 -2.24 -1.26 -4.50 114.28 111.83 1req n THR 397 Ca 0.18 -0.11 0.10 0.00 -2.27 0.00 0.00 64.05 61.95 1req n THR 397 Cb 0.48 0.30 0.39 0.00 -2.10 0.00 0.00 70.33 69.40 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 0.00 -6.27 -0.78 0.11 -1.84 -2.76 114.38 102.84 1req h ARG 398 Ca 0.00 0.00 -0.68 0.00 0.10 0.00 0.00 59.98 59.40 1req h ARG 398 Cb 0.60 0.00 -0.19 0.00 1.11 0.00 0.00 29.97 31.49 1req h ARG 398 CO 0.00 0.20 -0.72 0.08 0.10 0.00 0.00 179.97 179.64 1req s VAL 399 N -3.49 3.53 -0.23 0.08 1.01 -1.26 -4.60 120.40 115.43 1req s VAL 399 Ca 0.02 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 61.01 1req s VAL 399 Cb 0.09 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.99 1req s VAL 399 CO 0.64 0.48 1.10 -0.63 0.00 0.00 0.00 175.10 176.69 1req s ILE 400 N -0.90 4.56 -0.64 2.22 1.01 -1.26 -4.06 121.20 122.14 1req s ILE 400 Ca 0.15 1.88 -0.13 0.00 0.00 0.00 0.00 60.65 62.54 1req s ILE 400 Cb -0.11 -4.26 0.02 0.00 0.01 0.00 0.00 42.46 38.12 1req s ILE 400 CO 0.04 -0.22 0.64 -0.67 0.00 0.00 0.00 174.94 174.73 1req n ASP 401 N 6.49 -6.28 -0.13 3.58 2.03 -1.26 -4.88 116.55 116.09 1req n ASP 401 Ca 0.12 -0.27 0.01 0.00 0.52 0.00 0.00 54.79 55.18 1req n ASP 401 Cb 0.46 -3.21 0.30 0.00 -0.72 0.00 0.00 41.12 37.95 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 0.93 0.82 0.00 -0.67 0.13 -1.83 -2.03 132.00 129.35 1req h PRO 402 Ca -0.35 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1req h PRO 402 Cb 1.24 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1req h PRO 402 CO 0.29 0.57 0.00 0.91 -0.23 0.00 0.00 178.00 179.54 1req n TRP 403 N -4.42 0.00 -1.65 1.56 7.02 -1.26 -4.87 117.44 113.82 1req n TRP 403 Ca 0.06 0.00 -0.55 0.00 -1.02 0.00 0.00 57.50 55.99 1req n TRP 403 Cb 0.07 -0.31 -0.07 0.00 -2.42 0.00 0.00 31.31 28.58 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 -1.31 2.51 0.00 -0.99 2.88 -0.76 -0.69 113.62 115.26 1req n SER 404 Ca 0.11 0.92 0.00 0.00 -1.33 0.00 0.00 58.87 58.57 1req n SER 404 Cb 0.20 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.46 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 4.77 2.84 3.27 0.46 0.00 -1.26 -5.04 105.19 110.23 1req n GLY 405 Ca 0.29 -0.59 -0.56 0.00 0.00 0.00 0.00 46.02 45.16 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 0.48 0.21 -0.11 1.61 2.88 0.14 -4.86 113.62 113.97 1req n SER 406 Ca 0.00 1.08 -0.14 0.00 -1.33 0.00 0.00 58.87 58.48 1req n SER 406 Cb 0.00 -0.84 -0.03 0.00 -0.75 0.00 0.00 64.21 62.59 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 3.13 0.53 0.33 -1.46 0.00 -1.90 -0.96 119.26 118.94 1req h ALA 407 Ca -0.46 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 53.98 1req h ALA 407 Cb 1.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1req h ALA 407 CO 0.66 0.65 -0.25 -0.92 0.00 0.00 0.00 179.25 179.39 1req h TYR 408 N 0.72 -0.66 -0.35 0.00 3.20 -1.89 -1.30 116.97 116.69 1req h TYR 408 Ca 0.05 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1req h TYR 408 Cb 1.00 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.50 1req h TYR 408 CO 0.07 -0.38 0.17 0.28 -1.64 0.00 0.00 178.16 176.66 1req h VAL 409 N -0.58 1.16 -0.41 1.81 2.07 -1.88 -0.87 116.25 117.55 1req h VAL 409 Ca -0.03 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.08 1req h VAL 409 Cb 0.51 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1req h VAL 409 CO -0.00 0.17 0.19 -0.33 0.02 0.00 0.00 177.57 177.61 1req h GLU 410 N 0.42 0.37 -0.28 1.57 4.39 -1.23 0.56 114.58 120.38 1req h GLU 410 Ca 0.12 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1req h GLU 410 Cb 0.11 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1req h GLU 410 CO -0.02 0.24 0.12 1.49 -1.16 0.00 0.00 179.01 179.69 1req h GLU 411 N 0.38 0.41 -0.65 2.33 4.57 -0.95 -1.68 114.58 118.99 1req h GLU 411 Ca 0.18 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.27 1req h GLU 411 Cb 0.12 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1req h GLU 411 CO -0.15 0.41 0.31 -0.07 -1.18 0.00 0.00 179.01 178.33 1req h LEU 412 N 0.31 0.83 0.06 1.64 3.38 -0.80 -0.77 115.31 119.95 1req h LEU 412 Ca 0.09 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1req h LEU 412 Cb 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1req h LEU 412 CO -0.01 0.71 -0.14 0.74 0.09 0.00 0.00 178.44 179.83 1req h THR 413 N 0.91 0.67 -0.61 0.22 2.02 -0.69 -0.31 112.91 115.13 1req h THR 413 Ca 0.22 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.40 1req h THR 413 Cb 0.10 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1req h THR 413 CO -0.03 0.00 0.38 -0.25 0.37 0.00 0.00 175.52 175.99 1req h TRP 414 N -0.26 0.80 0.26 3.16 -0.00 -1.17 0.71 115.95 119.44 1req h TRP 414 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 1req h TRP 414 Cb 0.29 -0.26 0.00 0.00 -0.00 0.00 0.00 29.16 29.19 1req h TRP 414 CO -0.17 0.54 -0.13 -0.44 -0.00 0.00 0.00 178.44 178.25 1req h ASP 415 N 0.83 -0.30 -0.63 2.65 3.32 -0.95 -1.63 116.42 119.72 1req h ASP 415 Ca 0.22 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1req h ASP 415 Cb -0.03 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1req h ASP 415 CO -0.04 -0.18 0.33 -0.07 -1.72 0.00 0.00 179.24 177.57 1req h LEU 416 N -0.39 0.79 -0.25 1.55 3.38 -1.02 -1.16 115.31 118.20 1req h LEU 416 Ca -0.04 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1req h LEU 416 Cb 0.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1req h LEU 416 CO 0.06 0.67 0.13 0.00 0.09 0.00 0.00 178.44 179.38 1req h ALA 417 N 1.16 0.30 -0.17 1.53 0.00 -0.79 -0.51 119.26 120.77 1req h ALA 417 Ca 0.22 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1req h ALA 417 Cb 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1req h ALA 417 CO -0.03 -0.27 -0.07 0.00 0.00 0.00 0.00 179.25 178.87 1req h ARG 418 N 0.27 0.36 -0.57 0.00 3.08 -1.19 -0.44 114.38 115.88 1req h ARG 418 Ca 0.10 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1req h ARG 418 Cb 0.03 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1req h ARG 418 CO -0.07 0.65 0.22 0.87 -1.07 0.00 0.00 179.97 180.57 1req h LYS 419 N 0.05 0.87 -0.12 0.04 1.57 -1.09 -2.50 116.57 115.38 1req h LYS 419 Ca 0.04 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.52 1req h LYS 419 Cb 0.54 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1req h LYS 419 CO 0.02 0.75 -0.51 0.00 -0.57 0.00 0.00 179.45 179.15 1req h ALA 420 N 1.07 0.91 -0.63 3.86 0.00 -1.18 -2.74 119.26 120.55 1req h ALA 420 Ca 0.19 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1req h ALA 420 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1req h ALA 420 CO -0.01 0.67 0.02 2.35 0.00 0.00 0.00 179.25 182.28 1req h TRP 421 N 0.25 1.19 -0.25 0.00 2.91 -0.76 -2.14 115.95 117.15 1req h TRP 421 Ca 0.01 -0.20 -0.09 0.00 1.13 0.00 0.00 58.89 59.75 1req h TRP 421 Cb 0.99 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 29.31 1req h TRP 421 CO 0.02 1.03 -0.22 0.78 -1.03 0.00 0.00 178.44 179.02 1req h GLY 422 N 1.01 0.49 0.99 2.65 0.00 -1.28 -0.95 103.07 105.97 1req h GLY 422 Ca 0.18 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 1req h GLY 422 CO 0.03 0.35 0.24 0.45 0.00 0.00 0.00 176.54 177.61 1req h HIS 423 N 0.41 0.86 -0.35 5.60 3.86 -1.18 -1.78 115.15 122.56 1req h HIS 423 Ca 0.07 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1req h HIS 423 Cb 0.61 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 1req h HIS 423 CO 0.02 0.69 0.14 0.82 0.86 0.00 0.00 177.93 180.45 1req h ILE 424 N 0.79 1.19 0.07 2.45 2.04 -1.15 -0.67 117.51 122.22 1req h ILE 424 Ca 0.19 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.49 1req h ILE 424 Cb 0.18 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 1req h ILE 424 CO -0.02 0.21 -0.25 1.56 0.00 0.00 0.00 178.15 179.65 1req h GLN 425 N 0.43 -0.41 0.14 2.37 4.20 -0.88 -0.95 115.11 120.01 1req h GLN 425 Ca 0.12 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.87 1req h GLN 425 Cb 0.19 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1req h GLN 425 CO -0.01 -0.27 -0.40 0.93 -0.67 0.00 0.00 178.83 178.40 1req h GLU 426 N -0.43 -0.63 -0.55 1.46 5.08 -1.17 -2.47 114.58 115.88 1req h GLU 426 Ca 0.04 0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.56 1req h GLU 426 Cb 0.48 0.14 -0.10 0.00 0.50 0.00 0.00 28.75 29.77 1req h GLU 426 CO -0.18 -0.42 -0.12 0.28 -1.00 0.00 0.00 179.01 177.57 1req h VAL 427 N -0.65 0.46 -0.09 3.13 2.07 -1.00 -1.96 116.25 118.20 1req h VAL 427 Ca 0.02 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 1req h VAL 427 Cb 0.67 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1req h VAL 427 CO -0.22 0.00 -0.13 -0.33 0.02 0.00 0.00 177.57 176.91 1req h GLU 428 N 0.01 0.14 0.00 1.57 4.39 -0.87 -2.27 114.58 117.55 1req h GLU 428 Ca 0.27 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.94 1req h GLU 428 Cb 0.41 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1req h GLU 428 CO -0.55 0.28 0.00 1.63 -1.16 0.00 0.00 179.01 179.20 1req n LYS 429 N -4.31 0.11 -0.43 2.33 4.76 -0.74 -2.65 118.16 117.21 1req n LYS 429 Ca -0.01 0.11 0.08 0.00 -2.87 0.00 0.00 58.31 55.61 1req n LYS 429 Cb 0.24 -1.50 0.27 0.00 -1.84 0.00 0.00 35.03 32.21 1req n LYS 429 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1req n VAL 430 N -1.43 1.64 -0.10 -0.18 3.14 -1.08 -4.98 118.33 115.34 1req n VAL 430 Ca 0.07 -1.28 0.00 0.00 -2.96 0.00 0.00 64.34 60.17 1req n VAL 430 Cb 0.23 0.18 0.00 0.00 -1.06 0.00 0.00 33.84 33.19 1req n VAL 430 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1req n GLY 431 N 0.62 0.98 0.00 7.55 0.00 -1.09 -4.58 105.19 108.68 1req n GLY 431 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.00 1.82 0.17 -0.02 0.00 -0.88 -4.70 105.19 99.59 1req n GLY 432 Ca 0.00 -2.17 -0.05 0.00 0.00 0.00 0.00 46.02 43.80 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 0.26 -0.89 1.61 2.86 -1.83 -0.01 114.93 116.93 1req h MET 433 Ca 0.00 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1req h MET 433 Cb 0.00 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.64 1req h MET 433 CO 0.00 0.77 0.53 0.00 1.06 0.00 0.00 176.91 179.27 1req h ALA 434 N 1.19 1.26 -0.23 6.32 0.00 -1.95 0.31 119.26 126.17 1req h ALA 434 Ca -0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1req h ALA 434 Cb 1.