#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4req n LEU 4 N 0.00 -4.93 -4.58 3.22 7.99 -1.26 -4.95 117.00 112.49 4req n LEU 4 Ca 0.00 -0.31 -0.36 0.00 -0.01 0.00 0.00 56.01 55.33 4req n LEU 4 Cb 0.00 -2.51 0.08 0.00 -0.11 0.00 0.00 43.42 40.88 4req n LEU 4 CO 0.00 -0.30 0.43 -0.81 -1.51 0.00 0.00 177.39 175.21 4req n PRO 5 N -2.22 0.50 -4.13 3.23 -0.04 -1.26 -5.02 135.00 126.06 4req n PRO 5 Ca -0.03 0.22 -0.33 0.00 -0.04 0.00 0.00 63.50 63.32 4req n PRO 5 Cb 0.55 -2.13 -0.15 0.00 -0.04 0.00 0.00 33.50 31.73 4req n PRO 5 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 4req s ARG 6 N -3.13 3.10 0.00 0.54 1.81 -1.26 -5.04 118.95 114.97 4req s ARG 6 Ca 0.72 -0.77 0.29 0.00 -1.72 0.00 0.00 55.73 54.25 4req s ARG 6 Cb -0.36 -2.67 1.57 0.00 -0.45 0.00 0.00 34.95 33.04 4req s ARG 6 CO 0.51 -0.18 2.04 1.19 -0.68 0.00 0.00 175.30 178.18 4req n PHE 7 N 4.59 0.00 0.75 -0.53 3.72 -1.26 -4.31 117.46 120.42 4req n PHE 7 Ca -0.20 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.27 4req n PHE 7 Cb 0.50 -0.18 0.37 0.00 -0.94 0.00 0.00 39.48 39.24 4req n PHE 7 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 4req n ASP 8 N -1.18 0.00 0.00 4.37 5.75 -1.26 -2.17 116.55 122.06 4req n ASP 8 Ca 0.17 -0.16 0.00 0.00 -0.01 0.00 0.00 54.79 54.79 4req n ASP 8 Cb 0.18 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 4req n ASP 8 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 4req n SER 9 N -1.15 2.56 -4.71 -1.12 3.41 -1.26 -5.04 113.62 106.31 4req n SER 9 Ca 0.08 -0.19 -0.42 0.00 -0.26 0.00 0.00 58.87 58.08 4req n SER 9 Cb 0.08 0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 64.89 4req n SER 9 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4req s VAL 10 N -1.40 4.31 0.27 -3.33 1.01 -0.92 -5.03 120.40 115.31 4req s VAL 10 Ca 0.00 1.66 -0.14 0.00 0.00 0.00 0.00 61.98 63.50 4req s VAL 10 Cb 0.00 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.24 4req s VAL 10 CO 0.00 0.10 0.66 -1.81 0.00 0.00 0.00 175.10 174.06 4req s ASP 11 N 1.11 6.75 0.07 3.32 1.01 -1.26 -5.01 116.67 122.67 4req s ASP 11 Ca 0.56 1.16 -0.20 0.00 0.71 0.00 0.00 52.55 54.78 4req s ASP 11 Cb -0.26 -2.32 -0.10 0.00 1.01 0.00 0.00 42.92 41.24 4req s ASP 11 CO 0.27 -0.12 1.51 0.25 0.21 0.00 0.00 175.17 177.29 4req h LEU 12 N 2.52 0.33 0.00 1.23 5.85 -1.97 -3.50 115.31 119.78 4req h LEU 12 Ca -0.48 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 57.94 4req h LEU 12 Cb 1.18 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.12 4req h LEU 12 CO 0.67 0.55 0.00 0.61 -0.34 0.00 0.00 178.44 179.93 4req n GLY 13 N -0.32 -4.19 1.18 3.75 0.00 -1.26 -4.68 105.19 99.67 4req n GLY 13 Ca -0.04 -2.12 -0.05 0.00 0.00 0.00 0.00 46.02 43.80 4req n GLY 13 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 4req n ASN 14 N 0.00 2.65 -3.55 1.61 4.05 -1.26 -4.99 115.26 113.76 4req n ASN 14 Ca 0.00 -3.82 -0.28 0.00 0.45 0.00 0.00 54.58 50.94 4req n ASN 14 Cb 0.00 -0.61 0.01 0.00 1.23 0.00 0.00 39.78 40.41 4req n ASN 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 4req n ALA 15 N -1.09 -2.49 -1.77 5.20 0.00 -1.26 -4.87 120.51 114.24 4req n ALA 15 Ca 0.33 -0.06 -0.38 0.00 0.00 0.00 0.00 53.44 53.33 4req n ALA 15 Cb 0.97 -1.12 -0.01 0.00 0.00 0.00 0.00 19.45 19.29 4req n ALA 15 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 4req s PRO 16 N -3.84 3.93 -0.24 0.00 0.04 -1.26 -5.00 135.00 128.62 4req s PRO 16 Ca 0.13 1.92 -0.07 0.00 0.04 0.00 0.00 61.00 63.01 4req s PRO 16 Cb -0.01 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 4req s PRO 16 CO 0.81 -0.45 0.07 0.08 0.04 0.00 0.00 177.00 177.55 4req s VAL 17 N -1.40 4.33 0.81 -0.36 1.01 -1.26 -5.07 120.40 118.46 4req s VAL 17 Ca 0.59 -0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.28 4req s VAL 17 Cb -0.32 -3.02 0.08 0.00 0.00 0.00 0.00 36.38 33.12 4req s VAL 17 CO 0.41 0.35 1.15 -2.16 0.00 0.00 0.00 175.10 174.84 4req s PRO 18 N 1.52 1.76 0.42 2.72 0.04 -1.26 -4.95 135.00 135.26 4req s PRO 18 Ca 0.06 1.50 0.29 0.00 0.04 0.00 0.00 61.00 62.89 4req s PRO 18 Cb -0.15 -1.81 1.10 0.00 0.04 0.00 0.00 34.50 33.68 4req s PRO 18 CO 0.04 -2.07 1.85 0.00 0.04 0.00 0.00 177.00 176.85 4req h ALA 19 N -1.12 1.00 -0.01 8.56 0.00 -2.06 -3.02 119.26 122.62 4req h ALA 19 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 4req h ALA 19 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 4req h ALA 19 CO 0.47 0.00 -0.26 -0.40 0.00 0.00 0.00 179.25 179.06 4req n ASP 20 N -2.76 1.42 -0.01 0.00 5.75 -1.26 -4.52 116.55 115.17 4req n ASP 20 Ca 0.02 -1.17 -0.08 0.00 -0.01 0.00 0.00 54.79 53.55 4req n ASP 20 Cb 0.31 0.19 -0.05 0.00 -1.03 0.00 0.00 41.12 40.54 4req n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 4req h ALA 21 N 3.87 -0.65 -0.26 2.12 0.00 -1.91 0.15 119.26 122.58 4req h ALA 21 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.91 4req h ALA 21 Cb 0.59 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 4req h ALA 21 CO 0.00 -0.76 -0.16 0.00 0.00 0.00 0.00 179.25 178.33 4req h ALA 22 N -0.84 -0.18 -0.43 0.00 0.00 -1.83 0.31 119.26 116.29 4req h ALA 22 Ca 0.02 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.99 4req h ALA 22 Cb 0.34 1.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 4req h ALA 22 CO -0.23 -0.29 0.29 0.07 0.00 0.00 0.00 179.25 179.09 4req h ARG 23 N -0.01 0.44 -0.40 0.00 0.11 -1.84 -1.08 114.38 111.59 4req h ARG 23 Ca 0.04 -0.03 -0.09 0.00 0.10 0.00 0.00 59.98 60.01 4req h ARG 23 Cb 0.12 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 31.08 4req h ARG 23 CO -0.25 0.29 -0.12 0.00 0.10 0.00 0.00 179.97 179.99 4req h ARG 24 N 0.45 0.71 0.41 0.08 3.08 0.91 -2.51 114.38 117.50 4req h ARG 24 Ca 0.18 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 4req h ARG 24 Cb 0.14 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.13 4req h ARG 24 CO -0.04 0.81 -0.20 0.35 -1.07 0.00 0.00 179.97 179.82 4req h PHE 25 N 0.65 -0.51 -0.49 3.04 3.57 0.78 -2.20 116.94 121.78 4req h PHE 25 Ca 0.11 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.69 4req h PHE 25 Cb 0.57 0.17 -0.10 0.00 2.79 0.00 0.00 35.95 39.38 4req h PHE 25 CO 0.03 -0.22 -0.32 0.93 -2.23 0.00 0.00 178.31 176.50 4req h GLU 26 N -0.73 -0.20 -0.49 1.11 4.39 -1.26 0.16 114.58 117.56 4req h GLU 26 Ca -0.06 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.69 4req h GLU 26 Cb 0.51 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.17 4req h GLU 26 CO 0.09 -0.13 0.26 0.93 -1.16 0.00 0.00 179.01 179.00 4req h GLU 27 N -0.20 0.49 -0.50 2.33 4.39 -1.45 0.74 114.58 120.39 4req h GLU 27 Ca 0.20 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.93 4req h GLU 27 Cb 0.54 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 4req h GLU 27 CO -0.60 0.33 0.20 -0.07 -1.16 0.00 0.00 179.01 177.71 4req h LEU 28 N 0.51 0.24 0.16 1.33 3.38 -0.46 0.91 115.31 121.38 4req h LEU 28 Ca 0.21 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.23 4req h LEU 28 Cb 0.10 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 4req h LEU 28 CO -0.13 0.17 -0.13 0.00 0.09 0.00 0.00 178.44 178.44 4req h ALA 29 N 1.31 -0.28 -0.72 1.53 0.00 -0.40 0.17 119.26 120.87 4req h ALA 29 Ca 0.23 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.11 4req h ALA 29 Cb 0.21 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 4req h ALA 29 CO -0.21 -0.67 0.48 0.00 0.00 0.00 0.00 179.25 178.84 4req h ALA 30 N 0.51 1.49 -0.03 0.00 0.00 -0.57 -1.87 119.26 118.80 4req h ALA 30 Ca -0.00 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 4req h ALA 30 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 4req h ALA 30 CO -0.01 0.47 -0.73 -0.22 0.00 0.00 0.00 179.25 178.76 4req h LYS 31 N 0.97 0.17 -0.27 0.00 3.64 -0.60 -3.25 116.57 117.23 4req h LYS 31 Ca 0.26 -0.14 -0.17 0.00 -1.27 0.00 0.00 60.65 59.33 4req h LYS 31 Cb -0.10 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.75 4req h LYS 31 CO -0.06 0.82 -0.52 0.00 -2.27 0.00 0.00 179.45 177.42 4req h ALA 32 N 1.14 0.58 0.00 5.00 0.00 0.10 -3.48 119.26 122.59 4req h ALA 32 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.39 4req h ALA 32 Cb 1.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 4req h ALA 32 CO 0.11 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.45 4req n GLY 33 N 0.28 0.79 3.46 0.00 0.00 -0.80 -5.07 105.19 103.84 4req n GLY 33 Ca -0.04 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.48 4req n GLY 33 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 4req n THR 34 N 0.00 0.21 -0.11 2.61 -1.04 -1.03 -4.94 114.28 109.98 4req n THR 34 Ca 0.00 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 4req n THR 34 Cb 0.00 -1.67 0.00 0.00 -1.82 0.00 0.00 70.33 66.84 4req n THR 34 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 4req n GLY 35 N 6.40 1.34 3.82 3.41 0.00 -1.26 -4.86 105.19 114.03 4req n GLY 35 Ca 0.40 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.56 4req n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4req s GLU 36 N 2.09 2.12 0.57 1.61 0.41 -1.26 -5.00 118.70 119.23 4req s GLU 36 Ca 0.00 0.57 -0.21 0.00 -0.41 0.00 0.00 54.97 54.92 4req s GLU 36 Cb 0.00 -1.93 -0.04 0.00 -1.78 0.00 0.00 34.13 30.38 4req s GLU 36 CO 0.00 -1.58 1.34 0.00 -0.49 0.00 0.00 175.26 174.53 4req s ALA 37 N -3.21 2.73 0.10 5.21 0.00 -1.26 -4.92 121.76 120.41 4req s ALA 37 Ca 0.61 1.31 -0.31 0.00 0.00 0.00 0.00 51.96 53.57 4req s ALA 37 Cb -0.14 -3.56 -0.08 0.00 0.00 0.00 0.00 23.12 19.34 4req s ALA 37 CO 0.54 -1.42 1.42 -0.46 0.00 0.00 0.00 175.76 175.84 4req s TRP 38 N -1.32 3.13 -0.40 0.00 -0.00 0.15 -4.69 118.94 115.81 4req s TRP 38 Ca 0.74 0.88 -0.15 0.00 -0.00 0.00 0.00 56.10 57.56 4req s TRP 38 Cb -0.40 -3.71 0.01 0.00 -0.00 0.00 0.00 33.47 29.38 4req s TRP 38 CO 0.46 -2.54 0.33 -2.00 -0.00 0.00 0.00 176.95 173.20 4req s GLU 39 N 1.37 3.11 0.75 5.86 2.56 -1.26 0.42 118.70 131.52 4req s GLU 39 Ca 0.65 -0.86 -0.12 0.00 0.00 0.00 0.00 54.97 54.64 4req s GLU 39 Cb -0.37 -3.94 0.04 0.00 2.00 0.00 0.00 34.13 31.86 4req s GLU 39 CO 0.30 -0.72 1.13 0.95 -0.56 0.00 0.00 175.26 176.36 4req s THR 40 N 1.82 2.88 0.57 -1.70 -4.23 -1.09 -4.93 115.64 108.97 4req s THR 40 Ca 0.07 0.29 0.29 0.00 -1.18 0.00 0.00 61.69 61.16 4req s THR 40 Cb -0.18 -3.27 0.40 0.00 1.34 0.00 0.00 72.50 70.79 4req s THR 40 CO 0.11 -0.37 1.92 0.00 -0.54 0.00 0.00 174.62 175.73 4req h ALA 41 N -0.84 2.34 0.00 3.99 0.00 -1.97 0.66 119.26 123.44 4req h ALA 41 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 4req h ALA 41 Cb 1.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 4req h ALA 41 CO 0.64 -0.77 0.00 0.93 0.00 0.00 0.00 179.25 180.06 4req h GLU 42 N 0.00 0.00 -3.98 0.00 3.07 -1.96 -3.48 114.58 108.23 4req h GLU 42 Ca 0.26 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.91 4req h GLU 42 Cb 1.23 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 29.23 4req h GLU 42 CO -0.00 0.00 -0.42 1.04 -1.40 0.00 0.00 179.01 178.22 4req n GLN 43 N -2.81 -4.17 -3.98 2.33 6.02 0.22 -4.96 117.38 110.03 4req n GLN 43 Ca 0.03 0.49 -0.34 0.00 -0.01 0.00 0.00 57.00 57.17 4req n GLN 43 Cb 0.41 -4.45 -0.14 0.00 1.02 0.00 0.00 30.24 27.08 4req n GLN 43 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 4req s ILE 44 N -3.20 2.63 0.14 5.09 1.01 -1.26 -4.95 121.20 120.67 4req s ILE 44 Ca 0.14 -1.48 -0.31 0.00 0.00 0.00 0.00 60.65 59.01 4req s ILE 44 Cb -0.06 -2.52 -0.08 0.00 0.01 0.00 0.00 42.46 39.81 4req s ILE 44 CO 0.42 -0.06 1.40 -2.16 0.00 0.00 0.00 174.94 174.54 4req s PRO 45 N 1.19 4.32 -0.26 2.79 0.04 -1.26 -2.66 135.00 139.16 4req s PRO 45 Ca -0.07 2.11 0.02 0.00 0.04 0.00 0.00 61.00 63.11 4req s PRO 45 Cb -0.20 -3.22 0.06 0.00 0.04 0.00 0.00 34.50 31.18 4req s PRO 45 CO -0.03 -0.43 -0.08 0.08 0.04 0.00 0.00 177.00 176.58 4req s VAL 46 N 0.91 1.96 0.95 -0.36 1.01 0.17 -4.92 120.40 120.12 4req s VAL 46 Ca 0.64 -1.54 -0.16 0.00 0.00 0.00 0.00 61.98 60.92 4req s VAL 46 Cb -0.38 -2.14 0.22 0.00 0.00 0.00 0.00 36.38 34.08 4req s VAL 46 CO 0.32 -0.08 1.24 0.61 0.00 0.00 0.00 175.10 177.19 4req n GLY 47 N 4.50 -1.61 0.15 4.51 0.00 -1.26 -0.67 105.19 110.81 4req n GLY 47 Ca -0.12 -1.69 0.14 0.00 0.00 0.00 0.00 46.02 44.35 4req n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 4req n THR 48 N -3.84 0.00 -3.64 2.61 -2.24 -1.26 -4.86 114.28 101.05 4req n THR 48 Ca 0.16 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.78 4req n THR 48 Cb 0.55 -0.03 -0.07 0.00 -2.10 0.00 0.00 70.33 68.68 4req n THR 48 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 4req s LEU 49 N -2.38 -0.76 -0.01 3.22 2.96 -1.26 -5.15 118.68 115.30 4req s LEU 49 Ca 0.31 1.27 0.05 0.00 -0.22 0.00 0.00 54.13 55.54 4req s LEU 49 Cb 0.20 2.19 -0.03 0.00 0.50 0.00 0.00 46.19 49.05 4req s LEU 49 CO 0.45 -0.20 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.77 4req s PHE 50 N 1.22 2.66 0.22 5.38 0.40 -1.26 -5.07 117.98 121.54 4req s PHE 50 Ca -0.07 -0.19 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 4req s PHE 50 Cb -0.05 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 41.91 4req s PHE 50 CO -0.14 0.22 0.12 0.09 0.70 0.00 0.00 175.22 176.21 4req n ASN 51 N 1.95 0.47 0.04 1.36 4.13 -1.26 -4.76 115.26 117.19 4req n ASN 51 Ca -0.16 -2.30 0.03 0.00 1.68 0.00 0.00 54.58 53.82 4req n ASN 51 Cb 0.52 0.78 0.15 0.00 -1.54 0.00 0.00 39.78 39.68 4req n ASN 51 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 4req n GLU 52 N -0.48 0.03 0.23 3.52 0.00 -1.26 -2.78 120.64 119.91 4req n GLU 52 Ca -0.00 0.51 0.11 0.00 0.00 0.00 0.00 57.16 57.78 4req n GLU 52 Cb 0.36 -1.66 0.52 0.00 0.00 0.00 0.00 31.44 30.67 4req n GLU 52 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.13 177.51 4req h ASP 53 N 0.00 0.00 0.29 -1.84 3.04 -2.01 -3.15 116.42 112.74 4req h ASP 53 Ca 0.00 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.70 4req h ASP 53 Cb 0.09 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.36 4req h ASP 53 CO 0.00 0.19 -0.39 -0.37 -2.04 0.00 0.00 179.24 176.63 4req h VAL 54 N 0.00 1.29 0.00 4.15 -1.51 -1.91 -3.29 116.25 114.99 4req h VAL 54 Ca -0.00 -1.42 -0.00 0.00 -1.23 0.00 0.00 66.70 64.04 4req h VAL 54 Cb 0.67 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.51 4req h VAL 54 CO 0.02 0.42 -0.02 1.88 -1.23 0.00 0.00 177.57 178.65 4req h TYR 55 N 0.12 0.00 -0.24 5.19 0.05 -1.80 -3.39 116.97 116.91 4req h TYR 55 Ca 0.01 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.81 4req h TYR 55 Cb 0.75 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.46 4req h TYR 55 CO 0.01 0.02 -0.14 1.17 -1.05 0.00 0.00 178.16 178.16 4req n LYS 56 N -3.22 -0.11 -0.17 4.88 4.81 -1.24 -1.37 118.16 121.74 4req n LYS 56 Ca -0.02 0.81 0.06 0.00 -0.87 0.00 0.00 58.31 58.29 4req n LYS 56 Cb 0.15 -1.20 0.18 0.00 0.02 0.00 0.00 35.03 34.18 4req n LYS 56 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 4req n ASP 57 N -3.45 1.84 -4.68 3.14 8.00 -1.26 -4.86 116.55 115.29 4req n ASP 57 Ca 0.00 -1.97 -0.40 0.00 0.71 0.00 0.00 54.79 53.13 4req n ASP 57 Cb 0.06 -0.22 -0.05 0.00 -0.02 0.00 0.00 41.12 40.89 4req n ASP 57 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 4req s MET 58 N -1.56 4.29 0.00 -1.24 -1.94 -0.47 -4.93 119.30 113.44 4req s MET 58 Ca 0.24 0.79 0.21 0.00 -1.71 0.00 0.00 55.69 55.23 4req s MET 58 Cb 0.13 -3.55 0.06 0.00 2.01 0.00 0.00 34.83 33.48 4req s MET 58 CO 0.17 -0.20 1.07 -0.40 -0.01 0.00 0.00 175.02 175.66 4req n ASP 59 N 4.81 2.23 -0.27 3.03 5.75 -1.26 -4.51 116.55 126.34 4req n ASP 59 Ca 0.00 -1.62 0.11 0.00 -0.01 0.00 0.00 54.79 53.28 4req n ASP 59 Cb 0.50 0.30 0.01 0.00 -1.03 0.00 0.00 41.12 40.90 4req n ASP 59 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 4req n TRP 60 N 0.41 0.00 0.07 2.11 2.14 -1.26 -4.73 117.44 116.18 4req n TRP 60 Ca 0.10 0.00 0.03 0.00 2.07 0.00 0.00 57.50 59.70 4req n TRP 60 Cb 0.47 -0.03 0.18 0.00 -0.81 0.00 0.00 31.31 31.12 4req n TRP 60 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 4req n LEU 61 N -0.69 0.17 -2.50 5.67 4.77 -1.26 -2.17 117.00 120.98 4req n LEU 61 Ca 0.07 0.47 -0.13 0.00 -0.03 0.00 0.00 56.01 56.39 4req n LEU 61 Cb 0.40 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 41.05 4req n LEU 61 CO 0.34 -0.53 0.06 -0.67 -1.33 0.00 0.00 177.39 175.26 4req n ASP 62 N -1.67 3.06 -4.88 -1.43 2.03 -1.26 -4.96 116.55 107.44 4req n ASP 62 Ca -0.00 -2.94 -0.21 0.00 0.52 0.00 0.00 54.79 52.16 4req n ASP 62 Cb 0.17 -0.44 -0.03 0.00 -0.72 0.00 0.00 41.12 40.10 4req n ASP 62 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 4req s THR 63 N -4.20 2.89 -0.04 5.18 -4.23 -0.92 -5.13 115.64 109.19 4req s THR 63 Ca 0.38 -1.32 0.02 0.00 -1.18 0.00 0.00 61.69 59.58 4req s THR 63 Cb 0.39 -3.04 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 4req s THR 63 CO -0.02 -0.04 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.64 4req s TYR 64 N -2.42 2.93 0.54 3.99 2.02 -1.26 -4.98 117.35 118.16 4req s TYR 64 Ca 0.47 0.00 -0.19 0.00 -0.37 0.00 0.00 57.07 56.98 4req s TYR 64 Cb -0.04 -1.67 -0.06 0.00 -0.40 0.00 0.00 41.96 39.79 4req s TYR 64 CO 0.28 0.35 1.11 0.00 -1.57 0.00 0.00 175.55 175.72 4req s ALA 65 N -0.89 2.72 0.00 3.71 0.00 -1.26 -3.79 121.76 122.24 4req s ALA 65 Ca 0.14 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.85 4req s ALA 65 Cb -0.11 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.68 4req s ALA 65 CO 0.04 -0.72 0.00 0.41 0.00 0.00 0.00 175.76 175.49 4req n GLY 66 N -0.01 0.54 2.83 0.00 0.00 -0.74 -4.05 105.19 103.76 4req n GLY 66 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 4req n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4req s ILE 67 N -2.22 -0.01 0.31 -0.61 1.01 -1.25 -4.68 121.20 113.75 4req s ILE 67 Ca 0.00 0.09 -0.27 0.00 0.00 0.00 0.00 60.65 60.47 4req s ILE 67 Cb 0.00 -0.06 -0.14 0.00 0.01 0.00 0.00 42.46 42.28 4req s ILE 67 CO 0.00 0.05 1.00 -2.65 0.00 0.00 0.00 174.94 173.33 4req n PRO 68 N 3.60 1.34 -0.74 2.79 -0.02 -1.26 -1.70 135.00 139.00 4req n PRO 68 Ca -0.19 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.61 4req n PRO 68 Cb 0.55 -1.86 0.07 0.00 -0.02 0.00 0.00 33.50 32.24 4req n PRO 68 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 4req n PRO 69 N 0.65 1.72 -4.45 0.52 -0.04 -1.26 -4.98 135.00 127.16 4req n PRO 69 Ca 0.09 -1.57 -0.40 0.00 -0.04 0.00 0.00 63.50 61.58 4req n PRO 69 Cb 0.33 -1.62 -0.08 0.00 -0.04 0.00 0.00 33.50 32.09 4req n PRO 69 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 4req n PHE 70 N -0.08 -1.15 -0.17 0.54 3.72 -0.69 -3.37 117.46 116.26 4req n PHE 70 Ca 0.31 0.66 -0.01 0.00 -0.05 0.00 0.00 57.45 58.36 4req n PHE 70 Cb 0.88 -1.99 0.22 0.00 -0.94 0.00 0.00 39.48 37.65 4req n PHE 70 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 4req h VAL 71 N -1.01 1.21 -0.01 -4.37 3.04 -1.84 -2.62 116.25 110.64 4req h VAL 71 Ca -0.60 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 64.50 4req h VAL 71 Cb 1.36 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 31.05 4req h VAL 71 CO 0.85 0.25 -0.07 1.41 -1.01 0.00 0.00 177.57 179.00 4req n HIS 72 N -4.34 0.00 0.00 3.17 8.25 -1.26 -4.70 115.22 116.34 4req n HIS 72 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 4req n HIS 72 Cb 0.14 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.17 4req n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4req n GLY 73 N 1.19 4.09 0.19 -1.41 0.00 -0.99 -4.33 105.19 103.93 4req n GLY 73 Ca 0.18 -1.61 0.06 0.00 0.00 0.00 0.00 46.02 44.65 4req n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4req h PRO 74 N 0.00 0.00 -6.37 1.61 0.13 -1.84 -1.96 132.00 123.57 4req h PRO 74 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 4req h PRO 74 Cb 0.00 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 30.93 4req h PRO 74 CO 0.00 0.37 -0.75 0.71 -0.23 0.00 0.00 178.00 178.10 4req s TYR 75 N -3.52 2.75 0.23 1.56 2.02 -1.26 -4.13 117.35 115.00 4req s TYR 75 Ca 0.01 -0.13 -0.06 0.00 -0.37 0.00 0.00 57.07 56.52 4req s TYR 75 Cb 0.10 -1.58 0.39 0.00 -0.40 0.00 0.00 41.96 40.48 4req s TYR 75 CO 0.69 0.28 1.76 0.00 -1.57 0.00 0.00 175.55 176.71 4req h ALA 76 N 4.80 1.02 0.00 3.71 0.00 -1.84 -3.13 119.26 123.83 4req h ALA 76 Ca -0.48 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.52 4req h ALA 76 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 4req h ALA 76 CO 0.51 -0.12 -1.21 0.25 0.00 0.00 0.00 179.25 178.68 4req n THR 77 N -4.92 0.11 -2.79 0.00 -2.24 -1.26 -4.66 114.28 98.52 4req n THR 77 Ca 0.13 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 4req n THR 77 Cb 0.34 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 4req n THR 77 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 4req n MET 78 N -1.95 0.00 0.30 -0.78 0.00 -1.19 -2.82 117.12 110.68 4req n MET 78 Ca 0.01 0.00 0.18 0.00 0.00 0.00 0.00 57.70 57.89 4req n MET 78 Cb 0.44 0.00 0.90 0.00 0.00 0.00 0.00 33.22 34.56 4req n MET 78 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 175.97 177.85 4req h TYR 79 N 0.00 0.00 -0.82 2.03 0.05 -1.77 -2.20 116.97 114.27 4req h TYR 79 Ca 0.00 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.84 4req h TYR 79 Cb 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.68 4req h TYR 79 CO 0.00 0.03 0.50 0.00 -1.05 0.00 0.00 178.16 177.64 4req h ALA 80 N 1.97 1.13 0.03 3.88 0.00 -1.31 -3.11 119.26 121.85 4req h ALA 80 Ca -0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 4req h ALA 80 Cb 0.28 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 4req h ALA 80 CO 0.00 0.22 -1.92 0.34 0.00 0.00 0.00 179.25 177.89 4req n PHE 81 N -4.66 0.71 -3.66 0.00 7.35 -1.05 -4.99 117.46 111.16 4req n PHE 81 Ca 0.12 0.23 -0.07 0.00 -0.76 0.00 0.00 57.45 56.97 4req n PHE 81 Cb 0.19 -1.08 -0.08 0.00 0.35 0.00 0.00 39.48 38.85 4req n PHE 81 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 4req s ARG 82 N -2.47 0.49 0.89 -4.13 3.52 -0.85 -5.10 118.95 111.30 4req s ARG 82 Ca -0.30 1.09 -0.11 0.00 -0.13 0.00 0.00 55.73 56.27 4req s ARG 82 Cb 0.09 0.27 0.12 0.00 -1.56 0.00 0.00 34.95 33.87 4req s ARG 82 CO 0.62 -0.19 1.09 -1.25 -0.81 0.00 0.00 175.30 174.76 4req s PRO 83 N 2.04 1.34 0.88 5.12 0.04 -1.25 -3.48 135.00 139.68 4req s PRO 83 Ca -0.07 0.90 -0.12 0.00 0.04 0.00 0.00 61.00 61.75 4req s PRO 83 Cb -0.09 -1.81 0.11 0.00 0.04 0.00 0.00 34.50 32.75 4req s PRO 83 CO -0.16 -2.20 1.10 -2.67 0.04 0.00 0.00 177.00 173.11 4req n TRP 84 N -3.87 0.81 -2.69 0.56 2.14 -1.26 -4.94 117.44 108.19 4req n TRP 84 Ca 0.07 0.39 -0.43 0.00 2.07 0.00 0.00 57.50 59.61 4req n TRP 84 Cb 0.55 -2.02 -0.02 0.00 -0.81 0.00 0.00 31.31 29.00 4req n TRP 84 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 4req s THR 85 N -2.41 4.76 -0.36 -1.67 2.01 -0.71 -4.93 115.64 112.33 4req s THR 85 Ca 0.69 2.03 -0.29 0.00 0.31 0.00 0.00 61.69 64.42 4req s THR 85 Cb -0.25 -4.31 -0.00 0.00 0.01 0.00 0.00 72.50 67.95 4req s THR 85 CO 0.56 -0.04 1.52 -0.63 -0.69 0.00 0.00 174.62 175.34 4req s ILE 86 N 2.29 3.80 -0.36 1.82 1.01 -1.26 -1.53 121.20 126.97 4req s ILE 86 Ca 0.47 0.84 -0.00 0.00 0.00 0.00 0.00 60.65 61.96 4req s ILE 86 Cb -0.17 -4.01 0.12 0.00 0.01 0.00 0.00 42.46 38.41 4req s ILE 86 CO 0.15 -0.59 0.18 -0.60 0.00 0.00 0.00 174.94 174.08 4req s ARG 87 N 4.99 0.74 -0.22 2.79 3.52 0.36 -1.96 118.95 129.18 4req s ARG 87 Ca 0.66 -1.35 -0.24 0.00 -0.13 0.00 0.00 55.73 54.68 4req s ARG 87 Cb -0.17 -1.73 -0.01 0.00 -1.56 0.00 0.00 34.95 31.47 4req s ARG 87 CO 0.31 -1.12 0.78 -0.65 -0.81 0.00 0.00 175.30 173.81 4req s GLN 88 N 1.14 4.21 0.12 5.12 -1.52 -1.26 -3.90 119.66 123.57 4req s GLN 88 Ca 0.15 0.87 -0.31 0.00 -1.95 0.00 0.00 55.36 54.12 4req s GLN 88 Cb -0.21 -3.61 -0.08 0.00 -0.22 0.00 0.00 33.01 28.88 4req s GLN 88 CO -0.10 -0.41 1.40 -0.47 -0.25 0.00 0.00 175.29 175.46 4req s TYR 89 N 2.46 3.23 0.07 0.91 5.04 -1.26 -3.89 117.35 123.91 4req s TYR 89 Ca 0.34 0.93 -0.26 0.00 -2.44 0.00 0.00 57.07 55.64 4req s TYR 89 Cb -0.16 -3.70 0.08 0.00 0.35 0.00 0.00 41.96 38.53 4req s TYR 89 CO 0.09 -2.46 0.67 0.00 -1.34 0.00 0.00 175.55 172.52 4req s ALA 90 N 1.07 -1.69 0.00 3.97 0.00 0.85 -4.95 121.76 121.01 4req s ALA 90 Ca 0.65 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.45 4req s ALA 90 Cb -0.37 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.25 4req s ALA 90 CO 0.31 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.85 4req n GLY 91 N 0.06 3.40 3.55 0.00 0.00 -1.26 -0.85 105.19 110.09 4req n GLY 91 Ca -0.16 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.63 4req n GLY 91 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 4req s PHE 92 N -0.52 -0.53 0.00 1.61 -0.71 -1.26 -3.93 117.98 112.64 4req s PHE 92 Ca 0.00 0.92 0.00 0.00 -1.04 0.00 0.00 56.93 56.81 4req s PHE 92 Cb 0.00 0.43 0.00 0.00 -1.21 0.00 0.00 43.02 42.24 4req s PHE 92 CO 0.00 -0.49 0.00 0.45 -1.34 0.00 0.00 175.22 173.84 4req n SER 93 N 0.86 0.00 -4.95 1.98 2.88 -0.44 -4.18 113.62 109.76 4req n SER 93 Ca -0.15 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.16 4req n SER 93 Cb 0.57 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.02 4req n SER 93 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 4req s THR 94 N 0.00 5.19 0.25 2.46 -4.23 -1.26 -0.82 115.64 117.23 4req s THR 94 Ca 0.00 -0.71 -0.05 0.00 -1.18 0.00 0.00 61.69 59.75 4req s THR 94 Cb 0.00 -3.85 0.26 0.00 1.34 0.00 0.00 72.50 70.25 4req s THR 94 CO 0.00 -0.41 1.91 0.00 -0.54 0.00 0.00 174.62 175.58 4req h ALA 95 N 1.07 1.30 -0.04 3.99 0.00 -1.82 -1.85 119.26 121.91 4req h ALA 95 Ca -0.51 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 4req h ALA 95 Cb 1.22 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 4req h ALA 95 CO 0.62 0.58 0.02 0.87 0.00 0.00 0.00 179.25 181.34 4req h LYS 96 N 1.29 0.06 -0.37 0.00 1.57 -1.91 -0.45 116.57 116.76 4req h LYS 96 Ca 0.39 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 59.12 4req h LYS 96 Cb -0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 4req h LYS 96 CO -0.11 0.12 0.07 0.93 -0.57 0.00 0.00 179.45 179.89 4req h GLU 97 N -0.02 0.60 -0.06 3.15 5.08 -1.83 -1.63 114.58 119.88 4req h GLU 97 Ca 0.01 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.24 4req h GLU 97 Cb 0.07 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 4req h GLU 97 CO -0.00 0.66 -0.07 0.77 -1.00 0.00 0.00 179.01 179.37 4req h SER 98 N 0.45 -0.21 -0.70 1.42 0.02 -1.32 -0.14 113.55 113.07 4req h SER 98 Ca 0.11 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 4req h SER 98 Cb 0.34 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.95 4req h SER 98 CO 0.01 -0.10 0.44 -1.13 -1.14 0.00 0.00 176.83 174.91 4req h ASN 99 N -0.10 0.81 -0.25 3.07 -0.73 -1.01 0.88 115.58 118.25 4req h ASN 99 Ca 0.05 -0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.16 4req h ASN 99 Cb 0.16 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.54 4req h ASN 99 CO -0.12 0.61 0.06 0.00 -0.37 0.00 0.00 177.43 177.62 4req h ALA 100 N 1.24 0.33 -0.52 1.57 0.00 -1.00 -1.63 119.26 119.25 4req h ALA 100 Ca 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 4req h ALA 100 Cb -0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 4req h ALA 100 CO -0.05 -0.02 0.27 0.35 0.00 0.00 0.00 179.25 179.80 4req h PHE 101 N 0.24 0.73 -0.48 0.00 3.57 -0.56 -2.67 116.94 117.77 4req h PHE 101 Ca 0.08 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.59 4req h PHE 101 Cb 0.27 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 4req h PHE 101 CO 0.01 0.55 0.25 1.88 -2.23 0.00 0.00 178.31 178.77 4req h TYR 102 N 0.69 0.46 -0.45 0.41 0.05 -0.66 -1.64 116.97 115.83 4req h TYR 102 Ca 0.18 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.98 4req h TYR 102 Cb 0.08 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 4req h TYR 102 CO -0.01 0.23 0.26 0.00 -1.05 0.00 0.00 178.16 177.60 4req h ARG 103 N 0.49 0.62 -0.42 4.88 3.08 -1.19 0.16 114.38 122.00 4req h ARG 103 Ca 0.21 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 4req h ARG 103 Cb 0.10 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 4req h ARG 103 CO -0.14 0.47 -0.17 0.00 -1.07 0.00 0.00 179.97 179.06 4req h ARG 104 N 0.59 0.80 -0.43 0.04 3.08 -1.29 -1.19 114.38 115.99 4req h ARG 104 Ca 0.16 -0.30 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 4req h ARG 104 Cb 0.02 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 4req h ARG 104 CO -0.03 0.91 0.11 -0.91 -1.07 0.00 0.00 179.97 178.99 4req h ASN 105 N 0.71 0.64 -0.36 7.04 2.35 -0.97 -2.24 115.58 122.73 4req h ASN 105 Ca 0.11 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 4req h ASN 105 Cb 0.67 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 4req h ASN 105 CO 0.05 0.69 0.11 -0.07 -1.65 0.00 0.00 177.43 176.56 4req h LEU 106 N 0.55 0.53 -1.87 1.61 3.38 -0.51 -0.78 115.31 118.22 4req h LEU 106 Ca 0.13 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 4req h LEU 106 Cb 0.30 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 4req h LEU 106 CO -0.00 0.59 -0.13 0.00 0.09 0.00 0.00 178.44 178.99 4req h ALA 107 N 0.95 1.47 -0.21 1.53 0.00 -1.07 -2.88 119.26 119.05 4req h ALA 107 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.91 4req h ALA 107 Cb 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 4req h ALA 107 CO -0.00 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.41 4req n ALA 108 N -2.37 2.50 0.00 0.00 0.00 -0.86 -4.91 120.51 114.87 4req n ALA 108 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.93 4req n ALA 108 Cb 0.22 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.62 4req n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4req n GLY 109 N 1.03 0.77 3.76 0.00 0.00 -1.09 -4.98 105.19 104.68 4req n GLY 109 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 4req n GLY 109 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 4req s GLN 110 N -0.48 3.68 -0.27 1.61 0.74 -0.32 -4.92 119.66 119.71 4req s GLN 110 Ca 0.00 2.01 -0.06 0.00 0.05 0.00 0.00 55.36 57.36 4req s GLN 110 Cb 0.00 -2.49 -0.14 0.00 1.10 0.00 0.00 33.01 31.48 4req s GLN 110 CO 0.00 -0.68 -0.29 1.17 -0.55 0.00 0.00 175.29 174.94 4req n LYS 111 N -0.40 0.61 -4.36 1.67 3.00 -0.83 -4.54 118.16 113.31 4req n LYS 111 Ca 0.07 0.20 -0.21 0.00 -0.00 0.00 0.00 58.31 58.37 4req n LYS 111 Cb 0.46 -1.49 -0.11 0.00 0.00 0.00 0.00 35.03 33.89 4req n LYS 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 4req s GLY 112 N -6.00 1.49 0.22 3.14 0.00 -0.98 -4.73 107.32 100.46 4req s GLY 112 Ca -0.36 -1.62 0.03 0.00 0.00 0.00 0.00 44.72 42.76 4req s GLY 112 CO 0.54 -1.70 0.37 1.08 0.00 0.00 0.00 173.10 173.39 4req s LEU 113 N -3.07 4.27 -0.22 0.66 1.43 -0.55 -4.18 118.68 117.02 4req s LEU 113 Ca 0.21 0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 53.48 4req s LEU 113 Cb -0.04 -2.99 0.11 0.00 0.03 0.00 0.00 46.19 43.31 4req s LEU 113 CO 0.08 -0.06 0.32 -0.55 0.23 0.00 0.00 176.35 176.37 4req s SER 114 N -3.66 0.54 -0.23 2.29 0.15 -1.25 -0.51 113.70 111.03 4req s SER 114 Ca 0.36 0.20 -0.19 0.00 0.70 0.00 0.00 55.95 57.02 4req s SER 114 Cb -0.10 0.88 -0.03 0.00 -1.71 0.00 0.00 66.02 65.06 4req s SER 114 CO 0.30 -0.30 0.54 -0.69 1.20 0.00 0.00 173.24 174.30 4req s VAL 115 N 2.47 5.06 -0.23 4.45 1.01 -0.80 -0.10 120.40 132.26 4req s VAL 115 Ca 0.09 0.97 -0.11 0.00 0.00 0.00 0.00 61.98 62.92 4req s VAL 115 Cb -0.15 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 4req s VAL 115 CO -0.14 0.11 0.19 0.00 0.00 0.00 0.00 175.10 175.26 4req s ALA 116 N 2.08 3.61 0.06 5.51 0.00 -0.03 -2.25 121.76 130.75 4req s ALA 116 Ca 0.24 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.40 4req s ALA 116 Cb -0.16 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.58 4req s ALA 116 CO 0.09 -0.18 0.01 -0.06 0.00 0.00 0.00 175.76 175.63 4req s PHE 117 N 1.03 3.04 1.02 0.00 0.08 -1.26 -1.28 117.98 120.61 4req s PHE 117 Ca 0.09 0.02 -0.12 0.00 0.12 0.00 0.00 56.93 57.04 4req s PHE 117 Cb -0.13 -1.59 0.20 0.00 -0.57 0.00 0.00 43.02 40.93 4req s PHE 117 CO 0.04 0.48 1.08 0.16 -0.10 0.00 0.00 175.22 176.88 4req s ASP 118 N -2.06 2.39 0.12 1.36 1.47 0.38 -4.13 116.67 116.20 4req s ASP 118 Ca 0.24 1.26 -0.19 0.00 1.18 0.00 0.00 52.55 55.04 4req s ASP 118 Cb -0.12 -1.94 -0.05 0.00 -0.34 0.00 0.00 42.92 40.47 4req s ASP 118 CO 0.16 -3.29 1.75 -0.07 0.68 0.00 0.00 175.17 174.41 4req h LEU 119 N -2.00 0.29 -0.22 2.11 3.38 -1.91 -2.44 115.31 114.53 4req h LEU 119 Ca -0.55 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 57.42 4req h LEU 119 Cb 1.33 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 4req h LEU 119 CO 0.56 0.25 -0.04 -0.65 0.09 0.00 0.00 178.44 178.65 4req h PRO 120 N 0.31 0.01 -0.35 1.13 0.11 -1.86 -2.40 132.00 128.96 4req h PRO 120 Ca 0.09 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.24 4req h PRO 120 Cb 0.01 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 4req h PRO 120 CO -0.02 0.01 0.10 1.15 -0.21 0.00 0.00 178.00 179.03 4req h THR 121 N 0.01 0.87 -0.43 -1.15 2.02 -1.58 -1.33 112.91 111.32 4req h THR 121 Ca 0.10 -0.08 0.09 0.00 0.77 0.00 0.00 66.41 67.29 4req h THR 121 Cb 0.15 0.61 -0.09 0.00 -1.74 0.00 0.00 68.15 67.09 4req h