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1req h ALA 434 CO 0.09 0.63 -0.34 0.87 0.00 0.00 0.00 179.25 180.51 1req h LYS 435 N 1.23 0.63 -0.34 0.00 1.57 -1.83 -0.93 116.57 116.90 1req h LYS 435 Ca 0.32 -0.37 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1req h LYS 435 Cb -0.04 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1req h LYS 435 CO -0.06 0.98 0.12 0.00 -0.57 0.00 0.00 179.45 179.93 1req h ALA 436 N 0.64 0.44 -0.56 3.86 0.00 -0.74 -2.49 119.26 120.40 1req h ALA 436 Ca 0.02 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1req h ALA 436 Cb 0.92 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1req h ALA 436 CO 0.08 0.05 0.13 0.82 0.00 0.00 0.00 179.25 180.33 1req h ILE 437 N 0.39 1.23 -0.55 0.00 2.04 -0.39 -3.01 117.51 117.23 1req h ILE 437 Ca 0.11 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 1req h ILE 437 Cb 0.21 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 1req h ILE 437 CO -0.01 0.32 0.24 -0.08 0.00 0.00 0.00 178.15 178.62 1req h GLU 438 N 0.83 0.77 0.00 2.37 4.57 -0.73 -2.21 114.58 120.19 1req h GLU 438 Ca 0.18 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1req h GLU 438 Cb 0.31 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1req h GLU 438 CO -0.00 0.61 0.00 0.87 -1.18 0.00 0.00 179.01 179.31 1req h LYS 439 N 0.77 0.00 0.00 1.92 1.57 -1.35 -3.47 116.57 116.01 1req h LYS 439 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1req h LYS 439 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1req h LYS 439 CO -0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.27 1req n GLY 440 N -0.09 0.73 0.28 3.86 0.00 -0.83 -4.97 105.19 104.16 1req n GLY 440 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 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 0.53 -0.12 -0.61 2.04 -1.83 -2.19 117.51 115.33 1req h ILE 441 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1req h ILE 441 Cb 0.00 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 1req h ILE 441 CO 0.00 0.00 -0.30 -0.65 0.00 0.00 0.00 178.15 177.20 1req h PRO 442 N -0.65 -0.37 -0.86 2.37 0.11 -1.91 0.39 132.00 131.09 1req h PRO 442 Ca -0.07 0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.12 1req h PRO 442 Cb 0.49 0.08 -0.06 0.00 0.11 0.00 0.00 31.00 31.63 1req h PRO 442 CO 0.11 -0.25 0.54 -0.22 -0.21 0.00 0.00 178.00 177.97 1req h LYS 443 N -0.39 0.98 -0.57 1.05 3.64 -1.78 -2.20 116.57 117.30 1req h LYS 443 Ca 0.09 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 1req h LYS 443 Cb 0.53 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1req h LYS 443 CO -0.33 0.65 0.06 0.52 -2.27 0.00 0.00 179.45 178.07 1req h MET 444 N 1.01 0.96 -0.48 1.90 2.86 -0.49 -0.92 114.93 119.78 1req h MET 444 Ca 0.36 -0.28 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 1req h MET 444 Cb 0.11 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 1req h MET 444 CO -0.15 0.94 0.23 -0.09 1.06 0.00 0.00 176.91 178.90 1req h ARG 445 N 0.85 0.45 -0.40 1.72 9.65 0.00 -0.38 114.38 126.27 1req h ARG 445 Ca 0.17 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.01 1req h ARG 445 Cb 0.47 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.93 1req h ARG 445 CO 0.02 0.30 0.22 0.82 2.80 0.00 0.00 179.97 184.12 1req h ILE 446 N 0.46 1.15 -0.39 1.20 2.04 -1.18 -2.56 117.51 118.23 1req h ILE 446 Ca 0.21 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1req h ILE 446 Cb 0.12 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1req h ILE 446 CO -0.15 0.16 0.15 -0.33 0.00 0.00 0.00 178.15 177.98 1req h GLU 447 N 0.51 0.56 -0.11 2.37 5.08 -0.49 -1.22 114.58 121.28 1req h GLU 447 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1req h GLU 447 Cb 0.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1req h GLU 447 CO -0.02 0.46 0.07 0.93 -1.00 0.00 0.00 179.01 179.45 1req h GLU 448 N 0.56 0.14 -0.64 2.33 5.08 -0.96 -0.02 114.58 121.06 1req h GLU 448 Ca 0.14 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1req h GLU 448 Cb 0.12 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1req h GLU 448 CO -0.01 0.10 0.28 0.00 -1.00 0.00 0.00 179.01 178.37 1req h ALA 449 N 1.04 1.30 -0.32 3.43 0.00 -1.23 0.77 119.26 124.25 1req h ALA 449 Ca 0.04 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1req h ALA 449 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1req h ALA 449 CO -0.01 0.53 -0.31 0.00 0.00 0.00 0.00 179.25 179.47 1req h ALA 450 N 1.40 0.87 -0.17 0.00 0.00 -0.92 0.75 119.26 121.19 1req h ALA 450 Ca 0.22 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1req h ALA 450 Cb 0.13 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1req h ALA 450 CO -0.02 0.63 -0.12 0.00 0.00 0.00 0.00 179.25 179.74 1req h ALA 451 N 1.08 0.24 -0.20 0.00 0.00 -0.56 -0.95 119.26 118.87 1req h ALA 451 Ca 0.07 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1req h ALA 451 Cb 0.81 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1req h ALA 451 CO 0.07 0.09 0.01 0.00 0.00 0.00 0.00 179.25 179.42 1req h ARG 452 N 0.03 0.07 -0.52 0.00 3.08 -0.77 -1.25 114.38 115.02 1req h ARG 452 Ca 0.03 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.12 1req h ARG 452 Cb 0.62 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 1req h ARG 452 CO 0.03 0.05 0.28 1.15 -1.07 0.00 0.00 179.97 180.41 1req h THR 453 N 0.08 0.98 -0.61 2.04 2.02 -0.82 -2.55 112.91 114.04 1req h THR 453 Ca 0.09 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1req h THR 453 Cb 0.11 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 1req h THR 453 CO -0.15 0.10 0.30 -0.61 0.37 0.00 0.00 175.52 175.52 1req h GLN 454 N 0.54 0.86 -0.34 6.66 5.75 -0.38 -1.58 115.11 126.60 1req h GLN 454 Ca 0.23 -0.11 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1req h GLN 454 Cb 0.12 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 1req h GLN 454 CO -0.15 0.66 0.07 0.00 -2.65 0.00 0.00 178.83 176.76 1req h ALA 455 N 1.47 0.46 -0.12 3.38 0.00 -1.11 0.37 119.26 123.69 1req h ALA 455 Ca 0.21 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 455 Cb 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1req h ALA 455 CO -0.03 0.14 -0.03 0.00 0.00 0.00 0.00 179.25 179.33 1req h ARG 456 N 0.40 -0.00 -0.35 0.00 3.08 -1.18 -0.69 114.38 115.64 1req h ARG 456 Ca 0.11 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 1req h ARG 456 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1req h ARG 456 CO 0.00 -0.00 -0.05 0.82 -1.07 0.00 0.00 179.97 179.67 1req h ILE 457 N -0.00 1.27 -0.63 2.04 2.04 -1.25 -1.90 117.51 119.08 1req h ILE 457 Ca 0.06 -1.09 -0.06 0.00 1.00 0.00 0.00 64.86 64.77 1req h ILE 457 Cb 0.09 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1req h ILE 457 CO -0.13 0.36 0.15 0.44 0.00 0.00 0.00 178.15 178.96 1req h ASP 458 N 0.44 0.93 1.25 1.72 3.32 -0.01 -2.52 116.42 121.55 1req h ASP 458 Ca 0.09 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.92 1req h ASP 458 Cb 0.54 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1req h ASP 458 CO 0.03 0.90 -0.18 0.77 -1.72 0.00 0.00 179.24 179.04 1req h SER 459 N 0.94 0.00 0.00 6.45 4.64 -1.22 -3.48 113.55 120.89 1req h SER 459 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1req h SER 459 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1req h SER 459 CO 0.00 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.76 1req n GLY 460 N 0.49 0.81 0.21 -0.77 0.00 -0.88 -4.96 105.19 100.09 1req n GLY 460 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 3.84 0.67 -4.40 1.61 -0.00 -1.64 -3.38 114.38 111.08 1req h ARG 461 Ca 0.00 -0.25 -0.73 0.00 -0.50 0.00 0.00 59.98 58.50 1req h ARG 461 Cb 0.00 -0.04 -0.22 0.00 0.00 0.00 0.00 29.97 29.71 1req h ARG 461 CO 0.00 0.82 -0.39 -1.14 0.00 0.00 0.00 179.97 179.27 1req s GLN 462 N -4.81 2.94 0.48 0.04 0.74 -0.96 -5.01 119.66 113.09 1req s GLN 462 Ca -0.13 -1.22 -0.24 0.00 0.05 0.00 0.00 55.36 53.83 1req s GLN 462 Cb 0.09 -4.03 -0.08 0.00 1.10 0.00 0.00 33.01 30.10 1req s GLN 462 CO 0.80 -0.90 1.32 -2.30 -0.55 0.00 0.00 175.29 173.65 1req n PRO 463 N 5.16 1.86 -3.43 1.67 -0.02 -1.26 -4.32 135.00 134.65 1req n PRO 463 Ca -0.12 0.67 -0.24 0.00 -2.02 0.00 0.00 63.50 61.79 1req n PRO 463 Cb 0.45 -2.49 -0.11 0.00 -0.02 0.00 0.00 33.50 31.33 1req n PRO 463 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1req s LEU 464 N -2.49 0.47 0.15 2.45 2.96 -1.26 -5.04 118.68 115.92 1req s LEU 464 Ca 0.65 -1.74 -0.33 0.00 -0.22 0.00 0.00 54.13 52.50 1req s LEU 464 Cb -0.46 -0.00 -0.13 0.00 0.50 0.00 0.00 46.19 46.10 1req s LEU 464 CO 0.54 -0.32 1.67 -0.38 -1.32 0.00 0.00 176.35 176.54 1req n ILE 465 N 4.39 0.08 0.00 6.68 2.08 -1.26 -1.74 119.36 129.59 1req n ILE 465 Ca 0.08 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.37 1req n ILE 465 Cb 0.41 -1.75 0.00 0.00 -0.75 0.00 0.00 39.64 37.55 1req n ILE 465 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1req n GLY 466 N 3.73 1.96 0.60 7.39 0.00 0.41 -4.85 105.19 114.43 1req n GLY 466 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 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 0.32 0.15 1.61 0.31 -0.71 -4.43 118.33 113.57 1req n VAL 467 Ca 0.00 0.23 0.09 0.00 -0.01 0.00 0.00 64.34 64.65 1req n VAL 467 Cb 0.00 -1.37 0.17 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 -2.83 3.06 -3.64 4.52 0.23 -0.88 -4.80 115.26 110.92 1req n ASN 468 Ca -0.01 -1.89 -0.07 0.00 -0.53 0.00 0.00 54.58 52.08 1req n ASN 468 Cb 0.05 -0.22 -0.07 0.00 -2.08 0.00 0.00 39.78 37.47 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 -1.20 0.68 -1.37 -3.83 2.20 -1.25 -4.89 119.74 110.09 1req s LYS 469 Ca 0.30 1.19 -0.04 0.00 -0.36 0.00 0.00 55.97 57.06 1req s LYS 469 Cb 0.17 0.14 0.02 0.00 -1.51 0.00 0.00 37.83 36.66 1req s LYS 469 CO 0.24 -0.15 0.78 0.66 -0.36 0.00 0.00 175.35 176.52 1req n TYR 470 N 4.29 -2.03 -1.28 4.03 4.01 -1.26 -0.44 117.16 124.47 1req n TYR 470 Ca -0.20 0.86 -0.34 0.00 -0.16 0.00 0.00 57.90 58.06 1req n TYR 470 Cb 0.59 -4.30 0.11 0.00 -0.31 0.00 0.00 39.34 35.42 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 -6.15 1.89 0.23 -0.72 0.52 -1.26 -4.21 118.95 109.24 1req s ARG 471 Ca 0.18 1.78 -0.07 0.00 -0.52 0.00 0.00 55.73 57.11 1req s ARG 471 Cb -0.09 -1.80 -0.06 0.00 0.52 0.00 0.00 34.95 33.52 1req s ARG 471 CO 0.82 -2.03 0.51 -0.51 0.02 0.00 0.00 175.30 174.10 1req s LEU 472 N -5.40 4.16 0.04 2.53 1.43 -1.26 -5.00 118.68 115.18 1req s LEU 472 Ca 0.74 0.78 -0.32 0.00 -1.03 0.00 0.00 54.13 54.30 1req s LEU 472 Cb -0.30 -3.55 -0.18 0.00 0.03 0.00 0.00 46.19 42.20 1req s LEU 472 CO 0.48 -0.08 1.41 -0.33 0.23 0.00 0.00 176.35 178.06 1req h GLU 473 N 2.36 -1.12 -5.70 1.70 4.39 -2.01 -3.42 114.58 110.78 1req h GLU 473 Ca -0.47 0.08 -0.69 0.00 0.34 0.00 0.00 59.36 58.62 1req h GLU 473 Cb 1.17 0.25 -0.32 0.00 -0.10 0.00 0.00 28.75 29.76 1req h GLU 473 CO 0.69 -0.74 -0.88 -3.38 -1.16 0.00 0.00 179.01 173.54 1req s HIS 474 N -5.42 2.50 -0.38 4.33 -3.43 -1.26 -5.10 115.29 106.53 1req s HIS 474 Ca -0.17 -0.87 -0.23 0.00 -0.80 0.00 0.00 55.06 53.00 1req s HIS 474 Cb 0.02 -1.65 0.01 0.00 -1.43 0.00 0.00 32.58 29.52 1req s HIS 474 CO 0.51 -0.31 0.77 -1.21 -2.00 0.00 0.00 174.74 172.50 1req s GLU 475 N 0.07 3.70 0.65 -0.38 0.41 -1.26 -5.03 118.70 116.86 1req s GLU 475 Ca -0.11 0.23 -0.17 0.00 -0.41 0.00 0.00 54.97 54.51 1req s GLU 475 Cb -0.16 -3.83 -0.02 0.00 -1.78 0.00 0.00 34.13 28.35 1req s GLU 475 CO 0.06 -0.88 1.07 -0.35 -0.49 0.00 0.00 175.26 174.67 1req n PRO 476 N 6.43 0.84 -2.08 0.39 -0.05 -1.26 -4.93 135.00 134.35 1req n PRO 476 Ca 0.03 0.34 -0.41 0.00 -0.05 0.00 0.00 63.50 63.40 1req n PRO 476 Cb 0.48 -2.30 -0.03 0.00 -0.05 0.00 0.00 33.50 31.60 1req n PRO 476 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 175.50 174.20 1req s PRO 477 N -3.13 4.30 -0.13 0.54 0.04 -1.26 -5.02 135.00 130.33 1req s PRO 477 Ca 0.78 2.22 0.01 0.00 0.04 0.00 0.00 61.00 64.05 1req s PRO 477 Cb -0.38 -3.15 -0.00 0.00 0.04 0.00 0.00 34.50 31.01 1req s PRO 477 CO 0.45 -0.39 -0.18 -1.17 0.04 0.00 0.00 177.00 175.76 1req s LEU 478 N -0.08 2.38 -0.00 -3.56 2.96 -1.26 -5.10 118.68 114.02 1req s LEU 478 Ca 0.60 -0.48 -0.30 0.00 -0.22 0.00 0.00 54.13 53.73 1req s LEU 478 Cb -0.40 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 1req s LEU 478 CO 0.40 0.12 1.28 1.51 -1.32 0.00 0.00 176.35 178.34 1req s ASP 479 N 0.58 6.97 0.09 3.68 3.84 -1.26 -5.02 116.67 125.56 1req s ASP 479 Ca -0.11 1.99 0.06 0.00 -0.00 0.00 0.00 52.55 54.50 1req s ASP 479 Cb -0.16 -2.57 -0.03 0.00 -1.38 0.00 0.00 42.92 38.78 1req s ASP 479 CO 0.04 -0.61 -0.16 0.68 -0.00 0.00 0.00 175.17 175.12 1req s VAL 480 N 1.96 1.32 0.10 2.11 -7.23 -1.26 -4.96 120.40 112.44 1req s VAL 480 Ca 0.60 -1.47 -0.31 0.00 -1.81 0.00 0.00 61.98 58.98 1req s VAL 480 Cb -0.29 -1.31 -0.08 0.00 0.56 0.00 0.00 36.38 35.26 1req s VAL 480 CO 0.26 -0.23 1.52 -0.22 -0.31 0.00 0.00 175.10 176.12 1req s LEU 481 N -1.97 4.36 -0.11 1.32 2.96 -1.25 -5.00 118.68 118.99 1req s LEU 481 Ca 0.03 2.43 0.02 0.00 -0.22 0.00 0.00 54.13 56.40 1req s LEU 481 Cb -0.09 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1req s LEU 481 CO 0.03 -0.78 -0.19 -0.75 -1.32 0.00 0.00 176.35 173.34 1req s LYS 482 N 1.74 3.15 0.08 1.98 2.20 -1.26 -4.44 119.74 123.19 1req s LYS 482 Ca 0.69 -0.79 -0.13 0.00 -0.36 0.00 0.00 55.97 55.38 1req s LYS 482 Cb -0.39 -2.44 -0.06 0.00 -1.51 0.00 0.00 37.83 33.43 1req s LYS 482 CO 0.31 0.22 0.47 0.08 -0.36 0.00 0.00 175.35 176.07 1req s VAL 483 N 0.28 4.97 -0.40 4.02 1.01 -1.26 -5.09 120.40 123.92 1req s VAL 483 Ca -0.13 0.73 -0.11 0.00 0.00 0.00 0.00 61.98 62.47 1req s VAL 483 Cb -0.17 -3.71 0.05 0.00 0.00 0.00 0.00 36.38 32.55 1req s VAL 483 CO 0.07 0.36 0.25 -0.62 0.00 0.00 0.00 175.10 175.16 1req s ASP 484 N -1.54 5.77 0.12 3.32 2.15 -1.26 -5.02 116.67 120.20 1req s ASP 484 Ca 0.32 -1.20 -0.17 0.00 0.43 0.00 0.00 52.55 51.92 1req s ASP 484 Cb -0.15 -2.04 -0.04 0.00 -0.30 0.00 0.00 42.92 40.39 1req s ASP 484 CO 0.17 -0.47 1.66 0.78 -0.17 0.00 0.00 175.17 177.14 1req h ASN 485 N 8.47 0.44 0.00 -0.34 4.21 -1.93 -3.31 115.58 123.12 1req h ASN 485 Ca -0.25 -0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.09 1req h ASN 485 Cb 1.10 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.18 1req h ASN 485 CO 0.73 0.49 0.00 -0.24 -1.29 0.00 0.00 177.43 177.11 1req n SER 486 N -4.72 0.00 0.16 5.81 2.88 -1.26 0.14 113.62 116.63 1req n SER 486 Ca -0.02 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.57 1req n SER 486 Cb 0.14 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.77 1req n SER 486 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1req h THR 487 N 0.00 0.85 0.24 2.46 1.03 -1.98 -1.89 112.91 113.62 1req h THR 487 Ca 0.00 -1.89 -0.01 0.00 -0.01 0.00 0.00 66.41 64.50 1req h THR 487 Cb 0.00 2.20 0.00 0.00 -1.07 0.00 0.00 68.15 69.28 1req h THR 487 CO 0.00 0.43 -0.12 0.58 -0.01 0.00 0.00 175.52 176.41 1req h VAL 488 N 0.00 0.74 -0.04 0.00 2.07 -0.40 -1.31 116.25 117.32 1req h VAL 488 Ca -0.00 -0.85 0.04 0.00 0.82 0.00 0.00 66.70 66.70 1req h VAL 488 Cb 1.16 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 1req h VAL 488 CO 0.06 0.16 -0.35 0.25 0.02 0.00 0.00 177.57 177.71 1req h LEU 489 N -0.82 -1.07 -0.19 2.57 5.85 -1.47 0.31 115.31 120.49 1req h LEU 489 Ca -0.03 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1req h LEU 489 Cb 0.51 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 1req h LEU 489 CO 0.05 -0.40 -0.15 0.00 -0.34 0.00 0.00 178.44 177.60 1req h ALA 490 N 0.22 -0.02 0.00 1.25 0.00 -1.42 -1.44 119.26 117.85 1req h ALA 490 Ca 0.07 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1req h ALA 490 Cb 0.59 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1req h ALA 490 CO -0.31 -0.58 -0.50 1.49 0.00 0.00 0.00 179.25 179.35 1req h GLU 491 N -0.16 0.00 -0.17 0.00 4.81 -0.71 -2.01 114.58 116.34 1req h GLU 491 Ca 0.11 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1req h GLU 491 Cb 0.33 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 1req h GLU 491 CO -0.29 0.50 -0.24 1.96 -0.73 0.00 0.00 179.01 180.21 1req h GLN 492 N 0.00 0.46 -0.47 1.92 1.08 -0.73 -2.47 115.11 114.89 1req h GLN 492 Ca -0.00 -0.27 0.09 0.00 -1.45 0.00 0.00 58.65 57.02 1req h GLN 492 Cb 0.89 0.02 -0.08 0.00 -0.05 0.00 0.00 27.48 28.26 1req h GLN 492 CO 0.06 0.86 -0.05 0.87 -0.95 0.00 0.00 178.83 179.63 1req h LYS 493 N 0.10 0.06 -0.06 1.46 1.57 -1.21 -2.36 116.57 116.13 1req h LYS 493 Ca 0.02 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1req h LYS 493 Cb 0.81 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1req h LYS 493 CO 0.06 0.04 -0.29 0.00 -0.57 0.00 0.00 179.45 178.69 1req h ALA 494 N 1.44 1.40 0.00 3.86 0.00 -1.13 -2.63 119.26 122.21 1req h ALA 494 Ca 0.24 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1req h ALA 494 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1req h ALA 494 CO -0.43 0.43 -0.30 0.87 0.00 0.00 0.00 179.25 179.81 1req h LYS 495 N 0.10 0.00 0.09 0.00 1.57 -0.97 -1.96 116.57 115.40 1req h LYS 495 Ca 0.01 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.54 1req h LYS 495 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1req h LYS 495 CO 0.04 0.30 -1.14 -0.07 -0.57 0.00 0.00 179.45 178.01 1req h LEU 496 N 0.00 0.47 0.68 2.94 3.38 -1.41 0.45 115.31 121.81 1req h LEU 496 Ca -0.00 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1req h LEU 496 Cb 0.81 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.42 1req h LEU 496 CO 0.04 1.31 -0.33 0.58 0.09 0.00 0.00 178.44 180.14 1req h VAL 497 N 0.13 0.30 -0.67 1.22 2.07 -1.37 -1.18 116.25 116.74 1req h VAL 497 Ca -0.12 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.33 1req h VAL 497 Cb 1.84 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 1req h VAL 497 CO 0.19 0.01 0.43 0.50 0.02 0.00 0.00 177.57 178.72 1req h LYS 498 N -0.98 0.83 -0.23 1.57 3.64 -1.40 -2.35 116.57 117.64 1req h LYS 498 Ca -0.09 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.29 1req h LYS 498 Cb 0.72 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.29 1req h LYS 498 CO 0.15 0.55 -0.17 1.25 -2.27 0.00 0.00 179.45 178.96 1req h LEU 499 N 0.85 -0.54 -1.00 5.20 5.85 0.08 -2.15 115.31 123.61 1req h LEU 499 Ca 0.26 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 59.02 1req h LEU 499 Cb -0.04 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1req h LEU 499 CO -0.08 -0.21 -0.03 0.03 -0.34 0.00 0.00 178.44 177.82 1req h ARG 500 N -0.16 0.69 0.89 1.25 3.08 -1.05 -0.36 114.38 118.72 1req h ARG 500 Ca 0.13 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1req h ARG 500 Cb 0.36 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.33 1req h ARG 500 CO -0.33 0.73 -0.43 0.00 -1.07 0.00 0.00 179.97 178.87 1req h ALA 501 N 1.32 -1.32 -0.20 0.04 0.00 -1.36 -3.29 119.26 114.45 1req h ALA 501 Ca 0.13 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1req h ALA 501 Cb 0.44 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1req h ALA 501 CO 0.02 -1.23 -0.18 1.05 0.00 0.00 0.00 179.25 178.90 1req h GLU 502 N -1.19 0.35 -7.43 0.00 9.09 -1.33 -3.45 114.58 110.60 1req h GLU 502 Ca -0.12 -0.10 -0.43 0.00 0.05 0.00 0.00 59.36 58.75 1req h GLU 502 Cb 0.91 -0.04 0.18 0.00 -1.65 0.00 0.00 28.75 28.16 1req h GLU 502 CO 0.20 0.53 0.19 -0.98 0.05 0.00 0.00 179.01 179.00 1req s ARG 503 N -4.61 -0.45 -0.32 1.06 1.70 -0.15 -5.01 118.95 111.17 1req s ARG 503 Ca -0.06 0.07 -0.17 0.00 -0.47 0.00 0.00 55.73 55.10 1req s ARG 503 Cb 0.15 -1.67 -0.02 0.00 -0.57 0.00 0.00 34.95 32.84 1req s ARG 503 CO 0.76 -3.23 0.46 0.34 -1.08 0.00 0.00 175.30 172.56 1req s ASP 504 N -3.89 6.30 0.33 -2.89 -1.08 -1.26 -4.96 116.67 109.21 1req s ASP 504 Ca 0.69 0.10 0.03 0.00 -0.52 0.00 0.00 52.55 52.85 1req s ASP 504 Cb -0.12 -2.25 0.56 0.00 -1.46 0.00 0.00 42.92 39.65 1req s ASP 504 CO 0.56 -0.37 1.88 -0.65 0.52 0.00 0.00 175.17 177.11 1req h PRO 505 N 8.33 0.64 0.10 4.34 0.11 -1.94 -2.94 132.00 140.64 1req h PRO 505 Ca -0.29 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 1req h PRO 505 Cb 1.14 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1req h PRO 505 CO 0.73 0.60 -0.05 1.05 -0.21 0.00 0.00 178.00 180.11 1req h GLU 506 N 0.62 -0.13 -0.24 1.05 9.09 -1.99 -2.73 114.58 120.25 1req h GLU 506 Ca 0.14 0.01 -0.03 0.00 0.05 0.00 0.00 59.36 59.53 1req h GLU 506 Cb 0.26 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.38 1req h GLU 506 CO -0.00 0.24 0.00 0.87 0.05 0.00 0.00 179.01 180.17 1req h LYS 507 N -0.54 0.35 -0.22 1.06 1.57 -1.94 -2.35 116.57 114.49 1req h LYS 507 Ca -0.01 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 1req h LYS 507 Cb 0.44 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1req h LYS 507 CO 0.02 0.38 -0.41 0.28 -0.57 0.00 0.00 179.45 179.15 1req h VAL 508 N 0.34 1.31 -0.22 0.50 2.07 -1.59 -1.82 116.25 116.85 1req h VAL 508 Ca 0.08 -1.63 -0.11 0.00 0.82 0.00 0.00 66.70 65.87 1req h VAL 508 Cb 0.23 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1req h VAL 508 CO 0.01 0.51 -0.32 0.50 0.02 0.00 0.00 177.57 178.29 1req h LYS 509 N 0.38 0.45 -0.40 1.57 3.64 -1.21 -0.46 116.57 120.54 1req h LYS 509 Ca 0.01 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.12 1req h LYS 509 Cb 1.01 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1req h LYS 509 CO 0.09 0.72 -0.07 0.00 -2.27 0.00 0.00 179.45 177.91 1req h ALA 510 N 1.28 0.55 -0.47 5.00 0.00 -1.40 -2.05 119.26 122.17 1req h ALA 510 Ca 0.05 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1req h ALA 510 Cb 0.75 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1req h ALA 510 CO 0.06 0.40 0.06 0.00 0.00 0.00 0.00 179.25 179.76 1req h ALA 511 N 0.85 1.22 0.00 0.00 0.00 -1.04 0.16 119.26 120.45 1req h ALA 511 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1req h ALA 511 Cb 0.59 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1req h ALA 511 CO 0.04 0.52 -0.00 -0.07 0.00 0.00 0.00 179.25 179.74 1req h LEU 512 N 0.70 -0.00 -0.83 0.00 3.38 -1.05 -1.91 115.31 115.59 1req h LEU 512 Ca 0.15 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1req h LEU 512 Cb 0.35 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1req h LEU 512 CO 0.01 0.23 0.54 0.44 0.09 0.00 0.00 178.44 179.75 1req h ASP 513 N -0.24 0.91 -0.88 -0.43 5.19 -1.20 -0.02 116.42 119.75 1req h ASP 513 Ca -0.00 -0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.42 1req h ASP 513 Cb 0.24 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 39.48 1req h ASP 513 CO 0.00 0.64 0.58 0.50 -3.12 0.00 0.00 179.24 177.84 1req h LYS 514 N 1.07 1.10 0.03 3.56 3.64 -0.56 -0.32 116.57 125.09 1req h LYS 514 Ca 0.32 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1req h LYS 514 Cb -0.04 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.53 1req h LYS 514 CO -0.10 0.73 -0.01 0.82 -2.27 0.00 0.00 179.45 178.62 1req h ILE 515 N 1.13 0.98 -0.89 2.00 2.04 -0.20 -0.09 117.51 122.48 1req h ILE 515 Ca 0.34 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 66.20 1req h ILE 515 Cb -0.03 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 1req h ILE 515 CO -0.09 0.01 0.58 0.74 0.00 0.00 0.00 178.15 179.39 1req h THR 516 N -0.05 1.18 0.09 -0.27 2.02 -0.73 0.27 112.91 115.42 1req h THR 516 Ca -0.00 -0.40 0.02 0.00 0.77 0.00 0.00 66.41 66.79 1req h THR 516 Cb 0.04 -0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.35 1req h THR 516 CO 0.01 0.21 -0.18 -0.25 0.37 0.00 0.00 175.52 175.68 1req h TRP 517 N 1.16 -0.47 -0.83 3.16 7.01 -0.97 0.28 115.95 125.28 1req h TRP 517 Ca 0.34 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.32 1req h TRP 517 Cb -0.06 0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 27.16 1req h TRP 517 CO -0.01 -0.27 0.41 0.00 -2.79 0.00 0.00 178.44 175.78 1req h ALA 518 N 0.50 1.15 -0.37 2.65 0.00 -0.40 0.49 119.26 123.29 1req h ALA 518 Ca 0.03 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1req h ALA 518 Cb 0.37 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1req h ALA 518 CO -0.11 0.65 0.19 0.00 0.00 0.00 0.00 179.25 179.98 1req h ALA 519 N 1.26 0.45 0.00 0.00 0.00 0.03 -1.98 119.26 119.03 1req h ALA 519 Ca 0.29 