THR 121 CO -0.21 0.04 -0.15 0.45 0.37 0.00 0.00 175.52 176.02 4req h HIS 122 N 0.23 -0.36 -0.25 3.16 3.86 -0.97 -2.93 115.15 117.88 4req h HIS 122 Ca 0.16 0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.39 4req h HIS 122 Cb 0.16 0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 4req h HIS 122 CO -0.16 -0.23 0.03 0.54 0.86 0.00 0.00 177.93 178.97 4req n ARG 123 N -5.36 2.48 -3.19 2.45 1.74 -0.95 -1.83 116.66 112.00 4req n ARG 123 Ca 0.03 -1.28 -0.23 0.00 -0.77 0.00 0.00 57.85 55.60 4req n ARG 123 Cb 0.27 -1.78 0.04 0.00 -1.02 0.00 0.00 32.46 29.97 4req n ARG 123 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4req n GLY 124 N 0.21 -0.53 3.47 -0.13 0.00 -1.06 -4.95 105.19 102.20 4req n GLY 124 Ca 0.13 0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 4req n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4req s TYR 125 N -3.20 2.79 0.68 1.61 2.02 -0.53 -4.08 117.35 116.64 4req s TYR 125 Ca 0.38 -0.27 -0.11 0.00 -0.37 0.00 0.00 57.07 56.70 4req s TYR 125 Cb -0.17 -1.72 -0.00 0.00 -0.40 0.00 0.00 41.96 39.66 4req s TYR 125 CO 0.47 0.09 1.06 -0.51 -1.57 0.00 0.00 175.55 175.09 4req s ASP 126 N -0.37 5.65 0.54 2.29 1.01 -1.26 -3.59 116.67 120.93 4req s ASP 126 Ca 0.04 1.39 0.33 0.00 0.71 0.00 0.00 52.55 55.02 4req s ASP 126 Cb -0.12 -2.30 1.30 0.00 1.01 0.00 0.00 42.92 42.80 4req s ASP 126 CO 0.02 -1.24 1.96 0.28 0.21 0.00 0.00 175.17 176.40 4req h SER 127 N -0.58 0.00 0.40 0.27 0.02 -1.94 -2.86 113.55 108.87 4req h SER 127 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 4req h SER 127 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 4req h SER 127 CO 0.61 0.01 -0.28 -0.90 -1.14 0.00 0.00 176.83 175.14 4req n ASP 128 N -3.11 0.67 -4.68 3.07 5.68 -1.26 -4.71 116.55 112.20 4req n ASP 128 Ca 0.01 -0.52 -0.42 0.00 -0.50 0.00 0.00 54.79 53.35 4req n ASP 128 Cb 0.32 0.07 -0.03 0.00 -1.14 0.00 0.00 41.12 40.35 4req n ASP 128 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 4req s ASN 129 N -2.68 6.76 0.29 -1.12 3.84 -1.08 -4.91 114.94 116.04 4req s ASN 129 Ca 0.21 2.20 0.04 0.00 0.21 0.00 0.00 52.86 55.51 4req s ASN 129 Cb 0.19 -2.55 0.66 0.00 -0.55 0.00 0.00 41.25 39.00 4req s ASN 129 CO 0.56 -0.80 1.79 -0.65 -2.79 0.00 0.00 177.10 175.21 4req h PRO 130 N 8.33 0.78 0.00 0.43 0.11 -1.90 -2.98 132.00 136.77 4req h PRO 130 Ca -0.38 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 4req h PRO 130 Cb 1.18 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 4req h PRO 130 CO 0.92 0.51 -0.04 -0.09 -0.21 0.00 0.00 178.00 179.10 4req h ARG 131 N 0.80 0.00 -0.30 1.05 2.43 -1.97 -3.18 114.38 113.21 4req h ARG 131 Ca 0.54 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 4req h ARG 131 Cb 0.76 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 4req h ARG 131 CO -0.35 0.04 0.00 1.33 -1.51 0.00 0.00 179.97 179.48 4req n VAL 132 N -3.59 1.54 -0.18 0.20 0.24 -1.12 -4.83 118.33 110.58 4req n VAL 132 Ca -0.02 -1.37 -0.12 0.00 -2.04 0.00 0.00 64.34 60.79 4req n VAL 132 Cb 0.14 0.18 -0.07 0.00 -1.47 0.00 0.00 33.84 32.61 4req n VAL 132 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 4req h ALA 133 N 1.87 -0.59 0.00 2.33 0.00 -1.64 -2.52 119.26 118.72 4req h ALA 133 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 4req h ALA 133 Cb 1.03 1.08 0.00 0.00 0.00 0.00 0.00 17.79 19.89 4req h ALA 133 CO 0.09 -0.96 0.00 0.78 0.00 0.00 0.00 179.25 179.16 4req h GLY 134 N -0.31 0.00 -0.52 0.00 0.00 -1.89 -2.65 103.07 97.70 4req h GLY 134 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 4req h GLY 134 CO -0.65 0.00 -0.66 1.22 0.00 0.00 0.00 176.54 176.45 4req n ASP 135 N -2.53 1.49 -4.66 0.19 8.00 -0.97 -4.51 116.55 113.56 4req n ASP 135 Ca -0.01 -1.24 -0.42 0.00 0.71 0.00 0.00 54.79 53.82 4req n ASP 135 Cb 0.08 0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 41.86 4req n ASP 135 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 4req s VAL 136 N -2.57 3.05 -1.11 2.53 1.01 -1.00 -2.55 120.40 119.75 4req s VAL 136 Ca 0.13 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.21 4req s VAL 136 Cb 0.16 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.48 4req s VAL 136 CO 0.65 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.36 4req n GLY 137 N 4.48 1.00 0.10 4.51 0.00 -1.26 -4.75 105.19 109.26 4req n GLY 137 Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 4req n GLY 137 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 4req h MET 138 N 0.00 0.00 -0.00 1.61 2.07 -1.82 -1.17 114.93 115.61 4req h MET 138 Ca -0.21 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.42 4req h MET 138 Cb 1.18 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.91 4req h MET 138 CO 0.31 0.51 -0.11 0.00 1.07 0.00 0.00 176.91 178.70 4req n ALA 139 N -2.37 2.60 0.00 6.32 0.00 -1.26 -4.84 120.51 120.95 4req n ALA 139 Ca -0.06 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 52.98 4req n ALA 139 Cb 0.87 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.11 4req n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4req n GLY 140 N 0.67 -1.24 3.73 0.00 0.00 -1.26 -4.71 105.19 102.38 4req n GLY 140 Ca 0.03 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 4req n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4req s VAL 141 N -2.90 3.63 -0.44 1.61 0.11 -0.40 -2.66 120.40 119.34 4req s VAL 141 Ca 0.00 1.29 -0.29 0.00 -2.93 0.00 0.00 61.98 60.05 4req s VAL 141 Cb 0.00 -3.82 0.03 0.00 -1.53 0.00 0.00 36.38 31.05 4req s VAL 141 CO 0.00 0.17 1.11 0.00 -3.33 0.00 0.00 175.10 173.05 4req s ALA 142 N 0.34 3.23 -0.23 1.54 0.00 0.00 -0.47 121.76 126.19 4req s ALA 142 Ca 0.56 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.13 4req s ALA 142 Cb -0.33 -3.83 0.05 0.00 0.00 0.00 0.00 23.12 19.01 4req s ALA 142 CO 0.34 -2.08 -0.14 0.42 0.00 0.00 0.00 175.76 174.31 4req s ILE 143 N 4.23 2.08 -0.11 0.00 -1.09 -1.26 -4.54 121.20 120.51 4req s ILE 143 Ca 0.47 -1.35 0.06 0.00 -2.23 0.00 0.00 60.65 57.60 4req s ILE 143 Cb -0.08 -2.09 -0.11 0.00 -1.58 0.00 0.00 42.46 38.60 4req s ILE 143 CO 0.28 0.17 -0.01 0.47 -1.23 0.00 0.00 174.94 174.62 4req n ASP 144 N 4.52 2.72 -1.46 3.58 8.00 -1.26 -4.75 116.55 127.90 4req n ASP 144 Ca -0.16 -0.02 -0.02 0.00 0.71 0.00 0.00 54.79 55.29 4req n ASP 144 Cb 0.45 0.46 0.01 0.00 -0.02 0.00 0.00 41.12 42.02 4req n ASP 144 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 4req n SER 145 N -2.51 -0.58 -0.24 -2.24 3.41 -1.26 -0.13 113.62 110.06 4req n SER 145 Ca -0.18 -1.41 0.17 0.00 -0.26 0.00 0.00 58.87 57.20 4req n SER 145 Cb 0.79 0.97 0.49 0.00 -0.26 0.00 0.00 64.21 66.21 4req n SER 145 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 4req h ILE 146 N 1.25 0.72 -0.13 -1.33 6.09 -1.84 -1.97 117.51 120.31 4req h ILE 146 Ca -0.09 -0.16 0.05 0.00 -1.37 0.00 0.00 64.86 63.30 4req h ILE 146 Cb 0.32 0.22 -0.06 0.00 0.47 0.00 0.00 36.82 37.77 4req h ILE 146 CO 0.11 0.08 -0.29 1.88 -3.07 0.00 0.00 178.15 176.86 4req h TYR 147 N 0.45 -0.80 0.35 2.19 -1.99 -1.97 -1.30 116.97 113.91 4req h TYR 147 Ca 0.45 0.04 -0.02 0.00 2.00 0.00 0.00 58.73 61.20 4req h TYR 147 Cb 1.05 0.37 0.00 0.00 2.00 0.00 0.00 36.73 40.15 4req h TYR 147 CO -0.00 -0.37 -0.17 -0.44 -0.00 0.00 0.00 178.16 177.17 4req h ASP 148 N -0.37 -0.40 -0.84 3.88 3.32 -1.72 -3.05 116.42 117.24 4req h ASP 148 Ca 0.10 -0.08 0.15 0.00 0.02 0.00 0.00 57.03 57.22 4req h ASP 148 Cb 0.52 0.10 -0.10 0.00 0.22 0.00 0.00 39.33 40.08 4req h ASP 148 CO -0.34 -0.17 0.42 0.24 -1.72 0.00 0.00 179.24 177.67 4req h MET 149 N -0.63 0.57 -0.54 3.56 2.86 -1.38 -0.56 114.93 118.81 4req h MET 149 Ca -0.05 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.49 4req h MET 149 Cb 0.46 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 4req h MET 149 CO 0.08 0.38 0.09 -0.09 1.06 0.00 0.00 176.91 178.43 4req h ARG 150 N 0.59 0.89 -0.30 1.72 2.43 -1.28 -2.83 114.38 115.61 4req h ARG 150 Ca 0.46 -0.24 -0.17 0.00 -0.81 0.00 0.00 59.98 59.22 4req h ARG 150 Cb 0.66 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 4req h ARG 150 CO -0.37 0.87 -0.50 0.93 -1.51 0.00 0.00 179.97 179.39 4req h GLU 151 N 0.78 0.83 -0.34 0.20 5.08 -1.36 -1.76 114.58 118.01 4req h GLU 151 Ca 0.16 -0.50 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 4req h GLU 151 Cb 0.41 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 4req h GLU 151 CO 0.01 1.13 0.15 1.25 -1.00 0.00 0.00 179.01 180.55 4req h LEU 152 N 0.65 0.20 -2.25 1.33 5.85 -0.87 -2.98 115.31 117.24 4req h LEU 152 Ca 0.03 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 4req h LEU 152 Cb 1.09 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.11 4req h LEU 152 CO 0.11 0.15 0.00 0.49 -0.34 0.00 0.00 178.44 178.85 4req n PHE 153 N -4.98 0.91 -2.08 1.25 3.72 -1.12 -4.37 117.46 110.79 4req n PHE 153 Ca 0.00 -0.41 -0.42 0.00 -0.05 0.00 0.00 57.45 56.57 4req n PHE 153 Cb 0.10 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 4req n PHE 153 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 4req s ALA 154 N -1.43 3.63 0.00 4.37 0.00 -0.66 -1.86 121.76 125.81 4req s ALA 154 Ca 0.39 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.37 4req s ALA 154 Cb 0.22 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.69 4req s ALA 154 CO 0.24 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.37 4req n GLY 155 N 3.83 0.49 2.70 0.00 0.00 -1.26 -5.00 105.19 105.95 4req n GLY 155 Ca 0.15 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 4req n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4req s ILE 156 N -2.00 1.02 -0.17 -0.61 1.01 -0.78 -5.08 121.20 114.59 4req s ILE 156 Ca 0.00 -1.87 -0.29 0.00 0.00 0.00 0.00 60.65 58.49 4req s ILE 156 Cb 0.00 -1.75 -0.07 0.00 0.01 0.00 0.00 42.46 40.66 4req s ILE 156 CO 0.00 -0.79 2.16 -2.65 0.00 0.00 0.00 174.94 173.66 4req n PRO 157 N 4.28 2.07 0.07 2.79 -0.02 -1.26 -4.88 135.00 138.05 4req n PRO 157 Ca 0.03 0.62 0.09 0.00 -2.02 0.00 0.00 63.50 62.23 4req n PRO 157 Cb 0.39 -3.10 0.40 0.00 -0.02 0.00 0.00 33.50 31.17 4req n PRO 157 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 4req n LEU 158 N 10.50 0.35 0.19 2.45 4.77 -1.26 -2.11 117.00 131.90 4req n LEU 158 Ca 0.29 0.59 0.11 0.00 -0.03 0.00 0.00 56.01 56.97 4req n LEU 158 Cb 0.41 -0.55 0.12 0.00 -2.33 0.00 0.00 43.42 41.07 4req n LEU 158 CO 0.68 -0.45 0.62 -2.24 -1.33 0.00 0.00 177.39 174.67 4req h ASP 159 N 0.00 0.00 0.00 -1.43 2.03 -1.90 -3.35 116.42 111.77 4req h ASP 159 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 4req h ASP 159 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 4req h ASP 159 CO 0.00 0.06 -1.24 0.00 -1.03 0.00 0.00 179.24 177.03 4req n GLN 160 N -3.03 1.26 -4.21 4.15 6.02 -0.89 -4.91 117.38 115.77 4req n GLN 160 Ca 0.03 -0.08 -0.34 0.00 -0.01 0.00 0.00 57.00 56.60 4req n GLN 160 Cb 0.56 -1.24 -0.08 0.00 1.02 0.00 0.00 30.24 30.50 4req n GLN 160 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 4req s MET 161 N -2.66 3.01 -0.25 -1.09 1.75 -0.90 -5.07 119.30 114.09 4req s MET 161 Ca -0.01 -0.45 -0.16 0.00 -1.25 0.00 0.00 55.69 53.81 4req s MET 161 Cb 0.09 -2.83 -0.03 0.00 2.84 0.00 0.00 34.83 34.90 4req s MET 161 CO 0.54 0.67 0.42 0.45 -0.65 0.00 0.00 175.02 176.46 4req s SER 162 N -1.36 6.35 -0.14 1.11 0.15 -1.26 -4.46 113.70 114.09 4req s SER 162 Ca 0.18 0.41 0.02 0.00 0.70 0.00 0.00 55.95 57.26 4req s SER 162 Cb -0.12 -2.24 0.01 0.00 -1.71 0.00 0.00 66.02 61.97 4req s SER 162 CO 0.08 -0.20 -0.21 -0.69 1.20 0.00 0.00 173.24 173.43 4req s VAL 163 N 2.00 1.98 -0.06 4.45 1.01 -0.81 -1.48 120.40 127.48 4req s VAL 163 Ca 0.18 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 4req s VAL 163 Cb -0.16 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 4req s VAL 163 CO 0.09 0.53 0.18 -0.55 0.00 0.00 0.00 175.10 175.35 4req s SER 164 N 0.92 6.41 -0.11 3.32 0.15 0.33 -1.45 113.70 123.27 4req s SER 164 Ca -0.05 0.45 0.00 0.00 0.70 0.00 0.00 55.95 57.05 4req s SER 164 Cb -0.15 -2.05 0.02 0.00 -1.71 0.00 0.00 66.02 62.13 4req s SER 164 CO -0.04 0.34 -0.10 -0.04 1.20 0.00 0.00 173.24 174.60 4req s MET 165 N -1.44 1.71 -0.85 5.44 -1.94 0.55 -1.90 119.30 120.87 4req s MET 165 Ca 0.21 -0.34 -0.20 0.00 -1.71 0.00 0.00 55.69 53.65 4req s MET 165 Cb -0.12 -1.67 0.11 0.00 2.01 0.00 0.00 34.83 35.15 4req s MET 165 CO 0.11 -0.22 1.09 0.99 -0.01 0.00 0.00 175.02 176.98 4req s THR 166 N 1.52 4.57 -0.17 2.05 2.01 -0.95 -1.12 115.64 123.55 4req s THR 166 Ca 0.02 -1.17 -0.07 0.00 0.31 0.00 0.00 61.69 60.77 4req s THR 166 Cb -0.13 -4.76 0.07 0.00 0.01 0.00 0.00 72.50 67.69 4req s THR 166 CO -0.07 -1.51 0.37 -0.32 -0.69 0.00 0.00 174.62 172.40 4req s MET 167 N 3.20 0.31 0.05 4.92 0.00 -1.26 -4.58 119.30 121.94 4req s MET 167 Ca 0.30 0.83 0.00 0.00 0.00 0.00 0.00 55.69 56.82 4req s MET 167 Cb -0.08 0.08 0.00 0.00 0.00 0.00 0.00 34.83 34.82 4req s MET 167 CO -0.04 -0.21 0.00 0.09 0.00 0.00 0.00 175.02 174.87 4req n ASN 168 N 4.78 0.34 0.02 1.11 3.02 -1.26 -0.82 115.26 122.45 4req n ASN 168 Ca -0.16 0.08 -0.01 0.00 -0.03 0.00 0.00 54.58 54.46 4req n ASN 168 Cb 0.52 -0.07 -0.00 0.00 -0.61 0.00 0.00 39.78 39.61 4req n ASN 168 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 4req h GLY 169 N 0.00 -0.06 -3.37 7.41 0.00 -1.69 -3.30 103.07 102.06 4req h GLY 169 Ca 0.00 0.02 -0.28 0.00 0.00 0.00 0.00 47.33 47.07 4req h GLY 169 CO 0.00 -0.02 0.36 0.00 0.00 0.00 0.00 176.54 176.88 4req n ALA 170 N -2.03 4.88 -0.36 3.60 0.00 -0.76 -4.67 120.51 121.16 4req n ALA 170 Ca -0.01 -1.45 0.03 0.00 0.00 0.00 0.00 53.44 52.01 4req n ALA 170 Cb 0.02 -1.32 0.17 0.00 0.00 0.00 0.00 19.45 18.33 4req n ALA 170 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 4req h VAL 171 N 0.94 1.06 0.70 0.00 3.04 -1.84 -2.67 116.25 117.49 4req h VAL 171 Ca 0.26 -0.39 -0.03 0.00 -1.01 0.00 0.00 66.70 65.53 4req h VAL 171 Cb 1.00 -0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 30.12 4req h VAL 171 CO 0.66 0.21 -0.48 -0.07 -1.01 0.00 0.00 177.57 176.88 4req h LEU 172 N 1.13 -1.22 -1.05 3.16 3.38 -1.90 -1.21 115.31 117.59 4req h LEU 172 Ca 0.43 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.40 4req h LEU 172 Cb 0.20 0.37 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 4req h LEU 172 CO -0.18 -0.71 -0.15 1.55 0.09 0.00 0.00 178.44 179.04 4req h PRO 173 N -1.12 0.50 -0.05 1.13 0.13 -1.92 0.61 132.00 131.29 4req h PRO 173 Ca -0.09 -0.15 -0.02 0.00 -0.87 0.00 0.00 66.00 64.87 4req h PRO 173 Cb 0.91 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.99 4req h PRO 173 CO 0.07 0.64 -0.03 0.82 -0.23 0.00 0.00 178.00 179.26 4req h ILE 174 N 0.46 1.34 -0.02 -3.56 1.08 -1.43 -1.04 117.51 114.34 4req h ILE 174 Ca 0.08 -1.07 0.01 0.00 -0.39 0.00 0.00 64.86 63.49 4req h ILE 174 Cb 0.53 1.95 -0.01 0.00 -3.07 0.00 0.00 36.82 36.22 4req h ILE 174 CO 0.03 0.29 -0.03 0.25 -0.69 0.00 0.00 178.15 178.00 4req h LEU 175 N -0.29 -0.10 -0.36 1.44 5.85 -1.18 -2.05 115.31 118.62 4req h LEU 175 Ca 0.01 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.82 4req h LEU 175 Cb 0.49 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 4req h LEU 175 CO 0.01 -0.05 -0.12 0.00 -0.34 0.00 0.00 178.44 177.93 4req h ALA 176 N 0.97 0.19 -0.22 1.25 0.00 -0.83 -0.93 119.26 119.68 4req h ALA 176 Ca 0.02 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.08 4req h ALA 176 Cb 0.08 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 4req h ALA 176 CO -0.05 -0.49 0.15 -0.07 0.00 0.00 0.00 179.25 178.78 4req h LEU 177 N -0.05 0.24 -0.06 0.00 3.38 -1.06 0.71 115.31 118.47 4req h LEU 177 Ca 0.18 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 4req h LEU 177 Cb 0.32 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 4req h LEU 177 CO -0.40 0.17 -0.02 0.22 0.09 0.00 0.00 178.44 178.50 4req h TYR 178 N 0.28 0.13 -0.57 1.13 3.20 -0.52 0.11 116.97 120.73 4req h TYR 178 Ca 0.08 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.98 4req h TYR 178 Cb -0.01 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.18 4req h TYR 178 CO -0.00 0.48 0.29 0.28 -1.64 0.00 0.00 178.16 177.57 4req h VAL 179 N -0.26 0.94 -0.55 1.81 2.07 -0.44 -0.03 116.25 119.79 4req h VAL 179 Ca 0.01 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 4req h VAL 179 Cb 0.44 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 4req h VAL 179 CO 0.01 0.10 0.16 0.58 0.02 0.00 0.00 177.57 178.44 4req h VAL 180 N 0.55 1.24 -0.49 2.57 2.07 -0.84 -1.16 116.25 120.18 4req h VAL 180 Ca 0.26 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.97 4req h VAL 180 Cb 0.18 