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1req h ALA 519 Cb 0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1req h ALA 519 CO -0.04 -0.18 -0.57 0.78 0.00 0.00 0.00 179.25 179.24 1req h GLY 520 N 0.38 0.00 -6.75 0.00 0.00 -0.17 -3.40 103.07 93.14 1req h GLY 520 Ca 0.15 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.86 1req h GLY 520 CO -0.10 0.00 -0.52 0.70 0.00 0.00 0.00 176.54 176.62 1req n ASN 521 N -3.53 3.48 -4.72 0.19 4.13 0.17 -5.05 115.26 109.92 1req n ASN 521 Ca -0.00 -3.31 -0.42 0.00 1.68 0.00 0.00 54.58 52.53 1req n ASN 521 Cb 0.65 -0.76 -0.03 0.00 -1.54 0.00 0.00 39.78 38.10 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 -1.90 4.25 -0.21 3.52 0.04 -1.21 -4.76 135.00 134.73 1req s PRO 522 Ca 0.31 2.28 -0.04 0.00 0.04 0.00 0.00 61.00 63.59 1req s PRO 522 Cb 0.03 -3.16 0.09 0.00 0.04 0.00 0.00 34.50 31.50 1req s PRO 522 CO -0.10 -0.52 0.17 0.34 0.04 0.00 0.00 177.00 176.94 1req s ASP 523 N 0.93 1.96 0.00 6.66 2.15 -1.26 -5.04 116.67 122.06 1req s ASP 523 Ca 0.66 -0.51 0.27 0.00 0.43 0.00 0.00 52.55 53.40 1req s ASP 523 Cb -0.42 0.10 1.30 0.00 -0.30 0.00 0.00 42.92 43.61 1req s ASP 523 CO 0.34 -0.35 1.92 -0.90 -0.17 0.00 0.00 175.17 176.01 1req n ASP 524 N 5.30 0.00 -0.15 -0.34 5.68 -1.26 -2.34 116.55 123.44 1req n ASP 524 Ca -0.06 0.13 0.14 0.00 -0.50 0.00 0.00 54.79 54.50 1req n ASP 524 Cb 0.48 -0.37 0.59 0.00 -1.14 0.00 0.00 41.12 40.68 1req n ASP 524 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1req n LYS 525 N -1.37 0.76 -4.28 0.11 4.01 -1.26 -4.71 118.16 111.42 1req n LYS 525 Ca 0.10 -0.29 -0.33 0.00 -0.51 0.00 0.00 58.31 57.28 1req n LYS 525 Cb 0.26 -1.49 -0.16 0.00 -0.51 0.00 0.00 35.03 33.12 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 -2.44 3.11 0.45 4.39 2.15 -0.99 -5.01 116.67 118.34 1req s ASP 526 Ca 0.29 -0.63 0.25 0.00 0.43 0.00 0.00 52.55 52.89 1req s ASP 526 Cb 0.20 -1.46 0.99 0.00 -0.30 0.00 0.00 42.92 42.35 1req s ASP 526 CO 0.47 0.02 1.86 -0.65 -0.17 0.00 0.00 175.17 176.70 1req h PRO 527 N 7.76 0.00 0.00 4.34 0.11 -1.85 -3.10 132.00 139.26 1req h PRO 527 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1req h PRO 527 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1req h PRO 527 CO 0.61 0.21 0.00 -0.44 -0.21 0.00 0.00 178.00 178.17 1req h ASP 528 N 0.00 0.00 0.91 -2.05 3.32 -1.95 -2.58 116.42 114.07 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 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1req h ASP 528 CO 0.03 0.00 -0.52 -1.14 -1.72 0.00 0.00 179.24 175.89 1req n ARG 529 N -2.67 0.25 -1.57 3.56 0.63 -1.17 -4.76 116.66 110.92 1req n ARG 529 Ca 0.04 0.09 -0.52 0.00 -0.92 0.00 0.00 57.85 56.54 1req n ARG 529 Cb 0.40 -1.68 -0.06 0.00 0.45 0.00 0.00 32.46 31.58 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 -2.05 1.35 0.21 6.15 2.85 -0.97 -4.84 115.26 117.95 1req n ASN 530 Ca 0.04 1.13 0.06 0.00 -0.11 0.00 0.00 54.58 55.69 1req n ASN 530 Cb 0.43 -1.17 0.47 0.00 1.24 0.00 0.00 39.78 40.75 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 4.02 0.00 -0.02 1.20 3.38 -1.91 -1.84 115.31 120.13 1req h LEU 531 Ca -0.46 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1req h LEU 531 Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 1req h LEU 531 CO 0.74 0.27 -0.01 0.25 0.09 0.00 0.00 178.44 179.78 1req h LEU 532 N 0.00 0.04 -0.54 1.67 5.85 -1.90 -0.94 115.31 119.50 1req h LEU 532 Ca -0.00 -0.41 0.11 0.00 0.84 0.00 0.00 57.88 58.41 1req h LEU 532 Cb 0.52 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.45 1req h LEU 532 CO 0.04 0.44 -0.04 0.50 -0.34 0.00 0.00 178.44 179.04 1req h LYS 533 N -0.36 0.08 -0.00 1.25 3.11 -1.80 -0.48 116.57 118.37 1req h LYS 533 Ca 0.00 -0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.75 1req h LYS 533 Cb 0.43 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.63 1req h LYS 533 CO 0.00 0.05 -0.44 -0.07 -2.81 0.00 0.00 179.45 176.19 1req h LEU 534 N 0.08 0.00 -0.35 5.20 3.38 -1.33 -2.21 115.31 120.09 1req h LEU 534 Ca 0.27 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 1req h LEU 534 Cb 0.43 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1req h LEU 534 CO -0.49 0.44 -0.11 0.00 0.09 0.00 0.00 178.44 178.38 1req h ILE 536 N 0.48 0.86 -0.69 0.00 2.04 -0.66 0.13 117.51 119.67 1req h ILE 536 Ca 0.09 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 1req h ILE 536 Cb 0.62 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1req h ILE 536 CO 0.04 0.09 0.35 0.44 0.00 0.00 0.00 178.15 179.07 1req h ASP 537 N 0.48 0.89 -0.48 1.72 3.32 -1.28 -1.93 116.42 119.14 1req h ASP 537 Ca 0.28 -0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1req h ASP 537 Cb 0.27 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1req h ASP 537 CO -0.24 0.76 -0.07 0.00 -1.72 0.00 0.00 179.24 177.97 1req h ALA 538 N 1.17 0.89 -0.46 3.45 0.00 -0.31 -2.49 119.26 121.51 1req h ALA 538 Ca 0.24 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1req h ALA 538 Cb 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1req h ALA 538 CO -0.03 0.64 -0.17 0.78 0.00 0.00 0.00 179.25 180.47 1req h GLY 539 N 0.97 0.96 2.00 0.00 0.00 -0.70 -0.09 103.07 106.21 1req h GLY 539 Ca 0.14 -0.79 -0.05 0.00 0.00 0.00 0.00 47.33 46.64 1req h GLY 539 CO 0.04 0.72 -0.22 -0.09 0.00 0.00 0.00 176.54 176.99 1req h ARG 540 N 0.78 0.00 0.00 4.80 2.43 -1.29 -1.30 114.38 119.80 1req h ARG 540 Ca 0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1req h ARG 540 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1req h ARG 540 CO 0.05 0.22 0.00 0.00 -1.51 0.00 0.00 179.97 178.73 1req n ALA 541 N -2.29 2.62 -2.23 2.80 0.00 -0.94 -4.91 120.51 115.56 1req n ALA 541 Ca -0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 53.44 53.22 1req n ALA 541 Cb 0.35 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 -0.98 -0.49 -2.18 0.00 2.81 -0.49 -4.68 117.12 111.10 1req n MET 542 Ca 0.22 0.13 -0.32 0.00 -1.81 0.00 0.00 57.70 55.92 1req n MET 542 Cb 0.10 -3.56 -0.01 0.00 -0.71 0.00 0.00 33.22 29.04 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 -2.41 2.90 0.75 3.04 0.00 -0.08 -4.94 121.76 121.03 1req s ALA 543 Ca 0.02 0.27 -0.05 0.00 0.00 0.00 0.00 51.96 52.20 1req s ALA 543 Cb -0.01 -3.17 0.12 0.00 0.00 0.00 0.00 23.12 20.05 1req s ALA 543 CO 0.03 -0.55 1.05 0.95 0.00 0.00 0.00 175.76 177.24 1req s THR 544 N -2.58 2.19 0.12 0.00 -4.23 -1.26 -4.58 115.64 105.30 1req s THR 544 Ca 0.61 -0.39 -0.14 0.00 -1.18 0.00 0.00 61.69 60.59 1req s THR 544 Cb -0.13 -2.81 -0.02 0.00 1.34 0.00 0.00 72.50 70.88 1req s THR 544 CO 0.36 0.00 1.56 0.58 -0.54 0.00 0.00 174.62 176.58 1req h VAL 545 N -0.73 1.26 -0.49 2.29 2.07 -0.83 -2.32 116.25 117.49 1req h VAL 545 Ca -0.41 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.03 1req h VAL 545 Cb 1.28 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1req h VAL 545 CO 0.46 0.36 0.21 1.23 0.02 0.00 0.00 177.57 179.85 1req h GLY 546 N 0.54 0.78 0.96 2.17 0.00 -1.82 -1.56 103.07 104.15 1req h GLY 546 Ca 0.11 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 1req h GLY 546 CO 0.03 0.39 -0.08 0.83 0.00 0.00 0.00 176.54 177.70 1req h GLU 547 N 0.66 -0.21 -0.67 4.80 5.08 -1.86 0.25 114.58 122.62 1req h GLU 547 Ca 0.17 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1req h GLU 547 Cb 0.17 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1req h GLU 547 CO -0.02 -0.14 0.43 0.52 -1.00 0.00 0.00 179.01 178.81 1req h MET 548 N -0.22 0.84 -0.49 2.33 2.86 -1.50 -0.03 114.93 118.72 1req h MET 548 Ca -0.01 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 1req h MET 548 Cb 0.18 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1req h MET 548 CO 0.01 0.55 0.11 0.77 1.06 0.00 0.00 176.91 179.42 1req h SER 549 N 0.86 0.75 -0.86 1.22 0.02 -0.80 -2.86 113.55 111.89 1req h SER 549 Ca 0.26 -0.24 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1req h SER 549 Cb -0.03 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.26 1req h SER 549 CO -0.08 0.80 0.56 0.44 -1.14 0.00 0.00 176.83 177.40 1req h ASP 550 N 0.68 0.93 -0.56 3.07 3.32 -0.34 -1.19 116.42 122.33 1req h ASP 550 Ca 0.15 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.28 1req h ASP 550 Cb 0.34 -0.22 -0.07 0.00 0.22 0.00 0.00 39.33 39.61 1req h ASP 550 CO 0.00 0.65 0.18 0.00 -1.72 0.00 0.00 179.24 178.35 1req h ALA 551 N 1.35 0.69 -0.16 3.45 0.00 -0.78 -1.72 119.26 122.08 1req h ALA 551 Ca 0.34 0.09 -0.16 0.00 0.00 0.00 0.00 54.91 55.18 1req h ALA 551 Cb -0.03 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1req h ALA 551 CO -0.10 -0.24 -0.56 -0.07 0.00 0.00 0.00 179.25 178.28 1req h LEU 552 N 0.34 0.55 -1.65 0.00 3.38 -1.36 -3.27 115.31 113.30 1req h LEU 552 Ca 0.28 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1req h LEU 552 Cb 0.35 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1req h LEU 552 CO -0.31 1.00 -0.16 -0.08 0.09 0.00 0.00 178.44 178.98 1req h GLU 553 N 0.38 0.02 -0.74 1.13 4.81 -0.35 -1.03 114.58 118.80 1req h GLU 553 Ca 0.00 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 1req h GLU 553 Cb 1.09 -0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.39 1req h GLU 553 CO 0.10 0.18 0.37 0.87 -0.73 0.00 0.00 179.01 179.80 1req h LYS 554 N 0.02 0.59 0.12 1.92 1.57 -1.44 0.57 116.57 119.92 1req h LYS 554 Ca 0.00 -0.04 -0.34 0.00 -1.87 0.00 0.00 60.65 58.41 1req h LYS 554 Cb 0.30 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1req h LYS 554 CO 0.02 0.39 -1.83 0.28 -0.57 0.00 0.00 179.45 177.74 1req h VAL 555 N 0.60 0.81 0.00 0.50 2.07 -1.67 -3.42 116.25 115.15 1req h VAL 555 Ca 0.37 -2.50 -0.23 0.00 0.82 0.00 0.00 66.70 65.15 1req h VAL 555 Cb 0.42 2.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.75 1req h VAL 555 CO -0.29 0.82 -1.37 -0.26 0.02 0.00 0.00 177.57 176.49 1req h PHE 556 N 0.07 0.00 -1.46 1.57 0.04 -0.91 -3.50 116.94 112.76 1req h PHE 556 Ca -0.36 0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.59 1req h PHE 556 Cb 2.04 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 40.15 1req h PHE 556 CO 0.07 0.90 -0.27 0.41 -0.60 0.00 0.00 178.31 178.82 1req n GLY 557 N 1.45 -1.69 3.58 -1.45 0.00 0.20 -4.54 105.19 102.72 1req n GLY 557 Ca -0.10 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.23 1req n GLY 557 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1req s ARG 558 N -1.75 3.28 0.28 1.61 0.52 -1.26 -4.28 118.95 117.35 1req s ARG 558 Ca 0.00 -0.49 -0.24 0.00 -0.52 0.00 0.00 55.73 54.49 1req s ARG 558 Cb 0.00 -2.82 -0.09 0.00 0.52 0.00 0.00 34.95 32.56 1req s ARG 558 CO 0.00 0.47 0.86 -0.47 0.02 0.00 0.00 175.30 176.18 1req s TYR 559 N -0.26 3.68 -0.09 -0.53 5.04 -0.38 -4.81 117.35 120.01 1req s TYR 559 Ca 0.05 1.64 0.01 0.00 -2.44 0.00 0.00 57.07 56.33 1req s TYR 559 Cb -0.13 -2.81 0.02 0.00 0.35 0.00 0.00 41.96 39.39 1req s TYR 559 CO 0.02 0.26 -0.11 0.99 -1.34 0.00 0.00 175.55 175.38 1req s THR 560 N -1.57 1.12 0.68 4.34 2.01 -1.26 -4.99 115.64 115.96 1req s THR 560 Ca 0.47 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.94 1req s THR 560 Cb -0.18 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.27 1req s THR 560 CO 0.23 0.36 1.07 0.00 -0.69 0.00 0.00 174.62 175.59 1req s ALA 561 N 1.06 2.89 -0.02 7.40 0.00 -1.26 -5.08 121.76 126.75 1req s ALA 561 Ca -0.07 -0.21 -0.17 0.00 0.00 0.00 0.00 51.96 51.51 1req s ALA 561 Cb -0.15 -3.06 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1req s ALA 561 CO -0.01 -1.04 0.47 -1.14 0.00 0.00 0.00 175.76 174.04 1req s GLN 562 N -5.26 4.14 -0.18 0.00 0.74 -1.26 -5.05 119.66 112.80 1req s GLN 562 Ca 0.57 0.51 -0.21 0.00 0.05 0.00 0.00 55.36 56.28 1req s GLN 562 Cb -0.12 -3.30 -0.03 0.00 1.10 0.00 0.00 33.01 30.66 1req s GLN 562 CO 0.53 0.48 0.62 0.42 -0.55 0.00 0.00 175.29 176.80 1req s ILE 563 N -0.46 5.04 -0.05 -2.34 -1.09 -1.26 -5.07 121.20 115.96 1req s ILE 563 Ca 0.26 1.19 0.03 0.00 -2.23 0.00 0.00 60.65 59.90 1req s ILE 563 Cb -0.17 -3.94 0.01 0.00 -1.58 0.00 0.00 42.46 36.78 1req s ILE 563 CO 0.14 0.14 -0.12 -0.13 -1.23 0.00 0.00 174.94 173.73 1req s ARG 564 N 1.70 1.59 -0.15 2.79 0.52 -1.26 -5.14 118.95 119.01 1req s ARG 564 Ca 0.29 -0.43 0.02 0.00 -0.52 0.00 0.00 55.73 55.10 1req s ARG 564 Cb -0.16 -1.35 0.01 0.00 0.52 0.00 0.00 34.95 33.98 1req s ARG 564 CO 0.11 0.08 -0.21 0.99 0.02 0.00 0.00 175.30 176.28 1req s THR 565 N 0.49 2.04 0.82 0.02 2.01 -1.26 -5.00 115.64 114.75 1req s THR 565 Ca -0.11 -0.96 -0.11 0.00 0.31 0.00 0.00 61.69 60.82 1req s THR 565 Cb -0.14 -1.81 0.08 0.00 0.01 0.00 0.00 72.50 70.64 1req s THR 565 CO 0.03 0.54 1.10 0.27 -0.69 0.00 0.00 174.62 175.87 1req s ILE 566 N 0.92 3.03 0.04 1.82 -4.36 -1.26 -5.06 121.20 116.32 1req s ILE 566 Ca -0.05 0.33 -0.02 0.00 -0.26 0.00 0.00 60.65 60.65 1req s ILE 566 Cb -0.15 -2.74 -0.02 0.00 1.25 0.00 0.00 42.46 40.79 1req s ILE 566 CO -0.04 -0.44 0.02 -0.94 0.24 0.00 0.00 174.94 173.78 1req s SER 567 N -3.28 0.30 -1.21 4.36 1.04 -1.26 -4.64 113.70 109.01 1req s SER 567 Ca 0.62 -0.67 -0.05 0.00 0.48 0.00 0.00 55.95 56.34 1req s SER 567 Cb -0.18 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.12 1req s SER 567 CO 0.57 -0.47 1.04 0.61 0.98 0.00 0.00 173.24 175.96 1req n GLY 568 N 0.83 -0.39 0.76 7.32 0.00 -1.26 -4.94 105.19 107.51 1req n GLY 568 Ca -0.19 0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 1req n GLY 568 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1req n VAL 569 N -4.44 0.57 0.30 1.61 0.31 -1.26 -4.57 118.33 110.85 1req n VAL 569 Ca -0.12 -0.04 -0.17 0.00 -0.01 0.00 0.00 64.34 64.01 1req n VAL 569 Cb 0.60 -1.64 -0.08 0.00 -0.91 0.00 0.00 33.84 31.81 1req n VAL 569 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1req h TYR 570 N -0.28 -0.91 -0.68 3.52 3.20 -1.90 -2.31 116.97 117.61 1req h TYR 570 Ca -0.17 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.70 1req h TYR 570 Cb 1.03 0.33 -0.03 0.00 1.54 0.00 0.00 36.73 39.59 1req h TYR 570 CO -0.04 -0.52 0.45 0.66 -1.64 0.00 0.00 178.16 177.07 1req h SER 571 N -0.83 0.77 -0.31 -2.11 4.64 -1.90 -3.08 113.55 110.74 1req h SER 571 Ca -0.06 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1req h SER 571 Cb 0.69 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1req h SER 571 CO 0.05 0.56 0.17 0.11 -0.87 0.00 0.00 176.83 176.84 1req h LYS 572 N 0.91 0.43 -0.12 4.77 6.56 -1.79 -3.32 116.57 124.01 1req h LYS 572 Ca 0.25 -0.05 0.01 0.00 -1.06 0.00 0.00 60.65 59.80 1req h LYS 572 Cb -0.10 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 31.45 1req h LYS 572 CO -0.06 0.37 -0.12 1.49 -2.06 0.00 0.00 179.45 179.08 1req h GLU 573 N 0.38 -0.06 -4.30 3.15 4.57 -1.31 -3.18 114.58 113.82 1req h GLU 573 Ca 0.11 0.00 -0.69 0.00 -1.18 0.00 0.00 59.36 57.60 1req h GLU 573 Cb 0.07 0.01 -0.36 0.00 -0.16 0.00 0.00 28.75 28.31 1req h GLU 573 CO -0.02 -0.04 -0.55 0.08 -1.18 0.00 0.00 179.01 177.31 1req s VAL 574 N -3.54 3.18 0.86 0.32 1.01 -1.25 -5.00 120.40 115.98 1req s VAL 574 Ca -0.03 -2.32 -0.12 0.00 0.00 0.00 0.00 61.98 59.51 1req s VAL 574 Cb 0.02 -3.18 0.11 0.00 0.00 0.00 0.00 36.38 33.32 1req s VAL 574 CO 0.13 -0.72 1.12 -1.59 0.00 0.00 0.00 175.10 174.04 1req s LYS 575 N 0.83 1.57 -1.57 2.72 0.00 -1.20 -4.49 119.74 117.60 1req s LYS 575 Ca 0.11 0.42 -0.11 0.00 0.00 0.00 0.00 55.97 56.38 1req s LYS 575 Cb -0.22 -1.88 0.09 0.00 0.00 0.00 0.00 37.83 35.82 1req s LYS 575 CO -0.04 -1.93 0.71 0.27 0.00 0.00 0.00 175.35 174.36 1req n ASN 576 N -3.60 -2.64 -4.82 0.03 6.94 -1.26 -5.00 115.26 104.90 1req n ASN 576 Ca 0.07 -0.96 -0.36 0.00 -0.02 0.00 0.00 54.58 53.31 1req n ASN 576 Cb 0.58 -3.11 -0.06 0.00 -2.36 0.00 0.00 39.78 34.83 1req n ASN 576 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1req s THR 577 N -3.51 4.67 0.25 5.53 2.01 -1.26 -4.99 115.64 118.34 1req s THR 577 Ca 0.48 1.15 0.05 0.00 0.31 0.00 0.00 61.69 63.69 1req s THR 577 Cb -0.26 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 1req s THR 577 CO 0.89 0.29 1.58 1.55 -0.69 0.00 0.00 174.62 178.24 1req h PRO 578 N 3.69 0.22 -0.34 4.92 0.13 -1.98 -0.31 132.00 138.33 1req h PRO 578 Ca -0.48 -0.15 -0.12 0.00 -0.87 0.00 0.00 66.00 64.38 1req h PRO 578 Cb 1.20 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1req h PRO 578 CO 0.65 0.74 -0.26 0.93 -0.23 0.00 0.00 178.00 179.84 1req h GLU 579 N 0.17 0.78 -0.20 0.86 3.07 -1.98 -0.66 114.58 116.61 1req h GLU 579 Ca -0.00 -0.38 -0.01 0.00 -0.50 0.00 0.00 59.36 58.47 1req h GLU 579 Cb 1.07 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.97 1req h GLU 579 CO 0.09 1.00 0.11 0.28 -1.40 0.00 0.00 179.01 179.09 1req h VAL 580 N 0.56 1.12 -0.32 3.13 2.07 -1.85 -1.20 116.25 119.75 1req h VAL 580 Ca 0.07 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 1req h VAL 580 Cb 0.82 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1req h VAL 580 CO 0.07 0.11 0.20 -0.08 0.02 0.00 0.00 177.57 177.89 1req h GLU 581 N 0.22 0.44 -0.59 1.57 4.22 -0.85 -0.26 114.58 119.32 1req h GLU 581 Ca 0.07 -0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.49 1req h GLU 581 Cb 0.08 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1req h GLU 581 CO -0.01 0.33 0.38 1.49 -2.18 0.00 0.00 179.01 179.02 1req h GLU 582 N 0.42 0.75 0.03 1.92 4.81 -1.04 -1.23 114.58 120.24 1req h GLU 582 Ca 0.12 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1req h GLU 582 Cb 0.00 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1req h GLU 582 CO -0.02 0.50 -0.05 0.00 -0.73 0.00 0.00 179.01 178.71 1req h ALA 583 N 1.23 -0.07 0.33 2.92 0.00 -1.08 -0.86 119.26 121.73 1req h ALA 583 Ca 0.22 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1req h ALA 583 Cb -0.06 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1req h ALA 583 CO -0.06 -0.55 -0.22 0.00 0.00 0.00 0.00 179.25 178.41 1req h ARG 584 N -0.10 -0.52 -0.50 0.00 3.08 -0.61 -2.19 114.38 113.54 1req h ARG 584 Ca 0.01 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.19 1req h ARG 584 Cb 0.11 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 30.17 1req h ARG 584 CO -0.03 -0.35 -0.35 0.93 -1.07 0.00 0.00 179.97 179.10 1req h GLU 585 N -0.54 -0.21 -0.70 0.04 5.08 -1.12 -0.99 114.58 116.14 1req h GLU 585 Ca -0.03 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.47 1req h GLU 585 Cb 0.46 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1req h GLU 585 CO 0.02 -0.14 0.47 -0.07 -1.00 0.00 0.00 179.01 178.29 1req h LEU 586 N -0.22 0.38 -0.00 1.33 3.38 -0.99 -0.62 115.31 118.57 1req h LEU 586 Ca 0.20 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1req h LEU 586 Cb 0.55 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1req h LEU 586 CO -0.61 0.21 0.00 0.58 0.09 0.00 0.00 178.44 178.71 1req h VAL 587 N 0.41 1.22 -0.24 1.22 2.07 -0.58 -0.44 116.25 119.91 1req h VAL 587 Ca 0.33 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 67.27 1req h VAL 587 Cb 0.73 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1req h VAL 587 CO -0.10 0.17 -0.12 -0.33 0.02 0.00 0.00 177.57 177.21 1req h GLU 588 N -0.27 -0.09 -0.37 1.57 5.08 -0.27 -2.10 114.58 118.14 1req h GLU 588 Ca 0.00 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1req h GLU 588 Cb 0.27 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1req h GLU 588 CO 0.00 -0.06 0.12 0.93 -1.00 0.00 0.00 179.01 179.00 1req h GLU 589 N -0.09 0.26 -0.37 2.33 5.08 -1.16 -2.48 114.58 118.15 1req h GLU 589 Ca 0.13 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1req h GLU 589 Cb 0.28 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 1req h GLU 589 CO -0.29 0.17 -0.20 0.35 -1.00 0.00 0.00 179.01 178.04 1req h PHE 590 N 0.27 -0.51 -0.95 4.33 3.04 -0.83 -1.96 116.94 120.34 1req h PHE 590 Ca 0.17 0.04 0.11 0.00 3.98 0.00 0.00 57.97 62.27 1req h PHE 590 Cb 0.16 0.28 -0.08 0.00 2.56 0.00 0.00 35.95 38.86 1req h PHE 590 CO -0.15 -0.28 0.58 1.49 -2.02 0.00 0.00 178.31 177.93 1req h GLU 591 N -0.14 0.92 -0.72 1.11 4.81 -0.91 -1.65 114.58 117.99 1req h GLU 591 Ca 0.18 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1req h GLU 591 Cb 0.42 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1req h GLU 591 CO -0.46 0.61 0.19 1.96 -0.73 0.00 0.00 179.01 180.58 1req h GLN 592 N 0.94 1.15 -0.33 1.92 4.20 -1.42 0.45 115.11 122.02 1req h GLN 592 Ca 0.46 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.79 1req h GLN 592 Cb 0.43 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1req h GLN 592 CO -0.26 1.00 -0.25 0.00 -0.67 0.00 0.00 178.83 178.65 1req h ALA 593 N 1.11 0.47 -0.00 3.87 0.00 -1.10 -3.39 119.26 120.22 1req h ALA 593 Ca 0.23 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1req h ALA 593 Cb 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1req h ALA 593 CO -0.00 0.46 -0.26 0.39 0.00 0.00 0.00 179.25 179.84 1req n GLU 594 N -4.26 4.30 -0.20 0.00 -0.58 -0.65 -5.06 120.64 114.20 1req n GLU 594 Ca -0.03 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1req n GLU 594 Cb 0.45 -0.84 0.00 0.00 -0.57 0.00 0.00 31.44 30.48 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 1.05 0.99 3.56 0.62 0.00 0.16 -4.99 105.19 106.58 1req n GLY 595 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.58 1.43 0.72 1.61 1.70 -1.20 -4.99 118.95 117.64 1req s ARG 596 Ca 0.00 -0.90 -0.14 0.00 -0.47 0.00 0.00 55.73 54.22 1req s ARG 596 Cb 0.00 0.53 0.03 0.00 -0.57 0.00 0.00 34.95 34.94 1req s ARG 596 CO 0.00 -0.61 1.14 1.03 -1.08 0.00 0.00 175.30 175.78 1req s ARG 597 N -3.89 2.35 0.23 3.89 0.52 -1.26 -3.72 118.95 117.07 1req s ARG 597 Ca 0.10 1.47 -0.31 0.00 -0.52 0.00 0.00 55.73 56.47 1req s ARG 597 Cb -0.01 -1.89 -0.11 0.00 0.52 0.00 0.00 34.95 33.45 1req s ARG 597 CO -0.01 -1.62 1.66 -1.25 0.02 0.00 0.00 175.30 174.10 1req s PRO 598 N -4.23 4.14 -0.07 3.54 0.04 -1.26 -4.75 135.00 132.41 1req s PRO 598 Ca 0.68 2.56 0.06 0.00 0.04 0.00 0.00 61.00 64.34 1req s PRO 598 Cb -0.23 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.24 1req s PRO 598 CO 0.47 -0.69 -0.24 0.50 0.04 0.00 0.00 177.00 177.07 1req s ARG 599 N 0.62 2.65 0.04 4.56 6.06 -1.26 -1.46 118.95 130.16 1req s ARG 599 Ca 0.70 -0.89 0.05 0.00 -2.50 0.00 0.00 55.73 53.09 1req s ARG 599 Cb -0.48 -2.20 -0.02 0.00 0.06 0.00 0.00 34.95 32.31 1req s ARG 599 CO 0.37 0.35 -0.14 -1.50 -2.50 0.00 0.00 175.30 171.88 1req s ILE 600 N -0.08 1.07 -0.23 4.11 2.07 -0.69 -1.48 121.20 125.96 1req s ILE 600 Ca -0.06 -1.02 -0.04 0.00 -1.41 0.00 0.00 60.65 58.12 1req s ILE 600 Cb -0.14 -0.99 -0.00 0.00 0.13 0.00 0.00 42.46 41.46 1req s ILE 600 CO 0.05 -0.04 -0.03 -0.22 -1.91 0.00 0.00 174.94 172.79 1req s LEU 601 N -1.21 3.04 -0.37 8.50 2.96 -0.71 -1.35 118.68 129.54 1req s LEU 601 Ca 0.01 -0.47 -0.20 0.00 -0.22 0.00 0.00 54.13 53.25 1req s LEU 601 Cb -0.08 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.86 1req s LEU 601 CO 0.01 -0.05 0.60 -0.76 -1.32 0.00 0.00 176.35 174.84 1req s LEU 602 N 1.47 4.32 0.04 -0.68 1.43 -0.64 -0.52 118.68 124.10 1req s LEU 602 Ca 0.05 0.02 0.05 0.00 -1.03 0.00 0.00 54.13 53.21 1req s LEU 602 Cb -0.15 -2.72 