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 4req h VAL 180 CO -0.18 0.31 0.30 0.74 0.02 0.00 0.00 177.57 178.75 4req h THR 181 N 0.78 1.06 0.13 2.57 2.02 0.10 -2.34 112.91 117.23 4req h THR 181 Ca 0.18 -0.20 0.01 0.00 0.77 0.00 0.00 66.41 67.17 4req h THR 181 Cb 0.30 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 4req h THR 181 CO -0.00 0.11 -0.23 0.00 0.37 0.00 0.00 175.52 175.77 4req h ALA 182 N 1.22 -0.39 -0.54 6.16 0.00 -0.83 -3.02 119.26 121.85 4req h ALA 182 Ca 0.20 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.18 4req h ALA 182 Cb 0.01 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.05 4req h ALA 182 CO -0.08 -0.76 -0.16 1.49 0.00 0.00 0.00 179.25 179.73 4req h GLU 183 N -0.43 -0.03 -0.29 0.00 4.81 -0.74 -1.61 114.58 116.30 4req h GLU 183 Ca 0.02 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 4req h GLU 183 Cb 0.44 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 4req h GLU 183 CO -0.12 -0.02 0.26 0.93 -0.73 0.00 0.00 179.01 179.34 4req h GLU 184 N -0.03 0.00 0.00 1.92 5.08 -1.31 0.29 114.58 120.54 4req h GLU 184 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 4req h GLU 184 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 4req h GLU 184 CO -0.57 0.00 -0.19 1.04 -1.00 0.00 0.00 179.01 178.28 4req n GLN 185 N -4.02 0.02 -0.51 2.33 6.02 -0.70 -4.92 117.38 115.61 4req n GLN 185 Ca 0.04 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 4req n GLN 185 Cb 0.41 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 30.15 4req n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4req n GLY 186 N 1.49 0.71 3.71 1.08 0.00 0.09 -5.04 105.19 107.22 4req n GLY 186 Ca 0.06 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 4req n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4req s VAL 187 N -2.00 5.19 0.43 1.61 1.01 -0.69 -4.97 120.40 120.98 4req s VAL 187 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 4req s VAL 187 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 4req s VAL 187 CO 0.00 0.46 0.74 -0.54 0.00 0.00 0.00 175.10 175.77 4req s LYS 188 N 0.24 3.61 0.46 2.72 1.02 -1.26 -2.82 119.74 123.71 4req s LYS 188 Ca 0.07 0.22 0.20 0.00 0.02 0.00 0.00 55.97 56.48 4req s LYS 188 Cb -0.12 -2.42 1.19 0.00 -0.52 0.00 0.00 37.83 35.96 4req s LYS 188 CO -0.01 -0.10 1.93 -1.35 -0.92 0.00 0.00 175.35 174.90 4req h PRO 189 N 0.67 0.26 0.00 -1.68 0.11 -1.92 -2.45 132.00 126.99 4req h PRO 189 Ca -0.47 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 4req h PRO 189 Cb 1.20 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 4req h PRO 189 CO 0.63 0.17 -0.25 1.05 -0.21 0.00 0.00 178.00 179.39 4req h GLU 190 N 0.27 0.00 -0.01 1.05 9.09 -1.91 -3.02 114.58 120.06 4req h GLU 190 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 4req h GLU 190 Cb 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 4req h GLU 190 CO -0.09 0.25 -0.04 1.04 0.05 0.00 0.00 179.01 180.22 4req n GLN 191 N -3.55 1.04 -2.93 1.06 6.02 -0.92 -4.45 117.38 113.64 4req n GLN 191 Ca -0.01 -0.33 -0.42 0.00 -0.01 0.00 0.00 57.00 56.23 4req n GLN 191 Cb 0.40 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 30.11 4req n GLN 191 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 4req s LEU 192 N -2.19 4.13 -0.17 1.08 1.43 -1.14 -4.60 118.68 117.22 4req s LEU 192 Ca 0.38 0.25 -0.14 0.00 -1.03 0.00 0.00 54.13 53.59 4req s LEU 192 Cb 0.21 -3.05 -0.05 0.00 0.03 0.00 0.00 46.19 43.33 4req s LEU 192 CO 0.40 -0.81 0.28 0.00 0.23 0.00 0.00 176.35 176.45 4req s ALA 193 N 3.24 3.60 0.00 4.21 0.00 -1.26 -3.22 121.76 128.32 4req s ALA 193 Ca 0.32 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.80 4req s ALA 193 Cb -0.13 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.61 4req s ALA 193 CO 0.19 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.45 4req n GLY 194 N 3.43 -1.46 3.00 0.00 0.00 -1.22 -1.93 105.19 107.00 4req n GLY 194 Ca -0.12 -1.15 -0.11 0.00 0.00 0.00 0.00 46.02 44.64 4req n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4req s THR 195 N -2.91 0.06 -0.08 2.61 2.01 -0.53 0.31 115.64 117.11 4req s THR 195 Ca 0.00 -0.48 0.05 0.00 0.31 0.00 0.00 61.69 61.57 4req s THR 195 Cb 0.00 -0.25 -0.00 0.00 0.01 0.00 0.00 72.50 72.26 4req s THR 195 CO 0.00 -0.26 -0.24 -0.51 -0.69 0.00 0.00 174.62 172.91 4req s ILE 196 N -0.83 2.03 0.07 1.82 1.10 -0.99 -0.33 121.20 124.06 4req s ILE 196 Ca -0.09 -1.03 -0.33 0.00 -0.51 0.00 0.00 60.65 58.69 4req s ILE 196 Cb -0.05 -1.74 -0.19 0.00 0.15 0.00 0.00 42.46 40.62 4req s ILE 196 CO 0.00 0.56 1.60 -0.61 -2.11 0.00 0.00 174.94 174.38 4req h GLN 197 N 6.44 -0.93 -6.90 3.50 4.15 -1.15 -3.22 115.11 116.99 4req h GLN 197 Ca -0.25 0.06 -0.58 0.00 0.77 0.00 0.00 58.65 58.66 4req h GLN 197 Cb 1.21 0.21 -0.21 0.00 0.21 0.00 0.00 27.48 28.90 4req h GLN 197 CO 0.47 -0.62 -0.91 -1.71 -1.93 0.00 0.00 178.83 174.14 4req n ASN 198 N -5.50 -0.91 -3.99 -0.69 5.15 0.00 -1.38 115.26 107.94 4req n ASN 198 Ca -0.14 -1.15 -0.31 0.00 -0.60 0.00 0.00 54.58 52.38 4req n ASN 198 Cb 0.39 -2.20 -0.14 0.00 -0.53 0.00 0.00 39.78 37.30 4req n ASN 198 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 4req s ASP 199 N -3.89 4.55 0.27 1.20 -1.08 -1.26 -4.77 116.67 111.69 4req s ASP 199 Ca 0.35 -2.61 0.15 0.00 -0.52 0.00 0.00 52.55 49.93 4req s ASP 199 Cb -0.20 -1.64 0.06 0.00 -1.46 0.00 0.00 42.92 39.68 4req s ASP 199 CO 0.96 -0.31 1.42 -0.29 0.52 0.00 0.00 175.17 177.48 4req h ILE 200 N 6.02 0.84 -0.82 4.11 6.09 -1.90 -3.34 117.51 128.50 4req h ILE 200 Ca -0.06 -2.20 0.05 0.00 -1.37 0.00 0.00 64.86 61.28 4req h ILE 200 Cb 0.95 2.41 -0.06 0.00 0.47 0.00 0.00 36.82 40.59 4req h ILE 200 CO 0.61 0.48 0.51 -0.07 -3.07 0.00 0.00 178.15 176.61 4req h LEU 201 N 0.00 0.81 -0.70 2.19 3.38 -1.99 -1.11 115.31 117.89 4req h LEU 201 Ca -0.01 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 4req h LEU 201 Cb 1.39 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 4req h LEU 201 CO 0.06 0.52 -0.14 0.07 0.09 0.00 0.00 178.44 179.05 4req h LYS 202 N 0.94 0.00 0.02 1.13 5.09 -1.92 -1.92 116.57 119.91 4req h LYS 202 Ca 0.35 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 61.09 4req h LYS 202 Cb 0.14 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.47 4req h LYS 202 CO -0.16 0.14 -0.01 0.93 -2.09 0.00 0.00 179.45 178.26 4req h GLU 203 N 0.00 -0.02 -0.51 0.07 4.39 -1.33 0.54 114.58 117.72 4req h GLU 203 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 4req h GLU 203 Cb 0.86 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 4req h GLU 203 CO 0.02 0.19 0.11 0.74 -1.16 0.00 0.00 179.01 178.91 4req h PHE 204 N -0.24 0.87 -0.08 4.33 0.04 -1.47 0.13 116.94 120.53 4req h PHE 204 Ca -0.00 -0.11 -0.09 0.00 2.80 0.00 0.00 57.97 60.57 4req h PHE 204 Cb 0.23 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.14 4req h PHE 204 CO -0.00 0.78 -0.29 1.98 -0.60 0.00 0.00 178.31 180.18 4req h MET 205 N 0.71 0.33 0.00 1.51 4.05 -1.22 -3.46 114.93 116.86 4req h MET 205 Ca 0.16 -0.26 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 4req h MET 205 Cb 0.36 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 4req h MET 205 CO 0.01 0.89 0.00 1.33 0.23 0.00 0.00 176.91 179.36 4req n VAL 206 N -4.45 0.00 0.20 -5.77 0.24 0.18 -4.58 118.33 104.15 4req n VAL 206 Ca -0.08 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.31 4req n VAL 206 Cb 0.48 0.00 0.14 0.00 -1.47 0.00 0.00 33.84 32.99 4req n VAL 206 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 4req h ARG 207 N 0.00 0.00 -6.27 7.34 2.43 -1.07 -3.46 114.38 113.34 4req h ARG 207 Ca 0.00 0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 58.70 4req h ARG 207 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 4req h ARG 207 CO 0.00 0.15 -0.75 0.09 -1.51 0.00 0.00 179.97 177.95 4req n ASN 208 N -3.14 -4.84 -0.44 -3.80 3.02 0.43 -4.81 115.26 101.68 4req n ASN 208 Ca 0.03 -0.76 0.07 0.00 -0.03 0.00 0.00 54.58 53.88 4req n ASN 208 Cb 0.59 -3.96 0.12 0.00 -0.61 0.00 0.00 39.78 35.92 4req n ASN 208 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 4req n THR 209 N -4.70 1.46 -1.27 3.41 -2.24 -1.26 -4.68 114.28 105.00 4req n THR 209 Ca 0.03 -2.03 -0.30 0.00 -2.27 0.00 0.00 64.05 59.49 4req n THR 209 Cb 0.53 0.01 0.13 0.00 -2.10 0.00 0.00 70.33 68.90 4req n THR 209 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 4req s TYR 210 N -2.20 2.40 0.02 4.78 -0.85 -1.26 -3.31 117.35 116.94 4req s TYR 210 Ca 0.29 1.23 0.00 0.00 -0.52 0.00 0.00 57.07 58.07 4req s TYR 210 Cb 0.27 -3.16 0.00 0.00 0.38 0.00 0.00 41.96 39.45 4req s TYR 210 CO -0.02 -2.29 0.00 -0.89 -1.52 0.00 0.00 175.55 170.83 4req n ILE 211 N -3.81 0.18 -2.62 -3.49 5.41 -1.26 -4.86 119.36 108.91 4req n ILE 211 Ca 0.07 0.06 -0.28 0.00 1.00 0.00 0.00 62.75 63.60 4req n ILE 211 Cb 0.55 -0.95 -0.01 0.00 -0.71 0.00 0.00 39.64 38.53 4req n ILE 211 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 4req s TYR 212 N -1.17 3.55 0.91 1.39 2.02 -1.26 -0.57 117.35 122.22 4req s TYR 212 Ca 0.00 0.88 -0.11 0.00 -0.37 0.00 0.00 57.07 57.47 4req s TYR 212 Cb 0.00 -2.35 0.14 0.00 -0.40 0.00 0.00 41.96 39.35 4req s TYR 212 CO 0.00 -0.27 1.12 -2.14 -1.57 0.00 0.00 175.55 172.68 4req s PRO 213 N -4.62 1.08 0.13 -1.71 0.02 -1.26 -4.53 135.00 124.11 4req s PRO 213 Ca 0.48 1.33 -0.32 0.00 0.02 0.00 0.00 61.00 62.51 4req s PRO 213 Cb -0.10 -1.75 -0.10 0.00 0.02 0.00 0.00 34.50 32.57 4req s PRO 213 CO 0.43 -2.51 1.53 -1.35 -0.33 0.00 0.00 177.00 174.77 4req h PRO 214 N -1.77 -0.31 -0.20 5.54 0.11 -1.97 -2.08 132.00 131.32 4req h PRO 214 Ca -0.46 0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.70 4req h PRO 214 Cb 1.27 0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.39 4req h PRO 214 CO 0.46 -0.21 -0.46 0.37 -0.21 0.00 0.00 178.00 177.95 4req h GLN 215 N -0.32 -0.41 -0.64 1.05 -0.00 -1.99 0.25 115.11 113.06 4req h GLN 215 Ca 0.08 0.03 0.05 0.00 -0.00 0.00 0.00 58.65 58.82 4req h GLN 215 Cb 0.55 0.09 -0.04 0.00 0.00 0.00 0.00 27.48 28.08 4req h GLN 215 CO -0.64 -0.27 0.42 -1.00 0.00 0.00 0.00 178.83 177.34 4req h PRO 216 N -0.43 0.65 -0.24 -2.39 0.13 -1.93 -0.54 132.00 127.26 4req h PRO 216 Ca 0.04 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 4req h PRO 216 Cb 0.54 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.51 4req h PRO 216 CO -0.42 0.43 0.05 0.77 -0.23 0.00 0.00 178.00 178.60 4req h SER 217 N 0.67 0.37 -0.86 1.44 0.02 -0.60 0.04 113.55 114.63 4req h SER 217 Ca 0.27 -0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 4req h SER 217 Cb 0.22 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 4req h SER 217 CO -0.08 0.52 0.42 0.24 -1.14 0.00 0.00 176.83 176.79 4req h MET 218 N 0.20 1.23 -0.52 3.45 2.86 0.34 -2.43 114.93 120.07 4req h MET 218 Ca 0.07 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.45 4req h MET 218 Cb 0.30 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 4req h MET 218 CO 0.00 0.93 -0.05 -0.09 1.06 0.00 0.00 176.91 178.77 4req h ARG 219 N 1.22 0.91 -0.46 1.72 2.43 -0.79 -2.23 114.38 117.19 4req h ARG 219 Ca 0.30 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 4req h ARG 219 Cb 0.10 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 4req h ARG 219 CO -0.04 0.94 0.24 0.82 -1.51 0.00 0.00 179.97 180.42 4req h ILE 220 N 0.83 1.17 0.42 1.20 2.04 -0.62 -2.26 117.51 120.29 4req h ILE 220 Ca 0.15 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 4req h ILE 220 Cb 0.57 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 4req h ILE 220 CO 0.03 0.19 -0.24 0.40 0.00 0.00 0.00 178.15 178.53 4req h ILE 221 N 0.60 0.50 -0.67 -0.67 2.04 -1.22 -2.58 117.51 115.51 4req h ILE 221 Ca 0.16 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.17 4req h ILE 221 Cb 0.08 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 4req h ILE 221 CO -0.02 0.00 0.46 0.77 0.00 0.00 0.00 178.15 179.36 4req h SER 222 N -0.62 0.24 1.06 1.72 4.64 -1.31 -0.34 113.55 118.94 4req h SER 222 Ca -0.05 0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.19 4req h SER 222 Cb 0.50 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 4req h SER 222 CO 0.06 0.12 -0.46 -0.33 -0.87 0.00 0.00 176.83 175.35 4req h GLU 223 N 0.25 0.00 0.03 4.77 5.08 -1.15 -0.64 114.58 122.92 4req h GLU 223 Ca 0.32 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.53 4req h GLU 223 Cb 0.92 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.18 4req h GLU 223 CO -0.07 0.46 -0.64 0.82 -1.00 0.00 0.00 179.01 178.59 4req h ILE 224 N 0.00 1.45 0.29 3.13 2.04 -0.70 -1.13 117.51 122.58 4req h ILE 224 Ca -0.00 -2.17 0.00 0.00 1.00 0.00 0.00 64.86 63.69 4req h ILE 224 Cb 1.12 2.73 -0.03 0.00 -0.74 0.00 0.00 36.82 39.90 4req h ILE 224 CO 0.06 0.63 -0.39 -0.26 0.00 0.00 0.00 178.15 178.19 4req h PHE 225 N -0.17 -1.08 -0.44 1.37 0.04 -1.21 0.47 116.94 115.93 4req h PHE 225 Ca -0.09 0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.74 4req h PHE 225 Cb 1.37 0.43 -0.04 0.00 2.20 0.00 0.00 35.95 39.92 4req h PHE 225 CO 0.16 -0.52 0.21 0.00 -0.60 0.00 0.00 178.31 177.55 4req h ALA 226 N -0.29 0.54 -0.07 2.45 0.00 -1.16 0.43 119.26 121.16 4req h ALA 226 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 4req h ALA 226 Cb 0.69 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 4req h ALA 226 CO -0.13 -0.15 -0.00 -0.92 0.00 0.00 0.00 179.25 178.04 4req h TYR 227 N 0.42 0.14 -0.12 0.00 3.20 -0.93 -2.82 116.97 116.84 4req h TYR 227 Ca 0.19 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 4req h TYR 227 Cb 0.11 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 4req h TYR 227 CO -0.11 0.41 0.06 1.79 -1.64 0.00 0.00 178.16 178.68 4req h THR 228 N -0.18 1.10 -0.85 1.81 1.35 0.17 0.47 112.91 116.79 4req h THR 228 Ca 0.02 -0.28 0.15 0.00 -0.55 0.00 0.00 66.41 65.75 4req h THR 228 Cb 0.36 1.06 -0.09 0.00 -1.73 0.00 0.00 68.15 67.75 4req h THR 228 CO 0.00 0.09 0.44 -1.28 -0.25 0.00 0.00 175.52 174.52 4req h SER 229 N 0.09 0.53 0.59 5.36 0.87 -0.20 0.49 113.55 121.29 4req h SER 229 Ca 0.04 0.09 -0.28 0.00 -1.23 0.00 0.00 61.79 60.41 4req h SER 229 Cb 0.09 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 4req h SER 229 CO -0.01 0.22 -1.43 0.00 -0.53 0.00 0.00 176.83 175.09 4req h ALA 230 N 1.56 0.37 0.00 6.23 0.00 -1.28 -3.42 119.26 122.71 4req h ALA 230 Ca 0.46 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 54.26 4req h ALA 230 Cb 0.65 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.64 4req h ALA 230 CO -0.36 1.23 -0.37 0.09 0.00 0.00 0.00 179.25 179.84 4req n ASN 231 N -3.36 0.78 -3.47 0.00 3.02 0.14 -4.90 115.26 107.46 4req n ASN 231 Ca -0.12 -0.52 -0.27 0.00 -0.03 0.00 0.00 54.58 53.64 4req n ASN 231 Cb 1.02 1.03 -0.10 0.00 -0.61 0.00 0.00 39.78 41.12 4req n ASN 231 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 4req s MET 232 N -1.57 1.12 0.54 3.52 -1.94 0.15 -2.81 119.30 118.31 4req s MET 232 Ca 0.01 -2.26 0.31 0.00 -1.71 0.00 0.00 55.69 52.04 4req s MET 232 Cb 0.03 -1.71 1.49 0.00 2.01 0.00 0.00 34.83 36.65 4req s MET 232 CO 0.19 -1.37 2.05 -1.00 -0.01 0.00 0.00 175.02 174.89 4req h PRO 233 N 5.66 0.00 -0.02 2.03 0.13 -1.80 -2.79 132.00 135.21 4req h PRO 233 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 4req h PRO 233 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 4req h PRO 233 CO 0.42 0.09 -0.25 1.63 -0.23 0.00 0.00 178.00 179.66 4req n LYS 234 N -3.35 1.41 -2.97 0.86 5.02 -1.26 -4.93 118.16 112.94 4req n LYS 234 Ca -0.01 -1.05 -0.41 0.00 -2.02 0.00 0.00 58.31 54.82 4req n LYS 234 Cb 0.26 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 4req n LYS 234 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 4req s TRP 235 N -2.31 3.45 -0.29 2.13 -0.11 -1.05 -3.43 118.94 117.33 4req s TRP 235 Ca 0.25 1.19 -0.28 0.00 1.22 0.00 0.00 56.10 58.48 4req s TRP 235 Cb 0.19 -2.92 0.01 0.00 -1.50 0.00 0.00 33.47 29.25 4req s TRP 235 CO 0.47 -0.14 1.02 -0.80 -4.62 0.00 0.00 176.95 172.87 4req s ASN 236 N 1.08 6.93 0.05 5.86 0.01 0.15 -4.85 114.94 124.17 4req s ASN 236 Ca 0.36 1.07 0.27 0.00 -0.71 0.00 0.00 52.86 53.86 4req s ASN 236 Cb -0.17 -2.52 0.91 0.00 0.41 0.00 0.00 41.25 39.89 4req s ASN 236 CO 0.14 -0.78 1.73 -1.54 -1.51 0.00 0.00 177.10 175.14 4req n SER 237 N 6.61 0.33 -3.58 -1.22 3.41 -0.55 -2.36 113.62 116.26 4req n SER 237 Ca 0.11 0.32 -0.16 0.00 -0.26 0.00 0.00 58.87 58.87 4req n SER 237 Cb 0.47 -0.33 -0.06 0.00 -0.26 0.00 0.00 64.21 64.03 4req n SER 237 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 4req s ILE 238 N -3.04 0.02 -0.59 -1.33 2.07 -1.22 -4.65 121.20 112.46 4req s ILE 238 Ca 0.12 -0.15 0.04 0.00 -1.41 0.00 0.00 60.65 59.26 4req s ILE 238 Cb 0.17 -0.92 0.16 0.00 0.13 0.00 0.00 42.46 42.00 4req s ILE 238 CO 0.60 -0.08 0.41 -0.55 -1.91 0.00 0.00 174.94 173.41 4req s SER 239 N -1.42 3.89 -0.41 4.50 0.15 -0.48 -1.22 113.70 118.70 4req s SER 239 Ca -0.10 -3.46 -0.28 0.00 0.70 0.00 0.00 55.95 52.81 4req s SER 239 Cb -0.01 -1.30 -0.02 0.00 -1.71 0.00 0.00 66.02 62.98 4req s SER 239 CO 0.06 -0.14 1.84 -0.63 1.20 0.00 0.00 173.24 175.57 4req s ILE 240 N -0.80 3.42 0.07 6.45 1.01 0.55 -4.62 121.20 127.28 4req s ILE 240 Ca 0.25 0.39 0.04 0.00 0.00 0.00 0.00 60.65 61.33 4req s ILE 240 Cb -0.07 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 4req s ILE 240 CO -0.14 -0.53 0.01 -0.44 0.00 0.00 0.00 174.94 173.84 4req s SER 241 N 6.92 5.12 -0.01 3.58 0.01 -1.26 -1.97 113.70 126.09 4req s SER 241 Ca 0.77 -0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.94 4req s SER 241 Cb -0.19 -1.27 -0.04 0.00 0.21 0.00 0.00 66.02 64.73 4req s SER 241 CO 0.30 0.20 0.06 0.61 0.41 0.00 0.00 173.24 174.81 4req n GLY 242 N 0.74 -0.13 0.36 3.44 0.00 0.14 -4.71 105.19 105.03 4req n GLY 242 Ca -0.11 -0.06 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 4req n GLY 242 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 4req h TYR 243 N 0.00 -1.03 -0.88 1.61 3.20 -1.61 -1.88 116.97 116.37 4req h TYR 243 Ca -0.01 0.08 0.06 0.00 3.14 0.00 0.00 58.73 62.00 4req h TYR 243 Cb 0.23 0.54 -0.06 0.00 1.54 0.00 0.00 36.73 38.98 4req h TYR 243 CO 0.00 -0.39 0.58 0.45 -1.64 0.00 0.00 178.16 177.15 4req h HIS 244 N -0.17 1.03 -0.43 -3.82 -0.00 -1.89 0.02 115.15 109.89 4req h HIS 244 Ca 0.22 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.55 4req h HIS 244 Cb 0.56 -0.34 -0.02 0.00 -0.00 0.00 0.00 27.41 27.61 4req h HIS 244 CO -0.67 0.56 -0.00 0.52 -0.00 0.00 0.00 177.93 178.34 4req h MET 245 N 1.03 0.75 -0.28 2.45 2.86 -1.72 0.02 114.93 120.04 4req h MET 245 Ca 0.37 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 4req h MET 245 Cb 0.15 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 4req h MET 245 CO -0.13 0.83 0.04 0.37 1.06 0.00 0.00 176.91 179.08 4req h GLN 246 N 0.59 0.47 -0.15 1.72 4.15 -0.52 0.12 115.11 121.48 4req h GLN 246 Ca 0.12 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 4req h GLN 246 Cb 0.49 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 4req h GLN 246 CO 0.02 0.59 0.09 0.93 -1.93 0.00 0.00 178.83 178.53 4req h GLU 247 N 0.28 0.20 0.00 1.69 4.39 -0.70 -1.80 114.58 118.64 4req h GLU 247 Ca 0.08 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.77 4req h GLU 247 Cb 0.35 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 4req h GLU 247 CO 0.01 0.15 0.00 0.00 -1.16 0.00 0.00 179.01 178.00 4req h ALA 248 N 1.89 1.00 0.00 3.43 0.00 -0.88 -3.47 119.26 121.23 4req h ALA 248 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 4req h ALA 248 Cb -0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 4req h ALA 248 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 4req n GLY 249 N 0.91 0.23 3.75 0.00 0.00 -0.68 -4.58 105.19 104.82 4req n GLY 249 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 4req n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4req s ALA 250 N -1.19 2.70 0.62 4.61 0.00 0.38 -4.21 121.76 124.68 4req s ALA 250 Ca 0.00 1.28 -0.10 0.00 0.00 0.00 0.00 51.96 53.14 4req s ALA 250 Cb 0.00 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 4req s ALA 250 CO 0.00 -1.40 1.00 0.95 0.00 0.00 0.00 175.76 176.31 4req s THR 251 N -1.35 4.18 0.25 0.00 -4.23 -1.26 -4.53 115.64 108.70 4req s THR 251 Ca 0.74 0.53 -0.04 0.00 -1.18 0.00 0.00 61.69 61.74 4req s THR 251 Cb -0.39 -3.68 0.22 0.00 1.34 0.00 0.00 72.50 69.99 4req s THR 251 CO 0.45 -0.84 1.74 0.00 -0.54 0.00 0.00 174.62 175.43 4req h ALA 252 N -0.33 1.10 -0.81 3.99 0.00 -1.95 -0.83 119.26 120.43 4req h ALA 252 Ca -0.45 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 4req h ALA 252 Cb 1.22 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 4req h ALA 252 CO 0.62 -0.16 0.45 0.38 0.00 0.00 0.00 179.25 180.54 4req h ASP 253 N 0.50 1.01 -0.11 0.00 2.03 -1.93 -2.16 116.42 115.76 4req h ASP 253 Ca 0.42 -0.10 -0.08 0.00 -0.73 0.00 0.00 57.03 56.54 4req h ASP 253 Cb 0.60 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.84 4req h ASP 253 CO -0.37 0.81 -0.24 0.40 -1.03 0.00 0.00 179.24 178.81 4req h ILE 254 N 1.12 1.38 -0.46 4.15 1.08 -1.86 -2.10 117.51 120.83 4req h ILE 254 Ca 0.29 -1.53 0.04 0.00 -0.39 0.00 0.00 64.86 63.27 4req h ILE 254 Cb 0.03 2.10 -0.04 0.00 -3.07 0.00 0.00 36.82 35.83 4req h ILE 254 CO -0.05 0.44 0.21 -0.08 -0.69 0.00 0.00 178.15 177.99 4req h GLU 255 N -0.07 0.41 0.18 2.37 4.81 -1.05 -0.58 114.58 120.66 4req h GLU 255 Ca 0.00 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 4req h GLU 255 Cb 0.83 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.12 4req h GLU 255 CO 0.05 0.27 -0.09 0.52 -0.73 0.00 0.00 179.01 179.04 4req h MET 256 N 0.42 -0.24 0.05 1.92 2.86 -1.40 -2.47 114.93 116.07 4req h MET 256 Ca 0.21 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.89 4req h MET 256 Cb 0.14 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 4req h MET 256 CO -0.16 0.02 -0.26 0.00 1.06 0.00 0.00 176.91 177.57 4req h ALA 257 N 0.29 -0.39 -0.63 6.32 0.00 -1.21 -0.49 119.26 123.14 4req h ALA 257 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 4req h ALA 257 Cb 0.37 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 4req h ALA 257 CO 0.04 -0.78 0.29 1.88 0.00 0.00 0.00 179.25 180.68 4req h TYR 258 N -0.43 0.93 -0.34 0.00 0.05 -1.20 0.22 116.97 116.20 4req h TYR 258 Ca 0.05 -0.05 -0.08 0.00 0.05 0.00 0.00 58.73 58.70 4req h TYR 258 Cb 0.49 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 4req h TYR 258 CO -0.27 0.71 -0.10 1.15 -1.05 0.00 0.00 178.16 178.61 4req h THR 259 N 0.88 1.28 -0.40 -2.88 2.02 -1.21 0.26 112.91 112.86 4req h THR 259 Ca 0.22 -1.16 -0.06 0.00 0.77 0.00 0.00 66.41 66.17 4req h THR 259 Cb 0.15 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 4req h THR 259 CO -0.02 0.38 0.02 -0.07 0.37 0.00 0.00 175.52 176.19 4req h LEU 260 N 0.44 0.68 -0.69 2.58 3.38 -0.95 -0.42 115.31 120.33 4req h LEU 260 Ca 0.08 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 4req h LEU 260 Cb 0.60 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 4req h LEU 260 CO 0.04 0.81 -0.00 0.00 0.09 0.00 0.00 178.44 179.37 4req h ALA 261 N 0.90 0.90 -0.41 1.53 0.00 -0.56 -0.42 119.26 121.19 4req h ALA 261 Ca 0.12 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.76 4req h ALA 261 Cb 0.45 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 4req h ALA 261 CO 0.02 0.65 0.18 -0.44 0.00 0.00 0.00 179.25 179.66 4req h ASP 262 N 0.92 0.24 -0.93 0.00 3.32 -0.14 -1.80 116.42 118.03 4req h ASP 262 Ca 0.17 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.33 4req h ASP 262 Cb 0.54 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.02 4req h ASP 262 CO 0.03 0.18 0.60 1.23 -1.72 0.00 0.00 179.24 179.56 4req h GLY 263 N 0.37 1.39 0.68 2.75 0.00 -0.09 -1.61 103.07 106.57 4req h GLY 263 Ca 0.18 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.12 4req h GLY 263 CO -0.15 0.27 -0.07 -2.08 0.00 0.00 0.00 176.54 174.50 4req h VAL 264 N 1.02 0.78 -0.68 4.60 2.07 -0.25 -1.08 116.25 122.71 4req h VAL 264 Ca 0.42 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.95 4req h VAL 264 Cb 0.28 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 4req h VAL 264 CO -0.17 0.00 0.44 0.44 0.02 0.00 0.00 177.57 178.30 4req h ASP 265 N -0.08 0.76 -0.66 0.57 5.19 -1.05 -1.57 116.42 119.58 4req h ASP 265 Ca 0.06 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.40 4req h ASP 265 Cb 0.17 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.47 4req h ASP 265 CO -0.15 0.54 0.20 1.88 -3.12 0.00 0.00 179.24 178.60 4req h TYR 266 N 0.90 1.08 -0.17 4.55 0.05 -0.77 0.38 116.97 122.98 4req h TYR 266 Ca 0.26 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.92 4req h TYR 266 Cb -0.07 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.34 4req h TYR 266 CO -0.03 0.87 0.07 0.82 -1.05 0.00 0.00 178.16 178.83 4req h ILE 267 N 1.01 1.16 -0.50 -2.88 2.04 -0.55 -1.79 117.51 116.00 4req h ILE 267 Ca 0.22 -0.48 0.08 0.00 1.00 0.00 0.00 64.86 65.68 4req h ILE 267 Cb 0.30 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.47 4req h ILE 267 CO -0.01 0.15 0.13 0.03 0.00 0.00 0.00 178.15 178.45 4req h ARG 268 N 0.12 0.27 -0.91 2.37 3.08 -1.05 -0.40 114.38 117.86 4req h ARG 268 Ca 0.06 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.11 4req h ARG 268 Cb 0.18 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 4req h ARG 268 CO -0.00 0.18 0.60 0.00 -1.07 0.00 0.00 179.97 179.67 4req h ALA 269 N 1.37 1.38 -0.38 0.04 0.00 -0.57 -0.51 119.26 120.59 4req h ALA 269 Ca 0.25 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 4req h ALA 269 Cb 0.31 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 4req h ALA 269 CO -0.30 0.56 -0.25 0.78 0.00 0.00 0.00 179.25 180.04 4req h GLY 270 N 1.20 0.92 0.94 0.00 0.00 -0.41 -3.15 103.07 102.57 4req h GLY 270 Ca 0.34 -0.87 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 4req h GLY 270 CO -0.08 0.79 0.04 0.83 0.00 0.00 0.00 176.54 178.11 4req h GLU 271 N 0.65 0.09 0.00 4.80 5.08 -0.73 -2.24 114.58 122.23 4req h GLU 271 Ca 0.08 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 4req h GLU 271 Cb 0.82 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.05 4req h GLU 271 CO 0.07 0.12 0.30 0.66 -1.00 0.00 0.00 179.01 179.16 4req h SER 272 N 0.03 0.00 -0.57 1.42 4.64 -1.05 -0.15 113.55 117.87 4req h SER 272 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 4req h SER 272 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 4req h SER 272 CO -0.00 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.29 4req n VAL 273 N -2.56 1.15 -0.58 0.95 0.24 -1.17 -4.95 118.33 111.40 4req n VAL 273 Ca -0.02 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.23 4req n VAL 273 Cb 0.34 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 33.14 4req n VAL 273 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 4req n GLY 274 N 1.09 0.82 3.78 7.63 0.00 -0.07 -4.89 105.19 113.55 4req n GLY 274 Ca 0.20 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 4req n GLY 274 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4req s LEU 275 N 0.00 4.30 0.57 0.99 1.43 -0.85 -5.02 118.68 120.10 4req s LEU 275 Ca 0.00 0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 53.39 4req s LEU 275 Cb 0.00 -2.23 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 4req s LEU 275 CO 0.00 0.24 1.10 0.21 0.23 0.00 0.00 176.35 178.13 4req s ASN 276 N -0.17 5.70 0.24 2.29 3.84 -1.26 -3.97 114.94 121.61 4req s ASN 276 Ca 0.15 2.05 -0.04 0.00 0.21 0.00 0.00 52.86 55.23 4req s ASN 276 Cb -0.13 -2.56 0.41 0.00 -0.55 0.00 0.00 41.25 38.42 4req s ASN 276 CO 0.03 -1.23 1.79 1.62 -2.79 0.00 0.00 177.10 176.53 4req h VAL 277 N 0.91 0.85 0.00 -5.21 3.04 -1.95 -1.96 116.25 111.93 4req h VAL 277 Ca -0.49 -0.24 0.00 0.00 -1.01 0.00 0.00 66.70 64.96 4req h VAL 277 Cb 1.25 0.08 0.00 0.00 -2.01 0.00 0.00 31.29 30.61 4req h VAL 277 CO 0.57 0.13 0.00 0.47 -1.01 0.00 0.00 177.57 177.73 4req n ASP 278 N -4.80 0.00 0.07 3.17 8.00 -1.26 -0.86 116.55 120.87 4req n ASP 278 Ca 0.14 0.48 0.13 0.00 0.71 0.00 0.00 54.79 56.25 4req n ASP 278 Cb 0.31 -0.49 0.35 0.00 -0.02 0.00 0.00 41.12 41.27 4req n ASP 278 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4req n GLN 279 N -1.49 0.22 0.00 -1.24 6.02 -0.74 -4.48 117.38 115.68 4req n GLN 279 Ca 0.03 0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 4req n GLN 279 Cb 0.12 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 29.67 4req n GLN 279 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 177.06 178.02 4req n PHE 280 N -2.06 0.00 -0.11 1.08 -1.74 -1.11 -4.65 117.46 108.87 4req n PHE 280 Ca 0.05 0.00 -0.05 0.00 -0.56 0.00 0.00 57.45 56.89 4req n PHE 280 Cb 0.41 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.44 4req n PHE 280 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 4req h ALA 281 N 0.00 0.38 0.00 1.98 0.00 -1.22 -2.21 119.26 118.19 4req h ALA 281 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 4req h ALA 281 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 4req h ALA 281 CO 0.00 -0.35 0.23 -1.35 0.00 0.00 0.00 179.25 177.78 4req h PRO 282 N 0.17 0.00 -0.55 0.00 0.11 -1.80 -1.70 132.00 128.22 4req h PRO 282 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 4req h PRO 282 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 4req h PRO 282 CO -0.25 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.08 4req n ARG 283 N -2.94 2.71 -2.95 1.05 5.12 -0.84 -4.91 116.66 113.90 4req n ARG 283 Ca -0.02 -2.38 -0.40 0.00 -1.93 0.00 0.00 57.85 53.11 4req n ARG 283 Cb 0.28 -1.45 -0.05 0.00 -1.16 0.00 0.00 32.46 30.08 4req n ARG 283 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 4req s LEU 284 N -1.04 4.39 0.22 0.55 1.43 -0.64 -1.48 118.68 122.11 4req s LEU 284 Ca 0.38 1.41 0.06 0.00 -1.03 0.00 0.00 54.13 54.95 4req s LEU 284 Cb 0.20 -3.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.12 4req s LEU 284 CO 0.27 -0.08 -0.07 -0.94 0.23 0.00 0.00 176.35 175.75 4req s SER 285 N 0.43 2.30 0.45 2.29 1.04 -0.36 -4.63 113.70 115.21 4req s SER 285 Ca 0.41 -1.12 0.05 0.00 0.48 0.00 0.00 55.95 55.77 4req s SER 285 Cb -0.20 -0.08 -0.05 0.00 0.10 0.00 0.00 66.02 65.79 4req s SER 285 CO 0.22 -0.34 0.08 -0.36 0.98 0.00 0.00 173.24 173.82 4req s PHE 286 N -3.17 2.31 -0.28 5.02 0.40 -0.04 -0.33 117.98 121.90 4req s PHE 286 Ca 0.25 -0.73 -0.02 0.00 -0.60 0.00 0.00 56.93 55.83 4req s PHE 286 Cb 0.03 -1.79 0.17 0.00 0.51 0.00 0.00 43.02 41.93 4req s PHE 286 CO 0.08 0.27 0.50 0.12 0.70 0.00 0.00 175.22 176.88 4req s PHE 287 N -2.73 -1.27 0.15 0.36 5.36 -0.83 -1.04 117.98 117.97 4req s PHE 287 Ca 0.29 1.31 0.04 0.00 -0.96 0.00 0.00 56.93 57.60 4req s PHE 287 Cb 0.06 0.32 -0.04 0.00 -0.34 0.00 0.00 43.02 43.02 4req s PHE 287 CO 0.15 -0.82 0.17 -1.58 -1.46 0.00 0.00 175.22 171.69 4req s TRP 288 N 2.72 3.26 0.22 10.12 0.52 -0.70 0.23 118.94 135.31 4req s TRP 288 Ca 0.17 0.04 -0.06 0.00 0.02 0.00 0.00 56.10 56.28 4req s TRP 288 Cb -0.15 -1.58 -0.06 0.00 -1.15 0.00 0.00 33.47 30.53 4req s TRP 288 CO -0.19 0.52 0.48 0.20 0.02 0.00 0.00 176.95 177.98 4req s GLY 289 N -3.03 2.08 -0.29 0.98 0.00 -1.26 -2.05 107.32 103.75 4req s GLY 289 Ca 0.32 -0.51 -0.01 0.00 0.00 0.00 0.00 44.72 44.52 4req s GLY 289 CO 0.25 -0.41 0.08 -0.42 0.00 0.00 0.00 173.10 172.60 4req s ILE 290 N -1.86 0.87 0.00 0.90 -1.09 -0.42 -4.85 121.20 114.75 4req s ILE 290 Ca 0.43 -1.27 0.00 0.00 -2.23 0.00 0.00 60.65 57.58 4req s ILE 290 Cb -0.11 -1.59 0.00 0.00 -1.58 0.00 0.00 42.46 39.18 4req s ILE 290 CO 0.26 -0.58 0.00 0.61 -1.23 0.00 0.00 174.94 174.00 4req n GLY 291 N 4.86 0.22 0.29 6.18 0.00 -1.26 -0.77 105.19 114.71 4req n GLY 291 Ca -0.04 -1.86 0.18 0.00 0.00 0.00 0.00 46.02 44.31 4req n GLY 291 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 4req h MET 292 N 0.00 0.00 -5.89 1.61 2.86 -1.95 -3.40 114.93 108.16 4req h MET 292 Ca 0.00 0.00 -0.66 0.00 -2.06 0.00 0.00 59.70 56.98 4req h MET 292 Cb 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.57 4req h MET 292 CO 0.00 0.00 2.05 1.21 1.06 0.00 0.00 176.91 181.23 4req s ASN 293 N -5.56 6.77 0.15 1.22 3.84 -1.26 -4.89 114.94 115.21 4req s ASN 293 Ca 0.00 -2.26 -0.31 0.00 0.21 0.00 0.00 52.86 50.50 4req s ASN 293 Cb 0.10 -2.57 -0.08 0.00 -0.55 0.00 0.00 41.25 38.14 4req s ASN 293 CO 0.51 -1.23 1.53 0.15 -2.79 0.00 0.00 177.10 175.28 4req h PHE 294 N 8.01 -1.82 -0.78 0.43 3.04 -1.94 -1.41 116.94 122.47 4req h PHE 294 Ca 0.40 0.11 -0.05 0.00 3.98 0.00 0.00 57.97 62.41 4req h PHE 294 Cb 0.90 0.90 -0.03 0.00 2.56 0.00 0.00 35.95 40.27 4req h PHE 294 CO 1.39 -0.40 0.30 0.74 -2.02 0.00 0.00 178.31 178.33 4req h PHE 295 N -0.11 1.20 -0.50 0.41 0.04 -1.97 -1.90 116.94 114.12 4req h PHE 295 Ca 0.13 -0.09 -0.07 0.00 2.80 0.00 0.00 57.97 60.73 4req h PHE 295 Cb 0.45 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 4req h PHE 295 CO -0.94 0.91 0.01 1.98 -0.60 0.00 0.00 178.31 179.67 4req h MET 296 N 1.14 0.82 -0.44 1.51 4.05 -1.89 -2.15 114.93 117.99 4req h MET 296 Ca 0.26 -0.22 -0.10 0.00 -0.28 0.00 0.00 59.70 59.36 4req h MET 296 Cb 0.23 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 4req h MET 296 CO -0.02 0.82 -0.10 0.93 