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 1req s LEU 602 CO -0.03 -0.59 -0.09 0.00 0.23 0.00 0.00 176.35 175.87 1req s ALA 603 N 2.64 2.96 -0.29 4.21 0.00 -0.38 -0.88 121.76 130.01 1req s ALA 603 Ca 0.22 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1req s ALA 603 Cb -0.15 -1.02 0.07 0.00 0.00 0.00 0.00 23.12 22.03 1req s ALA 603 CO 0.15 0.62 -0.04 0.15 0.00 0.00 0.00 175.76 176.65 1req s LYS 604 N -1.67 2.04 0.19 0.00 -0.14 -1.26 -0.49 119.74 118.41 1req s LYS 604 Ca 0.18 -1.51 0.08 0.00 -1.36 0.00 0.00 55.97 53.37 1req s LYS 604 Cb -0.11 -3.05 -0.04 0.00 -1.68 0.00 0.00 37.83 32.95 1req s LYS 604 CO 0.09 -0.70 -0.05 -1.64 -0.76 0.00 0.00 175.35 172.29 1req s MET 605 N 1.07 2.21 1.47 1.68 -1.94 -1.26 -2.37 119.30 120.15 1req s MET 605 Ca -0.02 -1.23 0.00 0.00 -1.71 0.00 0.00 55.69 52.73 1req s MET 605 Cb -0.20 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.41 1req s MET 605 CO -0.05 0.43 0.00 0.41 -0.01 0.00 0.00 175.02 175.80 1req n GLY 606 N -0.13 -1.24 0.35 -0.03 0.00 -1.04 -4.12 105.19 98.99 1req n GLY 606 Ca -0.10 -1.51 0.13 0.00 0.00 0.00 0.00 46.02 44.55 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 1.17 -1.50 1.61 1.13 -1.26 -3.73 117.38 114.80 1req n GLN 607 Ca 0.00 -0.71 -0.62 0.00 -1.94 0.00 0.00 57.00 53.73 1req n GLN 607 Cb 0.00 -1.49 -0.10 0.00 0.11 0.00 0.00 30.24 28.76 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 -0.29 1.23 -0.95 1.08 2.03 -1.26 -4.85 116.55 113.54 1req n ASP 608 Ca 0.14 0.89 0.10 0.00 0.52 0.00 0.00 54.79 56.44 1req n ASP 608 Cb 0.36 -0.95 0.18 0.00 -0.72 0.00 0.00 41.12 39.99 1req n ASP 608 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1req n GLY 609 N 5.77 1.58 3.68 0.27 0.00 -1.26 -4.62 105.19 110.61 1req n GLY 609 Ca 0.42 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.31 2.76 0.00 1.61 3.76 -1.26 -4.68 115.29 116.17 1req s HIS 610 Ca 0.32 0.82 0.00 0.00 -0.15 0.00 0.00 55.06 56.05 1req s HIS 610 Cb 0.19 -3.63 0.00 0.00 1.11 0.00 0.00 32.58 30.25 1req s HIS 610 CO 0.26 -2.33 0.33 -0.40 -0.85 0.00 0.00 174.74 171.75 1req n ASP 611 N 5.91 0.60 0.00 1.40 5.68 -1.26 -4.78 116.55 124.10 1req n ASP 611 Ca 0.14 -1.07 -0.10 0.00 -0.50 0.00 0.00 54.79 53.26 1req n ASP 611 Cb 0.44 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.39 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 -0.25 -0.55 0.11 2.43 -1.92 -1.10 114.38 113.11 1req h ARG 612 Ca 0.00 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1req h ARG 612 Cb 0.31 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1req h ARG 612 CO 0.00 -0.17 0.33 0.78 -1.51 0.00 0.00 179.97 179.40 1req h GLY 613 N -0.26 0.77 0.99 2.80 0.00 -1.98 -0.76 103.07 104.64 1req h GLY 613 Ca 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1req h GLY 613 CO -0.27 0.20 -0.07 -1.61 0.00 0.00 0.00 176.54 174.79 1req h GLN 614 N 0.65 -0.19 -0.53 4.80 4.15 -1.83 -0.53 115.11 121.63 1req h GLN 614 Ca 0.22 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.63 1req h GLN 614 Cb 0.03 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 1req h GLN 614 CO -0.10 -0.12 0.25 0.87 -1.93 0.00 0.00 178.83 177.81 1req h LYS 615 N -0.20 0.76 -0.53 1.69 1.79 -1.13 -0.66 116.57 118.29 1req h LYS 615 Ca -0.02 -0.11 -0.07 0.00 -2.18 0.00 0.00 60.65 58.26 1req h LYS 615 Cb 0.16 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 1req h LYS 615 CO 0.03 0.63 0.04 -0.24 -1.08 0.00 0.00 179.45 178.83 1req h VAL 616 N 0.71 1.26 -0.34 0.50 3.04 -1.04 -1.98 116.25 118.39 1req h VAL 616 Ca 0.18 -1.03 -0.00 0.00 -1.01 0.00 0.00 66.70 64.84 1req h VAL 616 Cb 0.12 0.90 -0.02 0.00 -2.01 0.00 0.00 31.29 30.28 1req h VAL 616 CO -0.02 0.37 0.21 0.40 -1.01 0.00 0.00 177.57 177.51 1req h ILE 617 N 0.78 1.11 0.17 3.17 1.08 -1.03 -2.14 117.51 120.65 1req h ILE 617 Ca 0.15 -0.26 0.01 0.00 -0.39 0.00 0.00 64.86 64.38 1req h ILE 617 Cb 0.47 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 34.85 1req h ILE 617 CO 0.02 0.11 -0.33 0.00 -0.69 0.00 0.00 178.15 177.26 1req h ALA 618 N 1.09 -0.61 -0.47 1.87 0.00 -0.85 0.30 119.26 120.60 1req h ALA 618 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 618 Cb -0.00 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1req h ALA 618 CO -0.02 -0.89 0.22 0.00 0.00 0.00 0.00 179.25 178.55 1req h THR 619 N -0.59 1.19 -0.40 0.00 1.03 -1.40 0.61 112.91 113.36 1req h THR 619 Ca 0.02 -0.57 -0.09 0.00 -0.01 0.00 0.00 66.41 65.76 1req h THR 619 Cb 0.60 0.69 -0.01 0.00 -1.07 0.00 0.00 68.15 68.36 1req h THR 619 CO -0.17 0.22 -0.11 0.00 -0.01 0.00 0.00 175.52 175.45 1req h ALA 620 N 1.06 0.55 -0.53 0.00 0.00 -1.27 -0.02 119.26 119.05 1req h ALA 620 Ca 0.16 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 1req h ALA 620 Cb 0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1req h ALA 620 CO -0.02 0.43 -0.08 1.88 0.00 0.00 0.00 179.25 181.46 1req h TYR 621 N 0.59 1.07 -0.28 0.00 -1.99 -0.89 -1.01 116.97 114.45 1req h TYR 621 Ca 0.10 -0.20 -0.01 0.00 2.00 0.00 0.00 58.73 60.62 1req h TYR 621 Cb 0.64 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 39.09 1req h TYR 621 CO 0.05 0.99 0.15 0.00 -0.00 0.00 0.00 178.16 179.35 1req h ALA 622 N 1.03 0.36 -0.36 3.88 0.00 -0.67 -1.93 119.26 121.57 1req h ALA 622 Ca 0.14 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.09 1req h ALA 622 Cb 0.62 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1req h ALA 622 CO 0.04 -0.12 0.36 -0.44 0.00 0.00 0.00 179.25 179.10 1req h ASP 623 N 0.33 0.00 0.29 0.00 5.19 -0.32 -1.75 116.42 120.16 1req h ASP 623 Ca 0.10 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1req h ASP 623 Cb 0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1req h ASP 623 CO -0.02 0.00 -0.32 0.18 -3.12 0.00 0.00 179.24 175.97 1req n LEU 624 N -3.83 0.92 0.00 1.55 4.77 -0.45 -4.97 117.00 114.99 1req n LEU 624 Ca 0.06 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1req n LEU 624 Cb 0.53 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1req n LEU 624 CO 0.29 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1req n GLY 625 N 1.38 0.92 3.74 -0.72 0.00 -0.66 -4.37 105.19 105.49 1req n GLY 625 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 2.29 -0.14 1.61 0.40 -0.77 -4.73 117.98 114.64 1req s PHE 626 Ca 0.00 1.57 -0.20 0.00 -0.60 0.00 0.00 56.93 57.70 1req s PHE 626 Cb 0.00 -3.37 -0.03 0.00 0.51 0.00 0.00 43.02 40.12 1req s PHE 626 CO 0.00 -2.24 0.57 -0.51 0.70 0.00 0.00 175.22 173.75 1req s ASP 627 N -2.14 6.73 -0.11 1.36 1.01 -0.54 -4.42 116.67 118.56 1req s ASP 627 Ca 0.72 0.87 0.03 0.00 0.71 0.00 0.00 52.55 54.89 1req s ASP 627 Cb -0.26 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.34 1req s ASP 627 CO 0.42 -0.13 -0.23 -0.69 0.21 0.00 0.00 175.17 174.75 1req s VAL 628 N 1.18 2.02 -0.12 -1.27 1.01 -1.26 -1.71 120.40 120.24 1req s VAL 628 Ca 0.29 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 1req s VAL 628 Cb -0.16 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1req s VAL 628 CO 0.12 0.55 -0.05 -1.81 0.00 0.00 0.00 175.10 173.90 1req s ASP 629 N 0.52 4.72 -0.35 3.32 1.01 -0.46 -4.99 116.67 120.44 1req s ASP 629 Ca -0.15 -0.09 -0.13 0.00 0.71 0.00 0.00 52.55 52.89 1req s ASP 629 Cb -0.17 -1.57 -0.01 0.00 1.01 0.00 0.00 42.92 42.18 1req s ASP 629 CO 0.05 0.24 0.27 -0.69 0.21 0.00 0.00 175.17 175.25 1req s VAL 630 N -0.08 5.26 0.69 -1.27 1.01 -1.26 -1.63 120.40 123.13 1req s VAL 630 Ca 0.01 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 1req s VAL 630 Cb -0.13 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.50 1req s VAL 630 CO 0.03 -0.06 1.08 -0.83 0.00 0.00 0.00 175.10 175.31 1req s GLY 631 N 1.72 1.86 0.53 4.51 0.00 -0.06 -4.96 107.32 110.92 1req s GLY 631 Ca 0.07 0.29 -0.17 0.00 0.00 0.00 0.00 44.72 44.91 1req s GLY 631 CO 0.11 0.62 1.01 2.56 0.00 0.00 0.00 173.10 177.40 1req s PRO 632 N -4.62 3.73 1.05 2.90 0.04 -1.26 -4.71 135.00 132.13 1req s PRO 632 Ca 0.62 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 1req s PRO 632 Cb -0.16 -2.10 0.22 0.00 0.04 0.00 0.00 34.50 32.50 1req s PRO 632 CO 0.49 -0.46 1.07 -0.51 0.04 0.00 0.00 177.00 177.62 1req s LEU 633 N -4.10 1.48 -1.53 -3.56 1.43 -1.26 -4.13 118.68 107.01 1req s LEU 633 Ca 0.62 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 55.21 1req s LEU 633 Cb -0.13 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.48 1req s LEU 633 CO 0.31 -3.55 0.00 0.49 0.23 0.00 0.00 176.35 173.83 1req n PHE 634 N -4.48 -0.57 -2.64 0.29 3.72 -1.23 -5.01 117.46 107.55 1req n PHE 634 Ca 0.05 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.13 1req n PHE 634 Cb 0.55 -3.24 -0.05 0.00 -0.94 0.00 0.00 39.48 35.80 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 -4.42 4.08 0.93 -1.08 -0.21 -1.00 -4.60 119.66 113.36 1req s GLN 635 Ca 0.00 1.01 -0.15 0.00 0.02 0.00 0.00 55.36 56.24 1req s GLN 635 Cb 0.00 -2.17 0.18 0.00 1.00 0.00 0.00 33.01 32.01 1req s GLN 635 CO 0.00 -0.14 1.30 0.95 -2.12 0.00 0.00 175.29 175.28 1req s THR 636 N -2.39 2.00 0.32 -0.19 -4.23 -1.26 -2.50 115.64 107.39 1req s THR 636 Ca 0.60 0.00 0.32 0.00 -1.18 0.00 0.00 61.69 61.43 1req s THR 636 Cb -0.09 -3.00 0.34 0.00 1.34 0.00 0.00 72.50 71.09 1req s THR 636 CO 0.22 0.00 2.06 -0.65 -0.54 0.00 0.00 174.62 175.71 1req h PRO 637 N -1.53 0.00 0.13 3.99 0.11 -1.92 -2.20 132.00 130.58 1req h PRO 637 Ca -0.45 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.36 1req h PRO 637 Cb 1.25 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.39 1req h PRO 637 CO 0.43 0.08 -1.26 1.49 -0.21 0.00 0.00 178.00 178.53 1req h GLU 638 N 0.00 0.58 -0.36 1.05 4.81 -1.93 -2.35 114.58 116.39 1req h GLU 638 Ca -0.00 -0.80 -0.10 0.00 -0.13 0.00 0.00 59.36 58.33 1req h GLU 638 Cb 0.40 0.27 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1req h GLU 638 CO 0.01 1.36 -0.16 0.93 -0.73 0.00 0.00 179.01 180.42 1req h GLU 639 N 0.25 0.74 0.03 1.92 5.08 -1.85 -2.32 114.58 118.42 1req h GLU 639 Ca -0.19 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1req h GLU 639 Cb 1.93 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.16 1req h GLU 639 CO 0.24 0.93 -0.01 1.15 -1.00 0.00 0.00 179.01 180.31 1req h THR 640 N 0.53 1.15 -0.35 1.13 2.02 -1.50 -0.01 112.91 115.87 1req h THR 640 Ca 0.08 -0.55 0.07 0.00 0.77 0.00 0.00 66.41 66.78 1req h THR 640 Cb 0.70 1.51 -0.09 0.00 -1.74 0.00 0.00 68.15 68.54 1req h THR 640 CO 0.05 0.14 -0.37 0.00 0.37 0.00 0.00 175.52 175.72 1req h ALA 641 N 0.68 -0.32 -1.00 6.16 0.00 -1.41 0.16 119.26 123.53 1req h ALA 641 Ca -0.00 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1req h ALA 641 Cb 0.26 0.76 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1req h ALA 641 CO 0.01 -0.80 0.65 -0.09 0.00 0.00 0.00 179.25 179.02 1req h ARG 642 N -0.32 1.32 -0.41 0.00 2.43 -1.33 -1.00 114.38 115.07 1req h ARG 642 Ca 0.14 -0.09 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1req h ARG 642 Cb 0.56 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1req h ARG 642 CO -0.52 0.88 -0.23 0.37 -1.51 0.00 0.00 179.97 178.97 1req h GLN 643 N 1.35 0.83 -0.48 0.20 4.15 -0.79 -0.35 115.11 120.03 1req h GLN 643 Ca 0.36 -0.34 -0.05 0.00 0.77 0.00 0.00 58.65 59.38 1req h GLN 643 Cb -0.14 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.50 1req h GLN 643 CO -0.08 0.98 0.09 0.00 -1.93 0.00 0.00 178.83 177.89 1req h ALA 644 N 1.02 0.63 -0.08 3.38 0.00 0.05 -2.81 119.26 121.45 1req h ALA 644 Ca 0.10 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1req h ALA 644 Cb 0.76 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1req h ALA 644 CO 0.06 0.35 -0.27 0.28 0.00 0.00 0.00 179.25 179.68 1req h VAL 645 N 0.66 1.42 0.00 0.00 2.07 -1.10 -0.86 116.25 118.44 1req h VAL 645 Ca 0.15 -1.