0.23 0.00 0.00 176.91 178.77 4req h GLU 297 N 0.77 0.84 0.04 0.39 4.39 -0.85 0.14 114.58 120.31 4req h GLU 297 Ca 0.15 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.53 4req h GLU 297 Cb 0.45 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 4req h GLU 297 CO 0.02 0.95 -0.04 0.28 -1.16 0.00 0.00 179.01 179.06 4req h VAL 298 N 0.67 0.92 -0.64 3.13 2.07 -1.25 -2.67 116.25 118.48 4req h VAL 298 Ca 0.11 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 4req h VAL 298 Cb 0.63 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 4req h VAL 298 CO 0.04 0.00 0.38 0.00 0.02 0.00 0.00 177.57 178.01 4req h ALA 299 N 0.87 0.82 -0.35 1.67 0.00 -1.28 -2.83 119.26 118.16 4req h ALA 299 Ca 0.00 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.90 4req h ALA 299 Cb 0.08 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 17.54 4req h ALA 299 CO -0.01 0.31 -0.16 -0.22 0.00 0.00 0.00 179.25 179.18 4req h LYS 300 N 0.87 -0.09 -0.97 0.00 3.64 -0.46 0.34 116.57 119.90 4req h LYS 300 Ca 0.23 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 4req h LYS 300 Cb -0.00 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 4req h LYS 300 CO -0.04 -0.06 0.61 -0.07 -2.27 0.00 0.00 179.45 177.62 4req h LEU 301 N -0.10 1.14 -0.10 5.20 4.07 -1.32 0.24 115.31 124.44 4req h LEU 301 Ca 0.17 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 58.01 4req h LEU 301 Cb 0.36 -0.29 0.00 0.00 1.08 0.00 0.00 40.66 41.81 4req h LEU 301 CO -0.41 0.86 -0.21 0.03 -1.08 0.00 0.00 178.44 177.63 4req h ARG 302 N 1.33 0.32 -0.22 1.13 3.08 -1.14 -2.53 114.38 116.34 4req h ARG 302 Ca 0.35 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 4req h ARG 302 Cb -0.10 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 4req h ARG 302 CO -0.07 0.81 0.11 0.00 -1.07 0.00 0.00 179.97 179.75 4req h ALA 303 N 0.51 0.29 -0.84 0.04 0.00 -0.17 -2.71 119.26 116.37 4req h ALA 303 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.89 4req h ALA 303 Cb 0.80 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 4req h ALA 303 CO 0.05 -0.15 0.52 0.00 0.00 0.00 0.00 179.25 179.66 4req h ALA 304 N 0.97 1.16 -0.70 0.00 0.00 -0.57 -1.49 119.26 118.64 4req h ALA 304 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 4req h ALA 304 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 4req h ALA 304 CO -0.01 0.25 0.45 0.00 0.00 0.00 0.00 179.25 179.94 4req h ARG 305 N 0.94 0.94 -0.48 0.00 3.08 -1.13 -2.52 114.38 115.22 4req h ARG 305 Ca 0.37 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 4req h ARG 305 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 4req h ARG 305 CO -0.18 0.64 0.14 0.52 -1.07 0.00 0.00 179.97 180.03 4req h MET 306 N 0.96 0.75 -0.76 0.04 2.86 -1.25 -2.67 114.93 114.85 4req h MET 306 Ca 0.26 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 4req h MET 306 Cb -0.08 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.44 4req h MET 306 CO -0.05 0.71 0.45 -0.07 1.06 0.00 0.00 176.91 179.01 4req h LEU 307 N 0.64 0.91 -0.42 1.22 3.38 -1.06 -1.49 115.31 118.49 4req h LEU 307 Ca 0.15 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 4req h LEU 307 Cb 0.28 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 4req h LEU 307 CO -0.00 0.70 -0.27 -0.25 0.09 0.00 0.00 178.44 178.70 4req h TRP 308 N 1.04 1.08 0.14 1.13 -0.00 -1.44 -0.59 115.95 117.31 4req h TRP 308 Ca 0.27 -0.29 -0.01 0.00 -0.00 0.00 0.00 58.89 58.87 4req h TRP 308 Cb -0.04 -0.24 0.00 0.00 -0.00 0.00 0.00 29.16 28.88 4req h TRP 308 CO 0.00 1.10 -0.07 0.00 -0.00 0.00 0.00 178.44 179.48 4req h ALA 309 N 0.81 -0.18 -0.28 2.65 0.00 -1.10 0.26 119.26 121.42 4req h ALA 309 Ca 0.08 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.94 4req h ALA 309 Cb 0.85 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 4req h ALA 309 CO 0.08 -0.51 -0.34 -0.22 0.00 0.00 0.00 179.25 178.25 4req h LYS 310 N -0.37 -0.32 -0.53 0.00 3.64 -1.20 1.00 116.57 118.79 4req h LYS 310 Ca -0.02 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 4req h LYS 310 Cb 0.29 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 4req h LYS 310 CO 0.03 -0.21 0.30 -0.07 -2.27 0.00 0.00 179.45 177.23 4req h LEU 311 N -0.33 0.66 -0.62 5.20 3.38 -1.03 -2.94 115.31 119.62 4req h LEU 311 Ca 0.13 -0.08 -0.15 0.00 0.09 0.00 0.00 57.88 57.87 4req h LEU 311 Cb 0.55 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 4req h LEU 311 CO -0.47 0.55 -0.57 0.58 0.09 0.00 0.00 178.44 178.62 4req h VAL 312 N 0.71 1.35 -0.99 1.22 2.07 -0.03 -3.19 116.25 117.39 4req h VAL 312 Ca 0.19 -1.87 0.16 0.00 0.82 0.00 0.00 66.70 66.00 4req h VAL 312 Cb 0.03 1.89 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 4req h VAL 312 CO -0.03 0.56 0.62 -0.74 0.02 0.00 0.00 177.57 178.00 4req h HIS 313 N 0.28 1.06 0.00 1.57 6.17 -0.63 -2.62 115.15 120.99 4req h HIS 313 Ca 0.00 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.11 4req h HIS 313 Cb 1.08 -0.33 0.00 0.00 2.52 0.00 0.00 27.41 30.68 4req h HIS 313 CO 0.03 0.32 0.34 1.96 0.71 0.00 0.00 177.93 181.30 4req h GLN 314 N 0.84 0.00 -0.01 5.26 4.20 -1.59 -1.30 115.11 122.51 4req h GLN 314 Ca 0.53 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.24 4req h GLN 314 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 4req h GLN 314 CO -0.31 0.00 -0.26 1.19 -0.67 0.00 0.00 178.83 178.78 4req n PHE 315 N -2.83 0.00 -3.03 2.96 3.72 -0.99 -4.98 117.46 112.30 4req n PHE 315 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.25 4req n PHE 315 Cb 0.39 -0.13 0.06 0.00 -0.94 0.00 0.00 39.48 38.86 4req n PHE 315 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 4req n GLY 316 N 1.34 -0.92 3.75 1.37 0.00 -0.49 -4.86 105.19 105.37 4req n GLY 316 Ca 0.12 0.48 -0.41 0.00 0.00 0.00 0.00 46.02 46.21 4req n GLY 316 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 4req s PRO 317 N -4.19 4.42 0.02 1.61 0.04 -1.26 -4.93 135.00 130.71 4req s PRO 317 Ca 0.40 2.06 0.22 0.00 0.04 0.00 0.00 61.00 63.71 4req s PRO 317 Cb -0.05 -3.16 -0.22 0.00 0.04 0.00 0.00 34.50 31.10 4req s PRO 317 CO 0.65 -0.17 0.68 1.63 0.04 0.00 0.00 177.00 179.84 4req n LYS 318 N 1.93 0.55 -3.79 4.56 4.01 -1.26 -4.85 118.16 119.31 4req n LYS 318 Ca 0.03 -0.10 -0.36 0.00 -0.51 0.00 0.00 58.31 57.37 4req n LYS 318 Cb 0.43 -1.58 -0.10 0.00 -0.51 0.00 0.00 35.03 33.26 4req n LYS 318 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 4req s ASN 319 N -4.47 5.73 0.39 4.39 3.84 -1.26 -5.00 114.94 118.56 4req s ASN 319 Ca -0.04 0.02 0.08 0.00 0.21 0.00 0.00 52.86 53.14 4req s ASN 319 Cb 0.13 -2.02 0.79 0.00 -0.55 0.00 0.00 41.25 39.60 4req s ASN 319 CO 0.87 0.07 1.95 1.55 -2.79 0.00 0.00 177.10 178.75 4req h PRO 320 N 7.48 0.34 -0.48 0.43 0.13 -2.02 -2.42 132.00 135.46 4req h PRO 320 Ca -0.37 -0.06 0.05 0.00 -0.87 0.00 0.00 66.00 64.75 4req h PRO 320 Cb 1.17 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 4req h PRO 320 CO 0.64 0.39 0.32 0.87 -0.23 0.00 0.00 178.00 179.99 4req h LYS 321 N 0.33 0.42 -0.80 0.86 1.57 -1.96 -2.79 116.57 114.20 4req h LYS 321 Ca 0.07 -0.03 0.17 0.00 -1.87 0.00 0.00 60.65 59.00 4req h LYS 321 Cb 0.26 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 4req h LYS 321 CO 0.01 0.28 0.54 0.77 -0.57 0.00 0.00 179.45 180.48 4req h SER 322 N 0.43 0.36 0.05 0.86 0.02 -1.71 -1.46 113.55 112.10 4req h SER 322 Ca 0.21 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 4req h SER 322 Cb 0.26 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.76 4req h SER 322 CO -0.05 0.17 -0.14 0.23 -1.14 0.00 0.00 176.83 175.89 4req n MET 323 N -4.47 1.51 -2.96 3.45 2.81 -1.05 -4.57 117.12 111.83 4req n MET 323 Ca 0.16 -1.05 -0.40 0.00 -1.81 0.00 0.00 57.70 54.60 4req n MET 323 Cb 0.62 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.60 4req n MET 323 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 4req s SER 324 N -2.21 7.05 -0.58 7.83 1.04 -0.55 -3.60 113.70 122.67 4req s SER 324 Ca 0.29 1.27 -0.21 0.00 0.48 0.00 0.00 55.95 57.78 4req s SER 324 Cb 0.20 -2.45 0.07 0.00 0.10 0.00 0.00 66.02 63.94 4req s SER 324 CO 0.42 -0.18 0.83 -0.22 0.98 0.00 0.00 173.24 175.07 4req s LEU 325 N 1.03 4.63 -0.26 2.42 0.20 -1.26 -4.98 118.68 120.45 4req s LEU 325 Ca 0.40 -0.89 -0.10 0.00 0.69 0.00 0.00 54.13 54.23 4req s LEU 325 Cb -0.18 -2.50 -0.05 0.00 -0.43 0.00 0.00 46.19 43.03 4req s LEU 325 CO 0.19 -1.20 0.16 -0.13 -0.29 0.00 0.00 176.35 175.08 4req s ARG 326 N 3.45 3.91 0.13 1.98 0.52 -1.26 -4.71 118.95 122.97 4req s ARG 326 Ca 0.21 -0.35 0.08 0.00 -0.52 0.00 0.00 55.73 55.15 4req s ARG 326 Cb -0.18 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.70 4req s ARG 326 CO 0.12 -0.13 -0.18 -0.08 0.02 0.00 0.00 175.30 175.05 4req s THR 327 N 1.58 1.67 0.11 0.02 -1.32 -1.26 -0.86 115.64 115.57 4req s THR 327 Ca 0.07 -1.71 0.02 0.00 -1.21 0.00 0.00 61.69 58.86 4req s THR 327 Cb -0.15 -1.64 -0.04 0.00 -1.51 0.00 0.00 72.50 69.15 4req s THR 327 CO 0.08 -0.23 0.18 -2.28 -2.21 0.00 0.00 174.62 170.17 4req s HIS 328 N -1.69 3.35 0.04 9.09 2.46 -0.21 0.28 115.29 128.62 4req s HIS 328 Ca 0.10 0.12 0.01 0.00 0.47 0.00 0.00 55.06 55.76 4req s HIS 328 Cb -0.07 -1.65 -0.02 0.00 -0.13 0.00 0.00 32.58 30.70 4req s HIS 328 CO 0.05 0.54 -0.06 -1.12 -2.47 0.00 0.00 174.74 171.68 4req s SER 329 N -2.81 0.61 -0.03 9.88 0.01 -0.62 -1.72 113.70 119.04 4req s SER 329 Ca 0.33 -0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.04 4req s SER 329 Cb -0.12 0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.20 4req s SER 329 CO 0.26 -0.26 0.00 -1.58 0.41 0.00 0.00 173.24 172.07 4req s GLN 330 N -1.65 0.25 0.51 12.44 0.74 -0.87 -1.50 119.66 129.58 4req s GLN 330 Ca -0.11 0.07 -0.23 0.00 0.05 0.00 0.00 55.36 55.14 4req s GLN 330 Cb -0.09 -0.42 -0.06 0.00 1.10 0.00 0.00 33.01 33.54 4req s GLN 330 CO -0.01 -0.12 1.34 0.95 -0.55 0.00 0.00 175.29 176.90 4req s THR 331 N 0.91 2.26 -0.19 -0.34 -4.23 -1.01 -1.30 115.64 111.73 4req s THR 331 Ca -0.09 0.20 -0.29 0.00 -1.18 0.00 0.00 61.69 60.33 4req s THR 331 Cb -0.12 -3.11 -0.03 0.00 1.34 0.00 0.00 72.50 70.58 4req s THR 331 CO -0.02 0.00 1.59 -0.55 -0.54 0.00 0.00 174.62 175.11 4req s SER 332 N -0.93 6.47 0.24 3.99 0.15 0.05 -4.73 113.70 118.94 4req s SER 332 Ca 0.68 1.70 -0.02 0.00 0.70 0.00 0.00 55.95 59.01 4req s SER 332 Cb -0.39 -2.53 0.26 0.00 -1.71 0.00 0.00 66.02 61.65 4req s SER 332 CO 0.47 -1.17 1.67 1.23 1.20 0.00 0.00 173.24 176.64 4req h GLY 333 N 11.33 0.77 0.57 9.45 0.00 -1.91 -2.95 103.07 120.33 4req h GLY 333 Ca -0.34 -0.62 0.10 0.00 0.00 0.00 0.00 47.33 46.47 4req h GLY 333 CO 0.99 0.57 0.63 -0.25 0.00 0.00 0.00 176.54 178.49 4req h TRP 334 N 0.63 1.15 0.00 5.60 7.01 -1.92 -2.34 115.95 126.07 4req h TRP 334 Ca 0.09 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.13 4req h TRP 334 Cb 0.68 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 27.37 4req h TRP 334 CO 0.03 0.50 0.00 0.66 -2.79 0.00 0.00 178.44 176.84 4req h SER 335 N 1.04 0.00 -3.54 2.65 4.64 -1.93 -3.44 113.55 112.98 4req h SER 335 Ca 0.47 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.27 4req h SER 335 Cb 0.39 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 4req h SER 335 CO -0.23 0.00 0.08 -0.76 -0.87 0.00 0.00 176.83 175.05 4req s LEU 336 N -4.94 4.33 0.28 5.97 1.43 -0.88 -5.05 118.68 119.81 4req s LEU 336 Ca 0.03 1.36 0.09 0.00 -1.03 0.00 0.00 54.13 54.58 4req s LEU 336 Cb 0.09 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 4req s LEU 336 CO 0.43 0.03 0.09 0.42 0.23 0.00 0.00 176.35 177.55 4req s THR 337 N -1.54 3.55 -1.39 5.49 -4.23 -1.26 -4.73 115.64 111.53 4req s THR 337 Ca 0.43 -1.73 0.24 0.00 -1.18 0.00 0.00 61.69 59.45 4req s THR 337 Cb -0.16 -3.01 0.05 0.00 1.34 0.00 0.00 72.50 70.72 4req s THR 337 CO 0.20 -0.31 1.33 0.00 -0.54 0.00 0.00 174.62 175.31 4req n ALA 338 N -1.04 3.61 -2.58 3.99 0.00 -1.26 -4.56 120.51 118.66 4req n ALA 338 Ca -0.06 -0.45 -0.33 0.00 0.00 0.00 0.00 53.44 52.60 4req n ALA 338 Cb 0.59 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.91 4req n ALA 338 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 4req s GLN 339 N -2.77 2.68 -1.16 0.00 1.11 -1.26 -4.67 119.66 113.60 4req s GLN 339 Ca 0.16 -0.60 -0.21 0.00 0.01 0.00 0.00 55.36 54.72 4req s GLN 339 Cb 0.18 -2.56 -0.00 0.00 -1.01 0.00 0.00 33.01 29.62 4req s GLN 339 CO 0.65 0.65 0.77 -3.47 0.01 0.00 0.00 175.29 173.90 4req n ASP 340 N 2.04 -4.93 0.20 5.90 2.03 -1.26 -4.85 116.55 115.68 4req n ASP 340 Ca -0.17 -1.04 0.18 0.00 0.52 0.00 0.00 54.79 54.28 4req n ASP 340 Cb 0.53 -3.24 0.82 0.00 -0.72 0.00 0.00 41.12 38.51 4req n ASP 340 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 4req h VAL 341 N -1.95 0.33 0.00 5.18 -1.51 -1.83 -2.73 116.25 113.74 4req h VAL 341 Ca -0.67 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 4req h VAL 341 Cb 1.36 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.28 4req h VAL 341 CO 0.49 0.00 0.00 1.88 -1.23 0.00 0.00 177.57 178.71 4req h TYR 342 N 0.00 0.00 0.00 5.19 -1.99 -1.89 -2.68 116.97 115.60 4req h TYR 342 Ca 0.10 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 4req h TYR 342 Cb 0.69 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.42 4req h TYR 342 CO 0.00 0.00 -0.05 -0.91 -0.00 0.00 0.00 178.16 177.20 4req h ASN 343 N 0.00 0.00 -0.30 3.88 2.35 -1.84 -2.90 115.58 116.76 4req h ASN 343 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 4req h ASN 343 Cb 0.66 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.01 4req h ASN 343 CO 0.00 0.05 0.06 0.78 -1.65 0.00 0.00 177.43 176.66 4req h ASN 344 N 0.00 0.55 -0.80 5.81 2.35 -1.70 -1.85 115.58 119.94 4req h ASN 344 Ca -0.00 -0.09 0.03 0.00 -0.55 0.00 0.00 56.30 55.69 4req h ASN 344 Cb 0.42 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.60 4req h ASN 344 CO 0.01 0.58 0.51 0.58 -1.65 0.00 0.00 177.43 177.46 4req h VAL 345 N 0.58 1.12 -0.11 2.81 2.07 -1.69 0.26 116.25 121.28 4req h VAL 345 Ca 0.13 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 4req h VAL 345 Cb 0.28 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.09 4req h VAL 345 CO 0.00 0.18 -0.15 0.58 0.02 0.00 0.00 177.57 178.21 4req h VAL 346 N 0.99 1.37 -0.06 2.57 2.07 -1.64 -1.59 116.25 119.97 4req h VAL 346 Ca 0.32 -1.36 0.04 0.00 0.82 0.00 0.00 66.70 66.52 4req h VAL 346 Cb 0.02 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 4req h VAL 346 CO -0.12 0.39 -0.20 0.03 0.02 0.00 0.00 177.57 177.69 4req h ARG 347 N -0.13 -0.28 -0.72 1.57 3.08 -0.93 -1.17 114.38 115.79 4req h ARG 347 Ca 0.01 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 4req h ARG 347 Cb 0.70 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 4req h ARG 347 CO 0.03 -0.19 0.26 1.15 -1.07 0.00 0.00 179.97 180.16 4req h THR 348 N -0.29 1.25 -0.32 2.04 2.02 -0.49 -1.96 112.91 115.17 4req h THR 348 Ca 0.08 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.45 4req h THR 348 Cb 0.40 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 4req h THR 348 CO -0.23 0.33 0.18 0.00 0.37 0.00 0.00 175.52 176.17 4req h ILE 350 N 0.38 1.25 -0.39 0.00 1.08 -0.97 -1.25 117.51 117.60 4req h ILE 350 Ca 0.12 -0.90 -0.08 0.00 -0.39 0.00 0.00 64.86 63.61 4req h ILE 350 Cb -0.00 0.72 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 4req h ILE 350 CO -0.06 0.33 -0.10 -0.33 -0.69 0.00 0.00 178.15 177.31 4req h GLU 351 N 0.84 0.69 -0.76 2.37 5.08 -1.21 -1.56 114.58 120.03 4req h GLU 351 Ca 0.18 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 4req h GLU 351 Cb 0.35 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 4req h GLU 351 CO 0.00 0.78 0.28 0.00 -1.00 0.00 0.00 179.01 179.07 4req h ALA 352 N 1.26 0.98 -0.48 3.43 0.00 -0.87 -1.42 119.26 122.16 4req h ALA 352 Ca 0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 4req h ALA 352 Cb 0.54 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 4req h ALA 352 CO 0.03 0.63 0.10 0.52 0.00 0.00 0.00 179.25 180.53 4req h MET 353 N 1.10 0.78 -0.36 0.00 2.86 -0.87 -1.74 114.93 116.70 4req h MET 353 Ca 0.25 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.65 4req h MET 353 Cb 0.25 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 4req h MET 353 CO -0.02 0.78 0.06 0.00 1.06 0.00 0.00 176.91 178.79 4req h ALA 354 N 0.97 0.48 -0.32 6.32 0.00 -0.91 0.14 119.26 125.94 4req h ALA 354 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.86 4req h ALA 354 Cb 0.36 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 4req h ALA 354 CO 0.01 0.18 0.21 0.00 0.00 0.00 0.00 179.25 179.65 4req h ALA 355 N 0.91 0.41 0.01 0.00 0.00 -1.21 -1.21 119.26 118.17 4req h ALA 355 Ca 0.11 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 4req h ALA 355 Cb 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 4req h ALA 355 CO 0.01 -0.12 -0.88 1.79 0.00 0.00 0.00 179.25 180.05 4req h THR 356 N 0.43 1.58 0.00 0.00 1.35 -1.28 -0.51 112.91 114.48 4req h THR 356 Ca 0.12 -2.85 0.00 0.00 -0.55 0.00 0.00 66.41 63.13 4req h THR 356 Cb -0.04 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 4req h THR 356 CO -0.02 0.82 0.00 0.00 -0.25 0.00 0.00 175.52 176.06 4req n GLN 357 N -3.56 0.25 0.06 4.72 6.02 0.48 -2.22 117.38 123.13 4req n GLN 357 Ca -0.02 0.24 0.12 0.00 -0.01 0.00 0.00 57.00 57.34 4req n GLN 357 Cb 0.82 -1.81 0.25 0.00 1.02 0.00 0.00 30.24 30.53 4req n GLN 357 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4req n GLY 358 N 1.13 -1.47 2.25 1.08 0.00 -0.47 -4.65 105.19 103.05 4req n GLY 358 Ca 0.05 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 4req n GLY 358 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 4req n HIS 359 N -2.06 -1.10 -1.54 1.61 8.25 -0.84 -4.49 115.22 115.06 4req n HIS 359 Ca 0.04 0.41 -0.32 0.00 -0.26 0.00 0.00 57.72 57.59 4req n HIS 359 Cb 0.42 -3.30 0.07 0.00 1.12 0.00 0.00 29.99 28.30 4req n HIS 359 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 4req s THR 360 N -3.18 3.27 -0.14 1.59 -1.32 -0.26 -4.88 115.64 110.72 4req s THR 360 Ca 0.15 0.51 0.21 0.00 -1.21 0.00 0.00 61.69 61.35 4req s THR 360 Cb -0.02 -3.02 -0.16 0.00 -1.51 0.00 0.00 72.50 67.79 4req s THR 360 CO 0.34 -0.45 0.74 0.00 -2.21 0.00 0.00 174.62 173.04 4req n GLN 361 N -2.90 0.63 -3.73 7.08 3.00 0.14 -4.69 117.38 116.91 4req n GLN 361 Ca 0.10 0.01 -0.10 0.00 -0.01 0.00 0.00 57.00 57.00 4req n GLN 361 Cb 0.52 -1.69 -0.05 0.00 0.00 0.00 0.00 30.24 29.02 4req n GLN 361 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 4req s SER 362 N -5.12 -0.13 -0.10 1.08 1.04 -0.90 -1.73 113.70 107.83 4req s SER 362 Ca -0.04 -0.46 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 4req s SER 362 Cb 0.11 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.72 4req s SER 362 CO 0.84 -0.86 0.40 -0.22 0.98 0.00 0.00 173.24 174.38 4req s LEU 363 N -2.84 0.48 -0.05 2.42 2.96 -0.59 -1.58 118.68 119.49 4req s LEU 363 Ca 0.06 0.58 0.06 0.00 -0.22 0.00 0.00 54.13 54.61 4req s LEU 363 Cb 0.02 1.45 -0.01 0.00 0.50 0.00 0.00 46.19 48.15 4req s LEU 363 CO -0.09 -0.27 -0.24 -2.28 -1.32 0.00 0.00 176.35 172.14 4req s HIS 364 N -0.38 2.43 -0.12 5.38 5.65 -0.56 -0.49 115.29 127.20 4req s HIS 364 Ca -0.05 -0.59 0.02 0.00 0.25 0.00 0.00 55.06 54.69 4req s HIS 364 Cb -0.03 -1.57 -0.00 0.00 -1.18 0.00 0.00 32.58 29.79 4req s HIS 364 CO 0.02 -0.13 -0.19 0.95 -0.65 0.00 0.00 174.74 174.74 4req s THR 365 N -0.34 2.43 0.92 0.89 -4.23 -1.26 -2.40 115.64 111.65 4req s THR 365 Ca 0.02 -0.88 -0.12 0.00 -1.18 0.00 0.00 61.69 59.53 4req s THR 365 Cb -0.12 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 71.89 4req s THR 365 CO 0.02 0.54 1.11 0.20 -0.54 0.00 0.00 174.62 175.95 4req s ASN 366 N 0.45 3.33 0.21 3.99 0.01 -1.26 -4.83 114.94 116.84 4req s ASN 366 Ca -0.14 1.17 0.07 0.00 -0.71 0.00 0.00 52.86 53.25 4req s ASN 366 Cb -0.17 -1.82 -0.04 0.00 0.41 0.00 0.00 41.25 39.63 4req s ASN 366 CO 0.06 -2.68 0.07 -0.44 -1.51 0.00 0.00 177.10 172.60 4req s SER 367 N -3.72 5.07 0.45 -1.22 0.01 -1.26 -4.56 113.70 108.46 4req s SER 367 Ca 0.64 -0.35 0.16 0.00 1.31 0.00 0.00 55.95 57.70 4req s SER 367 Cb -0.17 -1.17 1.09 0.00 0.21 0.00 0.00 66.02 65.99 4req s SER 367 CO 0.55 0.04 1.98 0.17 0.41 0.00 0.00 173.24 176.39 4req h LEU 368 N 2.20 0.31 -0.65 2.44 8.10 -1.87 -2.53 115.31 123.29 4req h LEU 368 Ca -0.47 0.01 0.00 0.00 0.11 0.00 0.00 57.88 57.53 4req h LEU 368 Cb 1.22 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 41.38 4req h LEU 368 CO 0.60 0.18 0.00 -0.90 -4.11 0.00 0.00 178.44 174.21 4req n ASP 369 N -4.46 0.91 -0.33 0.17 5.68 -1.26 -4.62 116.55 112.64 4req n ASP 369 Ca 0.10 -2.03 0.14 0.00 -0.50 0.00 0.00 54.79 52.50 4req n ASP 369 Cb 0.42 -0.16 0.28 0.00 -1.14 0.00 0.00 41.12 40.52 4req n ASP 369 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 4req h GLU 370 N 0.80 0.03 -0.07 0.11 4.57 -1.61 0.17 114.58 118.57 4req h GLU 370 Ca 0.00 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 4req h GLU 370 Cb 0.27 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 4req h GLU 370 CO 0.01 0.02 0.00 0.00 -1.18 0.00 0.00 179.01 177.86 4req n ALA 371 N -3.09 2.58 0.00 2.92 0.00 -1.26 -4.30 120.51 117.35 4req n ALA 371 Ca 0.23 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.31 4req n ALA 371 Cb 0.74 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.98 4req n ALA 371 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 4req n ILE 372 N -0.18 0.00 -3.84 0.00 5.41 -0.13 -4.79 119.36 115.83 4req n ILE 372 Ca 0.17 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.88 4req n ILE 372 Cb 0.23 -0.82 0.02 0.00 -0.71 0.00 0.00 39.64 38.37 4req n ILE 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 4req n ALA 373 N -2.61 -2.32 -1.50 -1.39 0.00 -0.16 -4.48 120.51 108.05 4req n ALA 373 Ca 0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 53.44 52.08 4req n ALA 373 Cb 0.45 0.65 0.05 0.00 0.00 0.00 0.00 19.45 20.60 4req n ALA 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 4req s LEU 374 N 0.00 3.37 0.48 0.00 1.43 -1.26 -4.14 118.68 118.56 4req s LEU 374 Ca 0.20 2.00 -0.24 0.00 -1.03 0.00 0.00 54.13 55.06 4req s LEU 374 Cb -0.03 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.57 4req s LEU 374 CO 0.07 -1.66 1.34 -2.16 0.23 0.00 0.00 176.35 174.17 4req s PRO 375 N -4.13 3.52 0.64 1.29 0.04 -1.26 -4.07 135.00 131.03 4req s PRO 375 Ca 0.67 2.22 0.02 0.00 0.04 0.00 0.00 61.00 63.95 4req s PRO 375 Cb -0.20 -2.48 0.09 0.00 0.04 0.00 0.00 34.50 31.95 4req s PRO 375 CO 0.42 -0.88 0.88 0.95 0.04 0.00 0.00 177.00 178.42 4req s THR 376 N -1.30 2.29 0.15 1.26 -4.23 -1.26 -4.82 115.64 107.74 4req s THR 376 Ca 0.65 -0.72 -0.14 0.00 -1.18 0.00 0.00 61.69 60.30 4req s THR 376 Cb -0.39 -2.58 0.04 0.00 1.34 0.00 0.00 72.50 70.91 4req s THR 376 CO 0.49 0.00 1.73 0.44 -0.54 0.00 0.00 174.62 176.74 4req h ASP 377 N -0.19 0.65 0.59 3.99 3.32 -1.98 -0.35 116.42 122.45 4req h ASP 377 Ca -0.36 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.52 4req h ASP 377 Cb 1.28 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 40.67 4req h ASP 377 CO 0.43 0.60 -0.28 0.15 -1.72 0.00 0.00 179.24 178.42 4req h PHE 378 N 0.66 -0.74 -0.80 4.55 3.57 -1.99 -1.79 116.94 120.39 4req h PHE 378 Ca 0.17 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.67 4req h PHE 378 Cb 0.13 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 4req h PHE 378 CO -0.01 -0.40 0.52 0.66 -2.23 0.00 0.00 178.31 176.85 4req h SER 379 N -1.01 0.88 -0.14 0.41 4.64 -1.91 -1.96 113.55 114.47 4req h SER 379 Ca -0.08 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 4req h SER 379 Cb 0.67 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 4req h SER 379 CO 0.13 0.62 0.00 0.00 -0.87 0.00 0.00 176.83 176.72 4req h ALA 380 N 1.32 1.55 -0.40 5.18 0.00 -1.11 -1.09 119.26 124.71 4req h ALA 380 Ca 0.31 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 4req h ALA 380 Cb -0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 4req h ALA 380 CO -0.09 0.33 -0.24 -0.09 0.00 0.00 0.00 179.25 179.16 4req h ARG 381 N 0.36 0.86 -0.28 0.00 2.43 -0.54 -1.09 114.38 116.11 4req h ARG 381 Ca 0.08 -0.40 -0.04 0.00 -0.81 0.00 0.00 59.98 58.81 4req h ARG 381 Cb 0.24 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 4req h ARG 381 CO 0.01 1.04 0.01 0.82 -1.51 0.00 0.00 179.97 180.34 4req h ILE 382 N 0.67 1.25 -0.49 1.20 2.04 -1.27 0.01 117.51 120.93 4req h ILE 382 Ca 0.08 -0.90 0.05 0.00 1.00 0.00 0.00 64.86 65.09 4req h ILE 382 Cb 0.81 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.13 4req h ILE 382 CO 0.07 0.29 0.23 0.00 0.00 0.00 0.00 178.15 178.74 4req h ALA 383 N 0.84 0.62 -0.44 1.87 0.00 -1.03 -1.40 119.26 119.71 4req h ALA 383 Ca 0.08 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 4req h ALA 383 Cb 0.41 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 4req h ALA 383 CO 0.01 -0.13 -0.17 -0.09 0.00 0.00 0.00 179.25 178.87 4req h ARG 384 N 0.45 0.90 -0.17 0.00 2.43 -1.01 -3.10 114.38 113.88 4req h ARG 384 Ca 0.22 -0.37 -0.05 0.00 -0.81 0.00 0.00 59.98 58.97 4req h ARG 384 Cb 0.16 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 4req h ARG 384 CO -0.18 1.02 -0.11 -0.91 -1.51 0.00 0.00 179.97 178.29 4req h ASN 385 N 0.73 0.24 -0.11 -3.80 -0.26 -0.78 -1.47 115.58 110.14 4req h ASN 385 Ca 0.10 -0.05 0.04 0.00 -0.56 0.00 0.00 56.30 55.84 4req h ASN 385 Cb 0.73 -0.06 -0.05 0.00 -1.06 0.00 0.00 38.32 37.87 4req h ASN 385 CO 0.06 0.39 -0.24 0.74 -1.06 0.00 0.00 177.43 177.32 4req h THR 386 N 0.25 0.43 -0.19 2.81 2.02 -1.18 0.19 112.91 117.24 4req h THR 386 Ca 0.05 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.08 4req h THR 386 Cb 0.35 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 4req h THR 386 CO 0.02 0.00 -0.50 1.56 0.37 0.00 0.00 175.52 176.96 4req h GLN 387 N -0.31 0.53 -0.20 6.66 4.20 -1.50 -2.28 115.11 122.20 4req h GLN 387 Ca 0.09 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.46 4req h GLN 387 Cb 0.45 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 4req h GLN 387 CO -0.29 0.91 0.02 -0.07 -0.67 0.00 0.00 178.83 178.73 4req h LEU 388 N 0.42 0.33 -0.24 1.46 3.38 -0.96 -1.17 115.31 118.52 4req h LEU 388 Ca 0.02 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.76 4req h LEU 388 Cb 1.03 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 4req h LEU 388 CO 0.09 0.53 -0.13 0.15 0.09 0.00 0.00 178.44 179.17 4req h PHE 389 N 0.11 -0.33 -0.95 1.13 3.57 -0.63 0.35 116.94 120.20 4req h PHE 389 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 4req h PHE 389 Cb 0.36 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 4req h PHE 389 CO 0.03 -0.20 0.57 -0.07 -2.23 0.00 0.00 178.31 176.41 4req h LEU 390 N -0.11 1.14 -0.47 0.59 3.38 -1.22 0.20 115.31 118.81 4req h LEU 390 Ca 0.13 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.86 4req h LEU 390 Cb 0.31 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 4req h LEU 390 CO -0.31 0.87 -0.64 1.56 0.09 0.00 0.00 178.44 180.01 4req h GLN 391 N 1.31 0.47 0.08 1.13 4.20 -0.52 -3.31 115.11 118.46 4req h GLN 391 Ca 0.34 -0.33 -0.36 0.00 0.06 0.00 0.00 58.65 58.35 4req h GLN 391 Cb -0.06 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 4req h GLN 391 CO -0.06 0.95 -2.08 1.04 -0.67 0.00 0.00 178.83 178.01 4req n GLN 392 N -3.90 0.71 -0.08 1.46 6.02 0.12 -4.78 117.38 116.93 4req n GLN 392 Ca -0.04 0.26 -0.08 0.00 -0.01 0.00 0.00 57.00 57.13 4req n GLN 392 Cb 0.65 -1.65 -0.12 0.00 1.02 0.00 0.00 30.24 30.14 4req n GLN 392 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 4req n GLU 393 N -3.55 1.40 0.27 -1.09 1.02 0.66 -4.76 120.64 114.59 4req n GLU 393 Ca -0.37 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 56.90 4req n GLU 393 Cb 0.99 -1.39 0.80 0.00 -0.02 0.00 0.00 31.44 31.82 4req n GLU 393 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 4req h SER 394 N 0.00 0.00 -0.06 1.62 4.64 -1.61 -3.47 113.55 114.67 4req h SER 394 Ca -0.42 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.88 4req h SER 394 Cb 1.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.99 4req h SER 394 CO 0.01 0.00 -0.02 0.61 -0.87 0.00 0.00 176.83 176.56 4req n GLY 395 N -1.42 0.41 0.26 -0.77 0.00 -1.26 -4.92 105.19 97.48 4req n GLY 395 Ca -0.02 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.04 4req n GLY 395 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 4req n THR 396 N -2.61 0.01 0.00 2.61 -2.24 -1.26 -3.66 114.28 107.13 4req n THR 396 Ca -0.01 -0.14 0.05 0.00 -2.27 0.00 0.00 64.05 61.68 4req n THR 396 Cb 0.22 0.03 -0.12 0.00 -2.10 0.00 0.00 70.33 68.36 4req n THR 396 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 4req n THR 397 N -0.36 0.63 0.15 4.28 -2.24 -1.26 -4.51 114.28 110.97 4req n THR 397 Ca 0.21 -0.62 0.11 0.00 -2.27 0.00 0.00 64.05 61.48 4req n THR 397 Cb 0.24 -0.30 0.63 0.00 -2.10 0.00 0.00 70.33 68.79 4req n THR 397 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 4req h ARG 398 N 0.00 0.07 -5.68 -0.78 0.11 -1.85 -2.67 114.38 103.58 4req h ARG 398 Ca -0.14 -0.00 -0.67 0.00 0.10 0.00 0.00 59.98 59.26 4req h ARG 398 Cb 1.37 -0.02 -0.26 0.00 1.11 0.00 0.00 29.97 32.17 4req h ARG 398 CO 0.02 0.04 -0.78 0.08 0.10 0.00 0.00 179.97 179.43 4req s VAL 399 N -5.11 2.92 -0.07 0.08 1.01 -1.26 -4.56 120.40 113.42 4req s VAL 399 Ca -0.05 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 4req s VAL 399 Cb 0.18 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 4req s VAL 399 CO 0.70 0.55 1.57 -0.63 0.00 0.00 0.00 175.10 177.28 4req s ILE 400 N -0.02 3.70 -0.56 2.22 1.01 -1.26 -3.82 121.20 122.45 4req s ILE 400 Ca -0.04 0.87 -0.25 0.00 0.00 0.00 0.00 60.65 61.23 4req s ILE 400 Cb -0.14 -3.56 0.04 0.00 0.01 0.00 0.00 42.46 38.80 4req s ILE 400 CO 0.04 -0.07 0.65 -0.67 0.00 0.00 0.00 174.94 174.89 4req n ASP 401 N 6.87 -5.64 0.15 3.58 2.03 -1.26 -4.87 116.55 117.41 4req n ASP 401 Ca 0.16 -0.32 0.16 0.00 0.52 0.00 0.00 54.79 55.31 4req n ASP 401 Cb 0.43 -2.16 0.73 0.00 -0.72 0.00 0.00 41.12 39.40 4req n ASP 401 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 4req h PRO 402 N 1.36 0.00 -0.00 -0.67 0.13 -1.83 -2.42 132.00 128.57 4req h PRO 402 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 4req h PRO 402 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 4req h PRO 402 CO 0.27 0.00 -0.28 0.91 -0.23 0.00 0.00 178.00 178.66 4req n TRP 403 N -4.21 0.00 -1.70 1.56 7.02 -1.26 -4.92 117.44 113.93 4req n TRP 403 Ca 0.03 0.00 -0.62 0.00 -1.02 0.00 0.00 57.50 55.89 4req n TRP 403 Cb 0.35 -0.23 -0.08 0.00 -2.42 0.00 0.00 31.31 28.92 4req n TRP 403 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 4req n SER 404 N -1.15 1.57 0.00 -0.99 2.88 -0.91 0.57 113.62 115.59 4req n SER 404 Ca 0.09 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.77 4req n SER 404 Cb 0.33 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 4req n SER 404 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 4req n GLY 405 N 3.74 3.13 3.56 0.46 0.00 -1.26 -5.03 105.19 109.78 4req n GLY 405 Ca 0.27 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.74 4req n GLY 405 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 4req n SER 406 N 0.10 0.90 -0.16 1.61 2.88 0.19 -4.83 113.62 114.31 4req n SER 406 Ca 0.00 1.14 -0.10 0.00 -1.33 0.00 0.00 58.87 58.58 4req n SER 406 Cb 0.00 -1.06 -0.00 0.00 -0.75 0.00 0.00 64.21 62.40 4req n SER 406 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 4req h ALA 407 N 3.93 0.63 -0.11 -1.46 0.00 -1.89 -0.88 119.26 119.50 4req h ALA 407 Ca -0.49 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 4req h ALA 407 Cb 1.38 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 4req h ALA 407 CO 0.73 0.42 0.05 -0.92 0.00 0.00 0.00 179.25 179.53 4req h TYR 408 N 0.68 0.16 -0.58 0.00 3.20 -1.88 -1.23 116.97 117.32 4req h TYR 408 Ca 0.13 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 4req h TYR 408 Cb 0.49 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 4req h TYR 408 CO 0.04 0.24 0.20 0.28 -1.64 0.00 0.00 178.16 177.28 4req h VAL 409 N 0.03 1.24 -0.42 1.81 2.07 -1.90 -1.64 116.25 117.44 4req h VAL 409 Ca 0.04 -0.78 -0.13 0.00 0.82 0.00 0.00 66.70 66.64 4req h VAL 409 Cb 0.15 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 4req h VAL 409 CO -0.00 0.30 -0.25 -0.33 0.02 0.00 0.00 177.57 177.30 4req h GLU 410 N 0.81 0.87 0.20 1.57 4.39 -1.20 -0.99 114.58 120.23 4req h GLU 410 Ca 0.19 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 4req h GLU 410 Cb 0.26 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 4req h GLU 410 CO -0.01 1.02 -0.11 1.49 -1.16 0.00 0.00 179.01 180.25 4req h GLU 411 N 0.75 -0.27 -0.85 2.33 4.57 -0.61 -2.04 114.58 118.45 4req h GLU 411 Ca 0.09 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.34 4req h GLU 411 Cb 0.80 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.39 4req h GLU 411 CO 0.07 -0.18 0.53 -0.07 -1.18 0.00 0.00 179.01 178.18 4req h LEU 412 N -0.28 0.85 0.09 1.64 3.38 -1.25 -0.49 115.31 119.25 4req h LEU 412 Ca -0.02 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 4req h LEU 412 Cb 0.23 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 4req h LEU 412 