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.02 1req h VAL 645 Cb 0.38 2.26 -0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1req h VAL 645 CO 0.01 0.47 -0.03 -0.33 0.02 0.00 0.00 177.57 177.71 1req h GLU 646 N -0.16 0.00 -0.00 1.57 5.08 -1.12 0.98 114.58 120.93 1req h GLU 646 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1req h GLU 646 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1req h GLU 646 CO 0.06 0.03 -0.78 0.00 -1.00 0.00 0.00 179.01 177.32 1req n ALA 647 N -2.25 4.25 -3.48 3.43 0.00 -1.06 -5.04 120.51 116.35 1req n ALA 647 Ca -0.03 -0.53 -0.17 0.00 0.00 0.00 0.00 53.44 52.71 1req n ALA 647 Cb 0.13 -0.88 0.01 0.00 0.00 0.00 0.00 19.45 18.71 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 -1.31 -6.10 -4.91 0.00 2.03 0.34 -5.00 116.55 101.59 1req n ASP 648 Ca 0.05 -0.65 -0.27 0.00 0.52 0.00 0.00 54.79 54.45 1req n ASP 648 Cb 0.35 -3.51 0.02 0.00 -0.72 0.00 0.00 41.12 37.26 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 -3.12 3.95 0.05 5.18 -7.23 -0.84 -4.92 120.40 113.47 1req s VAL 649 Ca 0.13 0.12 -0.00 0.00 -1.81 0.00 0.00 61.98 60.42 1req s VAL 649 Cb -0.04 -3.56 -0.26 0.00 0.56 0.00 0.00 36.38 33.07 1req s VAL 649 CO 0.83 -0.59 1.01 0.45 -0.31 0.00 0.00 175.10 176.50 1req h HIS 650 N -0.14 0.35 -3.40 2.82 -0.00 -1.63 -3.45 115.15 109.70 1req h HIS 650 Ca -0.46 -0.25 -0.16 0.00 -0.00 0.00 0.00 60.37 59.50 1req h HIS 650 Cb 1.24 -0.01 -0.23 0.00 -0.00 0.00 0.00 27.41 28.41 1req h HIS 650 CO 0.51 1.25 -0.49 0.54 -0.00 0.00 0.00 177.93 179.73 1req s VAL 651 N -2.65 0.04 -0.33 2.45 0.11 -1.09 -0.59 120.40 118.35 1req s VAL 651 Ca -0.05 -0.37 -0.10 0.00 -2.93 0.00 0.00 61.98 58.53 1req s VAL 651 Cb 0.08 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.58 1req s VAL 651 CO 0.85 -0.20 0.17 -0.69 -3.33 0.00 0.00 175.10 171.90 1req s VAL 652 N -0.71 4.55 -0.55 2.04 1.01 -0.05 -1.75 120.40 124.94 1req s VAL 652 Ca -0.08 -0.59 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 1req s VAL 652 Cb -0.05 -3.40 0.09 0.00 0.00 0.00 0.00 36.38 33.03 1req s VAL 652 CO 0.01 -0.04 0.61 -0.83 0.00 0.00 0.00 175.10 174.85 1req s GLY 653 N 1.58 1.87 -0.01 4.51 0.00 0.33 -0.65 107.32 114.95 1req s GLY 653 Ca 0.04 -2.17 -0.30 0.00 0.00 0.00 0.00 44.72 42.29 1req s GLY 653 CO 0.06 1.42 1.04 0.14 0.00 0.00 0.00 173.10 175.76 1req s VAL 654 N 2.34 4.65 -0.36 1.40 1.01 0.43 -1.25 120.40 128.62 1req s VAL 654 Ca 0.10 1.91 -0.07 0.00 0.00 0.00 0.00 61.98 63.92 1req s VAL 654 Cb -0.24 -4.22 0.05 0.00 0.00 0.00 0.00 36.38 31.97 1req s VAL 654 CO 0.07 0.11 0.14 -0.55 0.00 0.00 0.00 175.10 174.87 1req s SER 655 N 1.07 5.37 -0.22 3.32 0.15 0.36 -0.13 113.70 123.62 1req s SER 655 Ca 0.53 -1.27 0.01 0.00 0.70 0.00 0.00 55.95 55.92 1req s SER 655 Cb -0.22 -1.89 0.05 0.00 -1.71 0.00 0.00 66.02 62.25 1req s SER 655 CO 0.26 -0.38 -0.10 -0.55 1.20 0.00 0.00 173.24 173.67 1req s SER 656 N 1.57 3.79 0.00 5.45 0.15 0.14 -4.65 113.70 120.15 1req s SER 656 Ca -0.00 -1.09 0.00 0.00 0.70 0.00 0.00 55.95 55.56 1req s SER 656 Cb -0.20 -1.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.79 1req s SER 656 CO 0.02 -0.17 0.60 0.18 1.20 0.00 0.00 173.24 175.07 1req n LEU 657 N 4.61 1.19 -1.22 3.45 4.32 -1.26 -1.77 117.00 126.31 1req n LEU 657 Ca -0.14 -1.19 0.11 0.00 -0.02 0.00 0.00 56.01 54.77 1req n LEU 657 Cb 0.45 0.00 0.28 0.00 -1.62 0.00 0.00 43.42 42.53 1req n LEU 657 CO 0.20 0.30 0.74 0.00 -1.22 0.00 0.00 177.39 177.41 1req n ALA 658 N -0.12 2.35 -1.03 -1.18 0.00 -1.26 -4.76 120.51 114.52 1req n ALA 658 Ca 0.00 -1.24 -0.01 0.00 0.00 0.00 0.00 53.44 52.19 1req n ALA 658 Cb 0.07 -0.84 -0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 1.45 0.48 1.09 0.00 0.00 -1.26 -4.67 105.19 102.28 1req n GLY 659 Ca 0.22 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.80 1.61 0.26 -0.02 0.00 -1.26 -4.52 105.19 98.45 1req n GLY 660 Ca -0.01 -0.69 -0.07 0.00 0.00 0.00 0.00 46.02 45.25 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 4.03 -0.55 -0.76 1.61 2.07 -1.93 -0.55 115.15 119.07 1req h HIS 661 Ca 0.00 0.04 0.16 0.00 -2.85 0.00 0.00 60.37 57.72 1req h HIS 661 Cb 0.89 0.29 -0.10 0.00 2.57 0.00 0.00 27.41 31.06 1req h HIS 661 CO 0.27 -0.29 0.25 -0.07 -3.07 0.00 0.00 177.93 175.03 1req h LEU 662 N -0.17 0.16 0.11 6.12 3.38 -1.96 0.64 115.31 123.59 1req h LEU 662 Ca 0.17 0.13 -0.15 0.00 0.09 0.00 0.00 57.88 58.12 1req h LEU 662 Cb 0.43 0.14 0.02 0.00 0.09 0.00 0.00 40.66 41.34 1req h LEU 662 CO -0.43 0.03 -0.65 0.71 0.09 0.00 0.00 178.44 178.19 1req h THR 663 N 0.36 1.56 -0.41 0.22 1.35 -1.68 -3.40 112.91 110.90 1req h THR 663 Ca 0.43 -2.47 0.04 0.00 -0.55 0.00 0.00 66.41 63.86 1req h THR 663 Cb 0.71 3.20 -0.04 0.00 -1.73 0.00 0.00 68.15 70.29 1req h THR 663 CO -0.46 0.69 0.18 -0.07 -0.25 0.00 0.00 175.52 175.60 1req h LEU 664 N -0.47 0.23 -0.31 3.87 3.38 -1.03 -3.07 115.31 117.90 1req h LEU 664 Ca -0.11 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1req h LEU 664 Cb 1.50 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 1req h LEU 664 CO 0.12 0.17 0.04 0.58 0.09 0.00 0.00 178.44 179.44 1req h VAL 665 N 0.36 1.24 -0.58 1.22 2.07 -1.08 -2.13 116.25 117.35 1req h VAL 665 Ca 0.19 -0.84 -0.10 0.00 0.82 0.00 0.00 66.70 66.77 1req h VAL 665 Cb 0.13 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1req h VAL 665 CO -0.16 0.27 -0.02 1.55 0.02 0.00 0.00 177.57 179.24 1req h PRO 666 N 0.34 1.03 -0.65 1.57 0.13 -1.73 -2.25 132.00 130.46 1req h PRO 666 Ca 0.09 -0.33 0.05 0.00 -0.87 0.00 0.00 66.00 64.95 1req h PRO 666 Cb 0.36 -0.09 -0.05 0.00 0.13 0.00 0.00 31.00 31.35 1req h PRO 666 CO 0.01 1.02 0.36 0.00 -0.23 0.00 0.00 178.00 179.16 1req h ALA 667 N 1.03 0.86 -0.33 -0.56 0.00 -1.50 -2.33 119.26 116.42 1req h ALA 667 Ca 0.17 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1req h ALA 667 Cb 0.57 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1req h ALA 667 CO 0.03 0.04 0.14 1.25 0.00 0.00 0.00 179.25 180.71 1req h LEU 668 N 0.67 0.46 -0.47 0.00 6.46 -1.15 -2.04 115.31 119.24 1req h LEU 668 Ca 0.29 -0.16 0.09 0.00 -0.12 0.00 0.00 57.88 57.97 1req h LEU 668 Cb 0.16 -0.12 -0.08 0.00 -0.73 0.00 0.00 40.66 39.89 1req h LEU 668 CO -0.17 0.50 -0.02 -0.09 -0.62 0.00 0.00 178.44 178.04 1req h ARG 669 N 0.39 0.09 0.00 1.25 9.65 -1.08 -1.72 114.38 122.97 1req h ARG 669 Ca 0.11 -0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 58.91 1req h ARG 669 Cb 0.18 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.73 1req h ARG 669 CO -0.01 0.06 -0.38 0.87 2.80 0.00 0.00 179.97 183.31 1req h LYS 670 N 0.09 0.00 -0.11 0.20 6.56 -1.43 -1.95 116.57 119.94 1req h LYS 670 Ca 0.23 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.65 1req h LYS 670 Cb 0.35 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.01 1req h LYS 670 CO -0.41 0.38 -0.65 0.93 -2.06 0.00 0.00 179.45 177.64 1req h GLU 671 N 0.00 0.43 0.01 3.15 4.39 -0.81 0.11 114.58 121.85 1req h GLU 671 Ca -0.00 -0.31 -0.00 0.00 0.34 0.00 0.00 59.36 59.39 1req h GLU 671 Cb 1.01 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1req h GLU 671 CO 0.05 0.93 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.76 1req h LEU 672 N 0.31 -0.01 -0.53 1.33 3.38 -1.19 -2.36 115.31 116.24 1req h LEU 672 Ca -0.01 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.77 1req h LEU 672 Cb 1.20 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 1req h LEU 672 CO 0.11 0.25 0.23 0.44 0.09 0.00 0.00 178.44 179.56 1req h ASP 673 N -0.26 0.28 -0.18 -0.43 5.19 -1.29 -0.20 116.42 119.53 1req h ASP 673 Ca -0.00 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1req h ASP 673 Cb 0.26 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.77 1req h ASP 673 CO 0.00 0.19 0.11 0.50 -3.12 0.00 0.00 179.24 176.92 1req h LYS 674 N 0.44 0.25 -0.05 3.56 3.64 -0.70 0.30 116.57 124.00 1req h LYS 674 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1req h LYS 674 Cb 0.23 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1req h LYS 674 CO -0.22 0.17 0.00 1.28 -2.27 0.00 0.00 179.45 178.42 1req n LEU 675 N -4.50 0.54 0.00 5.20 4.77 -0.90 -4.93 117.00 117.19 1req n LEU 675 Ca -0.00 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1req n LEU 675 Cb 0.08 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1req n LEU 675 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1req n GLY 676 N 0.91 0.64 2.50 -0.72 0.00 0.10 -5.05 105.19 103.58 1req n GLY 676 Ca 0.15 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.00 0.63 0.00 1.61 1.81 -0.11 -4.95 118.95 114.95 1req s ARG 677 Ca 0.00 -1.39 0.25 0.00 -1.72 0.00 0.00 55.73 52.87 1req s ARG 677 Cb 0.00 -1.43 0.45 0.00 -0.45 0.00 0.00 34.95 33.51 1req s ARG 677 CO 0.00 -1.20 1.40 -0.35 -0.68 0.00 0.00 175.30 174.48 1req n PRO 678 N 4.02 2.01 0.04 3.54 -0.04 -1.26 -3.33 135.00 139.98 1req n PRO 678 Ca 0.11 -1.54 -0.07 0.00 -0.04 0.00 0.00 63.50 61.97 1req n PRO 678 Cb 0.37 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.24 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 3.75 0.00 -2.88 3.54 2.03 -1.96 -3.45 116.42 117.46 1req h ASP 679 Ca 0.00 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.73 1req h ASP 679 Cb 0.82 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.29 1req h ASP 679 CO 0.00 0.95 1.14 -0.63 -1.03 0.00 0.00 179.24 179.66 1req s ILE 680 N -2.70 3.73 0.69 4.15 1.01 -1.21 -4.93 121.20 121.93 1req s ILE 680 Ca -0.01 0.79 -0.11 0.00 0.00 0.00 0.00 60.65 61.32 1req s ILE 680 Cb 0.09 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.74 1req s ILE 680 CO 0.82 -0.43 1.07 -0.76 0.00 0.00 0.00 174.94 175.64 1req s LEU 681 N 5.56 3.00 -0.14 2.97 1.43 0.24 -4.85 118.68 126.89 1req s LEU 681 Ca 0.70 1.32 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 1req s LEU 681 Cb -0.21 -4.18 -0.00 0.00 0.03 0.00 0.00 46.19 41.82 1req s LEU 681 CO 0.30 -1.29 -0.17 -0.63 0.23 0.00 0.00 176.35 174.80 1req s ILE 682 N -3.23 2.56 0.25 -0.59 1.01 -1.26 -0.88 121.20 119.06 1req s ILE 682 Ca 0.57 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 60.50 1req s ILE 682 Cb -0.12 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1req s ILE 682 CO 0.53 0.53 0.01 0.42 0.00 0.00 0.00 174.94 176.43 1req s THR 683 N 0.71 3.58 -0.05 2.92 -4.23 0.18 -0.79 115.64 117.97 1req s THR 683 Ca -0.08 -1.78 0.01 0.00 -1.18 0.00 0.00 61.69 58.66 1req s THR 683 Cb -0.16 -2.90 0.02 0.00 1.34 0.00 0.00 72.50 70.81 1req s THR 683 CO 0.01 -0.33 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.04 1req s VAL 684 N -2.20 0.48 0.34 2.29 1.01 -0.90 -0.43 120.40 120.99 1req s VAL 684 Ca 0.31 -0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.25 1req s VAL 684 Cb -0.07 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1req s VAL 684 CO 0.20 0.22 0.12 -0.83 0.00 0.00 0.00 175.10 174.82 1req s GLY 685 N 1.06 2.22 0.00 4.51 0.00 0.81 -1.34 107.32 114.58 1req s GLY 685 Ca -0.09 -1.66 0.00 0.00 0.00 0.00 0.00 44.72 42.98 1req s GLY 685 CO -0.01 -1.71 0.00 0.61 0.00 0.00 0.00 173.10 171.99 1req n GLY 686 N -0.70 0.29 3.45 0.20 0.00 -0.30 0.27 105.19 108.38 1req n GLY 686 Ca -0.02 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.48 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 4.36 -0.18 1.61 1.01 -0.73 -4.00 120.40 122.47 1req s VAL 687 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1req s VAL 687 Cb 0.00 -4.68 0.08 0.00 0.00 0.00 0.00 36.38 31.78 1req s VAL 687 CO 0.00 -1.44 0.19 -0.63 0.00 0.00 0.00 175.10 173.22 1req s ILE 688 N 3.97 -0.28 0.29 2.22 1.01 -1.26 -4.62 121.20 122.52 1req s ILE 688 Ca 0.22 -0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.54 1req s ILE 688 Cb -0.17 -0.60 -0.13 0.00 0.01 0.00 0.00 42.46 41.57 1req s ILE 688 CO 0.10 -0.15 1.22 -2.65 0.00 0.00 0.00 174.94 173.46 1req n PRO 689 N 5.31 1.80 0.26 2.79 -0.02 -1.26 -4.90 135.00 138.98 1req n PRO 689 Ca -0.06 0.63 0.12 0.00 -2.02 0.00 0.00 63.50 62.18 1req n PRO 689 Cb 0.49 -2.16 0.75 0.00 -0.02 0.00 0.00 33.50 32.56 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 2.82 0.00 -0.92 -0.52 4.81 -1.99 -2.53 114.58 116.26 1req h GLU 690 Ca -0.44 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 58.94 1req h GLU 690 Cb 1.30 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.59 1req h GLU 690 CO 0.65 0.00 0.52 1.96 -0.73 0.00 0.00 179.01 181.42 1req h GLN 691 N 0.00 0.72 -0.08 1.92 4.20 -1.99 -3.14 115.11 116.73 1req h GLN 691 Ca 0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1req h GLN 691 Cb 0.08 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.70 1req h GLN 691 CO -0.00 0.47 0.00 -0.25 -0.67 0.00 0.00 178.83 178.38 1req n ASP 692 N -4.79 0.28 0.13 1.46 9.92 -0.95 -4.25 116.55 118.34 1req n ASP 692 Ca 0.19 -2.00 -0.23 0.00 -0.53 0.00 0.00 54.79 52.22 1req n ASP 692 Cb 0.45 -0.05 -0.15 0.00 -0.64 0.00 0.00 41.12 40.72 1req n ASP 692 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 1req h PHE 693 N 0.26 0.86 -0.13 1.24 -1.00 -1.69 -2.88 116.94 113.60 1req h PHE 693 Ca 0.00 -0.63 -0.05 0.00 2.81 0.00 0.00 57.97 60.10 1req h PHE 693 Cb 0.08 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 39.60 1req h PHE 693 CO 0.03 1.54 -0.12 -0.44 -1.61 0.00 0.00 178.31 177.71 1req h ASP 694 N 0.13 0.33 0.30 2.17 5.19 -1.82 -1.43 116.42 121.28 1req h ASP 694 Ca -0.25 -0.48 0.00 0.00 -0.62 0.00 0.00 57.03 55.68 1req h ASP 694 Cb 2.13 -0.09 -0.03 0.00 0.18 0.00 0.00 39.33 41.52 1req h ASP 694 CO 0.25 0.74 -0.34 -0.08 -3.12 0.00 0.00 179.24 176.69 1req h GLU 695 N -0.08 -0.65 -0.81 3.56 4.81 -1.83 -2.52 114.58 117.06 1req h GLU 695 Ca 0.02 0.04 0.19 0.00 -0.13 0.00 0.00 59.36 59.49 1req h GLU 695 Cb 0.64 0.15 -0.13 0.00 0.63 0.00 0.00 28.75 30.04 1req h GLU 695 CO 0.03 -0.44 0.18 -0.07 -0.73 0.00 0.00 179.01 177.98 1req h LEU 696 N -0.68 -0.05 -1.00 1.64 3.38 -1.46 0.38 115.31 117.53 1req h LEU 696 Ca -0.01 0.18 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1req h LEU 696 Cb 0.63 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1req h LEU 696 CO -0.09 -0.11 0.19 0.03 0.09 0.00 0.00 178.44 178.55 1req h ARG 697 N 0.22 0.91 -0.21 1.13 3.08 -0.95 -1.68 114.38 116.87 1req h ARG 697 Ca 0.48 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 60.27 1req h ARG 697 Cb 0.89 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1req h ARG 697 CO -0.60 0.78 -0.23 0.87 -1.07 0.00 0.00 179.97 179.73 1req h LYS 698 N 0.88 0.39 0.00 0.04 6.56 -0.71 -3.12 116.57 120.61 1req h LYS 698 Ca 0.20 -0.13 0.00 0.00 -1.06 0.00 0.00 60.65 59.66 1req h LYS 698 Cb 0.26 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.89 1req h LYS 698 CO -0.01 0.60 0.00 -0.25 -2.06 0.00 0.00 179.45 177.73 1req n ASP 699 N -4.15 0.00 0.00 0.86 8.00 -0.03 -4.92 116.55 116.30 1req n ASP 699 Ca -0.00 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 55.03 1req n ASP 699 Cb 0.37 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1req n ASP 699 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1req n GLY 700 N 0.79 1.85 3.63 0.44 0.00 -1.05 -4.19 105.19 106.65 1req n GLY 700 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.92 3.18 0.09 4.61 0.00 -0.69 -4.18 121.76 122.86 1req s ALA 701 Ca 0.00 0.64 -0.06 0.00 0.00 0.00 0.00 51.96 52.54 1req s ALA 701 Cb 0.00 -3.91 -0.20 0.00 0.00 0.00 0.00 23.12 19.01 1req s ALA 701 CO 0.00 -2.11 1.20 -0.39 0.00 0.00 0.00 175.76 174.46 1req h VAL 702 N 6.32 1.42 -3.99 0.00 -1.51 -1.29 -3.38 116.25 113.81 1req h VAL 702 Ca -0.38 -2.71 -0.36 0.00 -1.23 0.00 0.00 66.70 62.03 1req h VAL 702 Cb 1.18 2.69 -0.26 0.00 -2.13 0.00 0.00 31.29 32.78 1req h VAL 702 CO 0.99 0.80 -0.77 -1.61 -1.23 0.00 0.00 177.57 175.75 1req s GLU 703 N -2.96 0.67 -0.16 5.19 0.41 -1.26 -5.08 118.70 115.52 1req s GLU 703 Ca -0.06 -0.51 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 1req s GLU 703 Cb 0.07 -0.61 0.02 0.00 -1.78 0.00 0.00 34.13 31.84 1req s GLU 703 CO 0.89 0.15 -0.14 0.42 -0.49 0.00 0.00 175.26 176.09 1req s ILE 704 N -0.63 1.61 -0.22 -1.63 1.01 -1.26 -2.12 121.20 117.96 1req s ILE 704 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 59.96 1req s ILE 704 Cb -0.06 -1.53 0.03 0.00 0.01 0.00 0.00 42.46 40.91 1req s ILE 704 CO 0.00 0.43 -0.12 -0.31 0.00 0.00 0.00 174.94 174.95 1req s TYR 705 N 1.47 2.99 0.48 3.97 2.02 -0.45 -5.02 117.35 122.81 1req s TYR 705 Ca 0.04 -1.71 0.06 0.00 -0.37 0.00 0.00 57.07 55.09 1req s TYR 705 Cb -0.13 -1.98 -0.01 0.00 -0.40 0.00 0.00 41.96 39.44 1req s TYR 705 CO -0.11 -0.78 0.27 0.95 -1.57 0.00 0.00 175.55 174.32 1req s THR 706 N 1.28 1.90 0.25 -0.71 -4.23 -1.26 -1.16 115.64 111.72 1req s THR 706 Ca 0.00 -1.62 -0.29 0.00 -1.18 0.00 0.00 61.69 58.61 1req s THR 706 Cb -0.16 -2.52 -0.15 0.00 1.34 0.00 0.00 72.50 71.02 1req s THR 706 CO -0.08 0.00 1.04 -2.65 -0.54 0.00 0.00 174.62 172.39 1req n PRO 707 N -1.50 1.27 0.00 3.99 -0.02 -1.26 -2.15 135.00 135.33 1req n PRO 707 Ca -0.03 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1req n PRO 707 Cb 0.64 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 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 1.48 0.08 3.70 -1.23 0.00 -1.26 -4.76 105.19 103.21 1req n GLY 708 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.93 0.36 -3.07 2.61 -1.04 -0.91 -4.94 114.28 105.36 1req n THR 709 Ca 0.00 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.51 1req n THR 709 Cb 0.00 -1.75 -0.06 0.00 -1.82 0.00 0.00 70.33 66.70 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 0.64 4.99 0.15 12.58 1.01 -1.26 -5.00 120.40 133.51 1req s VAL 710 Ca 0.73 1.26 -0.20 0.00 0.00 0.00 0.00 61.98 63.77 1req s VAL 710 Cb -0.58 -3.98 0.04 0.00 0.00 0.00 0.00 36.38 31.86 1req s VAL 710 CO 0.40 0.08 1.65 0.40 0.00 0.00 0.00 175.10 177.63 1req h ILE 711 N 5.22 0.52 -0.85 2.22 2.04 -1.93 -2.12 117.51 122.61 1req h ILE 711 Ca -0.30 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1req h ILE 711 Cb 1.14 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1req h ILE 711 CO 0.79 0.00 0.50 1.55 0.00 0.00 0.00 178.15 180.99 1req h PRO 712 N -0.14 1.16 -0.43 2.37 0.13 -1.94 -1.88 132.00 131.26 1req h PRO 712 Ca 0.15 -0.11 0.06 0.00 -0.87 0.00 0.00 66.00 65.22 1req h PRO 712 Cb 0.36 -0.24 -0.05 0.00 0.13 0.00 0.00 31.00 31.20 1req h PRO 712 CO -0.36 0.82 0.14 0.93 -0.23 0.00 0.00 178.00 179.31 1req h GLU 713 N 1.18 0.30 -0.66 0.86 5.08 -1.78 -2.05 114.58 117.50 1req h GLU 713 Ca 0.30 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.56 1req h GLU 713 Cb -0.03 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1req h GLU 713 CO -0.06 0.20 0.08 0.66 -1.00 0.00 0.00 179.01 178.89 1req h SER 714 N 0.31 1.08 -0.57 1.42 4.64 -0.69 -2.26 113.55 117.49 1req h SER 714 Ca 0.20 -0.27 0.11 0.00 -0.47 0.00 0.00 61.79 61.36 1req h SER 714 Cb 0.20 -0.29 -0.09 0.00 -0.31 0.00 0.00 62.40 61.91 1req h SER 714 CO -0.21 1.08 0.00 0.00 -0.87 0.00 0.00 176.83 176.83 1req h ALA 715 N 1.03 0.55 -0.28 5.18 0.00 -1.14 0.18 119.26 124.78 1req h ALA 715 Ca 0.20 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1req h ALA 715 Cb 0.48 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1req h ALA 715 CO 0.02 -0.39 0.18 0.82 0.00 0.00 0.00 179.25 179.88 1req h ILE 716 N 0.12 1.07 0.00 0.00 2.04 -1.10 -0.32 117.51 119.32 1req h ILE 716 Ca 0.29 -0.13 -0.18 0.00 1.00 0.00 0.00 64.86 65.84 1req h ILE 716 Cb 0.46 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1req h ILE 716 CO -0.48 0.07 -0.85 0.77 0.00 0.00 0.00 178.15 177.66 1req h SER 717 N 0.37 0.11 0.47 1.72 4.64 -1.07 -2.84 113.55 116.96 1req h SER 717 Ca 0.10 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1req h SER 717 Cb -0.04 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1req h SER 717 CO -0.03 0.91 -0.23 0.25 -0.87 0.00 0.00 176.83 176.87 1req h LEU 718 N 0.04 -0.54 -0.33 5.97 5.85 -0.51 -2.19 115.31 123.61 1req h LEU 718 Ca -0.02 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.70 1req h LEU 718 Cb 1.49 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 42.59 1req h LEU 718 CO 0.12 -0.25 -0.10 0.58 -0.34 0.00 0.00 178.44 178.45 1req h VAL 719 N -0.82 0.63 -0.99 1.05 2.07 -1.14 -0.44 116.25 116.60 1req h VAL 719 Ca -0.06 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.55 1req h VAL 719 Cb 0.57 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.89 1req h VAL 719 CO 0.11 0.00 0.63 0.50 0.02 0.00 0.00 177.57 178.83 1req h LYS 720 N -0.03 1.03 -0.38 1.57 3.64 -1.57 -0.76 116.57 120.07 1req h LYS 720 Ca 0.16 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1req h LYS 720 Cb 0.27 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1req h LYS 720 CO -0.35 0.68 0.14 -0.22 -2.27 0.00 0.00 179.45 177.43 1req h LYS 721 N 1.07 0.58 -0.17 1.90 1.63 -0.52 -2.34 116.57 118.71 1req h LYS 721 Ca 0.46 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 60.14 1req h LYS 721 Cb 0.34 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 1req h LYS 721 CO -0.21 0.56 0.07 -0.07 -3.45 0.00 0.00 179.45 176.35 1req h LEU 722 N 0.47 0.23 0.10 5.20 3.38 -0.73 -2.61 115.31 121.36 1req h LEU 722 Ca 0.13 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1req h LEU 722 Cb 0.21 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1req h LEU 722 CO -0.01 0.33 -0.16 0.03 0.09 0.00 0.00 178.44 178.72 1req h ARG 723 N 0.13 -0.30 -0.48 1.13 2.47 -1.15 -1.34 114.38 114.84 1req h ARG 723 Ca 0.06 0.02 0.08 0.00 -1.26 0.00 0.00 59.98 58.87 1req h ARG 723 Cb 0.16 0.07 -0.06 0.00 -1.65 0.00 0.00 29.97 28.49 1req h ARG 723 CO -0.01 -0.20 0.12 0.00 0.56 0.00 0.00 179.97 180.44 1req h ALA 724 N 0.54 0.55 -0.47 0.04 0.00 -1.42 -1.06 119.26 117.43 1req h ALA 724 Ca 0.02 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 1req h ALA 724 Cb 0.33 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1req h ALA 724 CO -0.08 -0.29 -0.13 1.03 0.00 0.00 0.00 179.25 179.78 1req h SER 725 N 0.26 0.88 1.20 0.00 0.87 -1.38 -3.34 113.55 112.05 1req h SER 725 Ca 0.24 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1req h SER 725 Cb 0.29 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1req h SER 725 CO -0.29 1.02 -0.47 -0.07 -0.53 0.00 0.00 176.83 176.49 1req h LEU 726 N 0.79 0.00 -3.83 2.23 3.38 -0.82 -3.32 115.31 113.73 1req h LEU 726 Ca 0.12 -0.09 -0.59 0.00 0.09 0.00 0.00 57.88 57.41 1req h LEU 726 Cb 0.66 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 41.03 1req h LEU 726 CO 0.05 0.05 -0.23 0.47 0.09 0.00 0.00 178.44 178.87 1req n ASP 727 N -2.41 5.86 0.00 -0.43 8.00 -0.44 -5.06 116.55 122.07 1req n ASP 727 Ca 0.03 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.77 1req n ASP 727 Cb 0.47 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1req n ASP 727 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81