CO 0.03 0.56 -0.18 0.74 0.09 0.00 0.00 178.44 179.69 4req h THR 413 N 1.00 0.59 -0.33 0.22 2.02 -0.97 0.18 112.91 115.61 4req h THR 413 Ca 0.36 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.53 4req h THR 413 Cb 0.11 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 4req h THR 413 CO -0.15 0.00 0.17 -0.25 0.37 0.00 0.00 175.52 175.66 4req h TRP 414 N -0.34 0.46 -0.35 3.16 -0.00 -0.90 0.15 115.95 118.13 4req h TRP 414 Ca 0.03 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.89 58.90 4req h TRP 414 Cb 0.36 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.36 4req h TRP 414 CO -0.18 0.39 0.21 -0.44 -0.00 0.00 0.00 178.44 178.41 4req h ASP 415 N 0.40 0.42 -0.18 2.65 3.32 -0.98 -0.77 116.42 121.28 4req h ASP 415 Ca 0.11 -0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.94 4req h ASP 415 Cb 0.09 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.54 4req h ASP 415 CO -0.02 0.35 -0.56 -0.07 -1.72 0.00 0.00 179.24 177.22 4req h LEU 416 N 0.46 0.80 -0.82 1.55 3.38 -0.57 -1.75 115.31 118.35 4req h LEU 416 Ca 0.13 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 4req h LEU 416 Cb 0.00 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 4req h LEU 416 CO -0.02 1.25 0.45 0.00 0.09 0.00 0.00 178.44 180.21 4req h ALA 417 N 0.57 1.06 -0.11 1.53 0.00 -0.58 0.10 119.26 121.82 4req h ALA 417 Ca -0.02 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.53 4req h ALA 417 Cb 1.18 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.65 4req h ALA 417 CO 0.12 0.57 -0.85 0.00 0.00 0.00 0.00 179.25 179.09 4req h ARG 418 N 1.15 0.76 -0.32 0.00 3.08 -1.13 -2.14 114.38 115.78 4req h ARG 418 Ca 0.29 -0.68 -0.05 0.00 0.07 0.00 0.00 59.98 59.61 4req h ARG 418 Cb 0.03 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 4req h ARG 418 CO -0.05 1.28 -0.00 0.87 -1.07 0.00 0.00 179.97 181.00 4req h LYS 419 N 0.49 0.56 -0.56 0.04 1.57 -1.20 -1.75 116.57 115.72 4req h LYS 419 Ca -0.08 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.44 4req h LYS 419 Cb 1.49 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.73 4req h LYS 419 CO 0.17 0.70 0.02 0.00 -0.57 0.00 0.00 179.45 179.77 4req h ALA 420 N 0.84 0.98 -0.62 3.86 0.00 -1.04 -2.42 119.26 120.85 4req h ALA 420 Ca 0.09 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 4req h ALA 420 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 4req h ALA 420 CO 0.02 0.63 0.15 2.35 0.00 0.00 0.00 179.25 182.39 4req h TRP 421 N 0.88 1.02 0.32 0.00 2.91 -1.28 -0.62 115.95 119.18 4req h TRP 421 Ca 0.17 -0.11 -0.02 0.00 1.13 0.00 0.00 58.89 60.06 4req h TRP 421 Cb 0.49 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 28.85 4req h TRP 421 CO 0.03 0.84 -0.15 0.78 -1.03 0.00 0.00 178.44 178.91 4req h GLY 422 N 1.04 -0.44 0.93 2.65 0.00 -1.03 -2.38 103.07 103.84 4req h GLY 422 Ca 0.20 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.72 4req h GLY 422 CO 0.00 -0.16 0.55 0.45 0.00 0.00 0.00 176.54 177.38 4req h HIS 423 N -0.44 1.04 -0.86 5.60 3.86 -1.26 -2.64 115.15 120.45 4req h HIS 423 Ca -0.04 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 4req h HIS 423 Cb 0.33 -0.35 -0.05 0.00 1.06 0.00 0.00 27.41 28.41 4req h HIS 423 CO -0.05 0.62 0.56 0.82 0.86 0.00 0.00 177.93 180.74 4req h ILE 424 N 1.09 1.19 0.00 2.45 2.04 -0.91 -1.70 117.51 121.69 4req h ILE 424 Ca 0.32 -0.39 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 4req h ILE 424 Cb -0.05 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 35.97 4req h ILE 424 CO -0.09 0.21 -0.68 1.56 0.00 0.00 0.00 178.15 179.14 4req h GLN 425 N 1.13 0.00 -0.19 2.37 4.20 -1.16 -1.51 115.11 119.95 4req h GLN 425 Ca 0.32 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.00 4req h GLN 425 Cb -0.09 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 4req h GLN 425 CO -0.08 0.68 0.00 0.93 -0.67 0.00 0.00 178.83 179.70 4req h GLU 426 N 0.00 0.33 -0.06 1.46 5.08 -1.17 -2.12 114.58 118.10 4req h GLU 426 Ca -0.01 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 4req h GLU 426 Cb 1.22 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 4req h GLU 426 CO 0.09 0.53 -0.02 0.28 -1.00 0.00 0.00 179.01 178.88 4req h VAL 427 N 0.09 0.93 -0.25 3.13 2.07 -1.26 -2.94 116.25 118.01 4req h VAL 427 Ca 0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 4req h VAL 427 Cb 0.38 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 4req h VAL 427 CO 0.01 0.00 0.15 -0.33 0.02 0.00 0.00 177.57 177.42 4req h GLU 428 N -0.01 0.34 -0.18 1.57 4.39 -1.19 -1.05 114.58 118.44 4req h GLU 428 Ca 0.03 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.60 4req h GLU 428 Cb 0.06 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 4req h GLU 428 CO -0.07 0.25 -0.36 0.87 -1.16 0.00 0.00 179.01 178.54 4req h LYS 429 N 0.35 0.39 -0.25 2.33 6.56 -1.20 -3.14 116.57 121.60 4req h LYS 429 Ca 0.09 -0.17 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 4req h LYS 429 Cb -0.00 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.65 4req h LYS 429 CO -0.02 0.70 0.00 0.28 -2.06 0.00 0.00 179.45 178.35 4req n VAL 430 N -4.06 0.33 -0.17 0.50 0.31 -1.01 -4.90 118.33 109.33 4req n VAL 430 Ca -0.01 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 4req n VAL 430 Cb 0.46 0.22 0.00 0.00 -0.91 0.00 0.00 33.84 33.61 4req n VAL 430 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 4req n GLY 431 N 1.01 0.83 0.00 2.92 0.00 -1.19 -4.65 105.19 104.11 4req n GLY 431 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 4req n GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4req n GLY 432 N -2.13 0.73 0.17 -0.02 0.00 -0.43 -4.59 105.19 98.93 4req n GLY 432 Ca 0.00 -2.12 -0.12 0.00 0.00 0.00 0.00 46.02 43.78 4req n GLY 432 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 4req h MET 433 N 0.00 0.45 -0.10 1.61 2.86 -1.82 -2.78 114.93 115.14 4req h MET 433 Ca 0.00 -0.41 -0.00 0.00 -2.06 0.00 0.00 59.70 57.23 4req h MET 433 Cb 0.00 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 4req h MET 433 CO 0.00 1.05 0.06 0.00 1.06 0.00 0.00 176.91 179.08 4req h ALA 434 N 0.82 0.12 -0.74 6.32 0.00 -1.94 -0.03 119.26 123.81 4req h ALA 434 Ca -0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 4req h ALA 434 Cb 1.43 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 4req h ALA 434 CO 0.14 -0.36 0.38 0.87 0.00 0.00 0.00 179.25 180.28 4req h LYS 435 N 0.09 1.05 -0.37 0.00 1.57 -1.81 -2.18 116.57 114.92 4req h LYS 435 Ca 0.03 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.56 4req h LYS 435 Cb 0.04 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 4req h LYS 435 CO -0.01 0.80 -0.26 0.00 -0.57 0.00 0.00 179.45 179.42 4req h ALA 436 N 1.19 0.86 -0.44 3.86 0.00 -1.30 -3.04 119.26 120.39 4req h ALA 436 Ca 0.26 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 4req h ALA 436 Cb 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 4req h ALA 436 CO -0.04 0.63 -0.18 0.82 0.00 0.00 0.00 179.25 180.49 4req h ILE 437 N 0.65 1.27 -0.97 0.00 2.04 -0.84 -3.11 117.51 116.56 4req h ILE 437 Ca 0.08 -1.33 0.13 0.00 1.00 0.00 0.00 64.86 64.75 4req h ILE 437 Cb 0.77 1.20 -0.08 0.00 -0.74 0.00 0.00 36.82 37.97 4req h ILE 437 CO 0.06 0.45 0.61 -0.33 0.00 0.00 0.00 178.15 178.94 4req h GLU 438 N 0.73 0.87 0.00 2.37 5.08 -1.28 -1.55 114.58 120.80 4req h GLU 438 Ca 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 4req h GLU 438 Cb 0.74 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.80 4req h GLU 438 CO 0.06 0.58 0.00 0.87 -1.00 0.00 0.00 179.01 179.51 4req h LYS 439 N 0.90 0.00 0.00 2.33 1.57 -1.52 -3.48 116.57 116.37 4req h LYS 439 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 4req h LYS 439 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 4req h LYS 439 CO -0.25 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.04 4req n GLY 440 N 0.23 0.40 0.14 3.86 0.00 -0.58 -4.98 105.19 104.25 4req n GLY 440 Ca 0.01 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 4req n GLY 440 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 4req h ILE 441 N 0.00 0.90 -0.08 -0.61 1.08 -1.81 -2.64 117.51 114.36 4req h ILE 441 Ca 0.00 -0.84 0.03 0.00 -0.39 0.00 0.00 64.86 63.66 4req h ILE 441 Cb 0.00 1.38 -0.06 0.00 -3.07 0.00 0.00 36.82 35.07 4req h ILE 441 CO 0.00 0.18 -0.50 -0.65 -0.69 0.00 0.00 178.15 176.50 4req h PRO 442 N -0.70 -0.57 -0.52 2.37 0.11 -1.90 0.24 132.00 131.03 4req h PRO 442 Ca -0.03 0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.21 4req h PRO 442 Cb 0.49 0.13 -0.07 0.00 0.11 0.00 0.00 31.00 31.66 4req h PRO 442 CO 0.04 -0.38 0.12 -0.22 -0.21 0.00 0.00 178.00 177.36 4req h LYS 443 N -0.59 0.26 -0.84 1.05 3.64 -1.81 -1.74 116.57 116.54 4req h LYS 443 Ca 0.04 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 4req h LYS 443 Cb 0.68 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 4req h LYS 443 CO -0.39 0.17 0.39 0.52 -2.27 0.00 0.00 179.45 177.87 4req h MET 444 N 0.27 1.21 -0.60 1.90 2.86 -0.93 -0.80 114.93 118.85 4req h MET 444 Ca 0.26 -0.19 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 4req h MET 444 Cb 0.35 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 4req h MET 444 CO -0.33 0.94 0.38 -0.09 1.06 0.00 0.00 176.91 178.87 4req h ARG 445 N 1.20 0.74 -0.45 1.72 9.65 0.24 -1.62 114.38 125.86 4req h ARG 445 Ca 0.29 -0.04 -0.13 0.00 -1.10 0.00 0.00 59.98 58.99 4req h ARG 445 Cb 0.14 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 4req h ARG 445 CO -0.03 0.49 -0.21 0.82 2.80 0.00 0.00 179.97 183.84 4req h ILE 446 N 0.77 1.27 -0.51 1.20 2.04 -1.06 -2.91 117.51 118.31 4req h ILE 446 Ca 0.23 -1.37 -0.06 0.00 1.00 0.00 0.00 64.86 64.66 4req h ILE 446 Cb -0.04 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 4req h ILE 446 CO -0.07 0.47 0.06 -0.33 0.00 0.00 0.00 178.15 178.27 4req h GLU 447 N 0.77 0.82 -0.37 2.37 5.08 -0.77 -1.05 114.58 121.43 4req h GLU 447 Ca 0.10 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 4req h GLU 447 Cb 0.79 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 4req h GLU 447 CO 0.06 0.78 0.23 0.93 -1.00 0.00 0.00 179.01 180.02 4req h GLU 448 N 0.77 0.49 -0.56 2.33 5.08 -1.29 0.25 114.58 121.66 4req h GLU 448 Ca 0.16 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 4req h GLU 448 Cb 0.38 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 4req h GLU 448 CO 0.01 0.35 0.12 0.00 -1.00 0.00 0.00 179.01 178.50 4req h ALA 449 N 1.11 1.15 -0.36 3.43 0.00 -1.30 0.62 119.26 123.92 4req h ALA 449 Ca 0.13 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 4req h ALA 449 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 4req h ALA 449 CO -0.03 0.57 -0.33 0.00 0.00 0.00 0.00 179.25 179.46 4req h ALA 450 N 1.29 0.75 -0.16 0.00 0.00 -0.54 -1.88 119.26 118.73 4req h ALA 450 Ca 0.18 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 4req h ALA 450 Cb 0.33 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 4req h ALA 450 CO 0.00 0.66 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 4req h ALA 451 N 0.96 0.22 -0.18 0.00 0.00 -0.30 -1.99 119.26 117.98 4req h ALA 451 Ca 0.07 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.70 4req h ALA 451 Cb 0.87 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 4req h ALA 451 CO 0.08 0.05 0.10 0.00 0.00 0.00 0.00 179.25 179.48 4req h ARG 452 N 0.00 0.20 -0.48 0.00 3.08 -0.83 -2.19 114.38 114.16 4req h ARG 452 Ca 0.03 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.09 4req h ARG 452 Cb 0.59 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 4req h ARG 452 CO 0.03 0.13 0.29 1.15 -1.07 0.00 0.00 179.97 180.50 4req h THR 453 N 0.21 1.06 -0.47 2.04 2.02 -1.32 -2.54 112.91 113.91 4req h THR 453 Ca 0.07 -0.20 0.05 0.00 0.77 0.00 0.00 66.41 67.09 4req h THR 453 Cb 0.00 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.79 4req h THR 453 CO -0.04 0.11 0.22 -0.61 0.37 0.00 0.00 175.52 175.57 4req h GLN 454 N 0.59 0.42 -0.43 6.66 5.75 -1.08 -1.94 115.11 125.08 4req h GLN 454 Ca 0.19 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.72 4req h GLN 454 Cb -0.00 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 28.40 4req h GLN 454 CO -0.08 0.28 0.13 0.00 -2.65 0.00 0.00 178.83 176.51 4req h ALA 455 N 1.27 0.50 -0.89 3.38 0.00 -1.22 0.30 119.26 122.61 4req h ALA 455 Ca 0.21 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 4req h ALA 455 Cb 0.15 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 4req h ALA 455 CO -0.17 -0.27 0.48 0.00 0.00 0.00 0.00 179.25 179.30 4req h ARG 456 N 0.28 1.24 0.00 0.00 3.08 -1.07 -1.24 114.38 116.67 4req h ARG 456 Ca 0.20 -0.15 -0.20 0.00 0.07 0.00 0.00 59.98 59.91 4req h ARG 456 Cb 0.22 -0.24 0.02 0.00 0.08 0.00 0.00 29.97 30.04 4req h ARG 456 CO -0.23 0.91 -0.79 0.82 -1.07 0.00 0.00 179.97 179.61 4req h ILE 457 N 1.24 1.37 -0.50 2.04 2.04 -0.86 -1.21 117.51 121.62 4req h ILE 457 Ca 0.31 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.01 4req h ILE 457 Cb 0.03 2.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 4req h ILE 457 CO -0.05 0.64 0.29 0.44 0.00 0.00 0.00 178.15 179.47 4req h ASP 458 N 0.09 0.61 0.65 1.72 3.32 -0.30 -2.91 116.42 119.61 4req h ASP 458 Ca -0.10 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 56.75 4req h ASP 458 Cb 1.48 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 4req h ASP 458 CO 0.15 0.51 -0.58 0.77 -1.72 0.00 0.00 179.24 178.37 4req h SER 459 N 0.67 0.00 0.00 6.45 4.64 -1.34 -3.48 113.55 120.49 4req h SER 459 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 4req h SER 459 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 4req h SER 459 CO -0.03 0.58 0.00 0.61 -0.87 0.00 0.00 176.83 177.12 4req n GLY 460 N 0.24 1.54 0.20 -0.77 0.00 -0.94 -5.00 105.19 100.46 4req n GLY 460 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 4req n GLY 460 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 4req h ARG 461 N 1.60 0.32 -4.48 1.61 -0.00 -1.56 -3.33 114.38 108.54 4req h ARG 461 Ca 0.00 -0.02 -0.72 0.00 -0.50 0.00 0.00 59.98 58.74 4req h ARG 461 Cb 0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 29.97 29.66 4req h ARG 461 CO 0.00 0.21 -0.45 -1.14 0.00 0.00 0.00 179.97 178.60 4req s GLN 462 N -6.13 2.86 0.40 0.04 0.74 -0.56 -5.00 119.66 112.00 4req s GLN 462 Ca -0.13 -1.18 -0.26 0.00 0.05 0.00 0.00 55.36 53.83 4req s GLN 462 Cb 0.15 -3.89 -0.09 0.00 1.10 0.00 0.00 33.01 30.28 4req s GLN 462 CO 0.73 -0.82 1.33 -2.14 -0.55 0.00 0.00 175.29 173.84 4req s PRO 463 N 1.58 4.00 -0.27 1.67 0.02 -1.25 -4.27 135.00 136.49 4req s PRO 463 Ca 0.03 2.22 -0.03 0.00 0.02 0.00 0.00 61.00 63.24 4req s PRO 463 Cb -0.21 -2.80 0.10 0.00 0.02 0.00 0.00 34.50 31.61 4req s PRO 463 CO 0.07 -0.49 0.16 -1.17 -0.33 0.00 0.00 177.00 175.24 4req s LEU 464 N -2.35 0.35 0.21 -5.54 2.96 -1.26 -5.06 118.68 107.98 4req s LEU 464 Ca 0.56 -1.06 -0.32 0.00 -0.22 0.00 0.00 54.13 53.08 4req s LEU 464 Cb -0.39 -0.15 -0.12 0.00 0.50 0.00 0.00 46.19 46.02 4req s LEU 464 CO 0.51 -0.41 1.70 -0.38 -1.32 0.00 0.00 176.35 176.45 4req n ILE 465 N 5.27 0.05 0.00 6.68 2.08 -1.26 -2.40 119.36 129.78 4req n ILE 465 Ca -0.05 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.24 4req n ILE 465 Cb 0.44 -1.94 0.00 0.00 -0.75 0.00 0.00 39.64 37.39 4req n ILE 465 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 4req n GLY 466 N 3.82 1.80 0.59 7.39 0.00 -0.18 -4.87 105.19 113.75 4req n GLY 466 Ca 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 4req n GLY 466 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 4req n VAL 467 N -2.00 0.67 -0.11 1.61 0.31 -1.01 -4.43 118.33 113.36 4req n VAL 467 Ca 0.00 0.26 0.04 0.00 -0.01 0.00 0.00 64.34 64.63 4req n VAL 467 Cb 0.00 -1.57 0.12 0.00 -0.91 0.00 0.00 33.84 31.48 4req n VAL 467 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 4req n ASN 468 N -3.20 2.69 -3.63 4.52 0.23 -1.02 -4.80 115.26 110.05 4req n ASN 468 Ca -0.03 -1.96 -0.04 0.00 -0.53 0.00 0.00 54.58 52.01 4req n ASN 468 Cb 0.11 -0.18 -0.06 0.00 -2.08 0.00 0.00 39.78 37.58 4req n ASN 468 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 4req s LYS 469 N -0.98 0.58 -1.18 -3.83 2.20 -1.25 -4.91 119.74 110.37 4req s LYS 469 Ca 0.18 1.09 -0.02 0.00 -0.36 0.00 0.00 55.97 56.87 4req s LYS 469 Cb 0.10 0.27 0.00 0.00 -1.51 0.00 0.00 37.83 36.68 4req s LYS 469 CO 0.13 -0.14 1.00 0.66 -0.36 0.00 0.00 175.35 176.64 4req n TYR 470 N 4.40 -2.25 -2.09 4.03 4.01 -1.26 -1.01 117.16 123.00 4req n TYR 470 Ca -0.18 0.92 -0.36 0.00 -0.16 0.00 0.00 57.90 58.12 4req n TYR 470 Cb 0.57 -4.93 0.02 0.00 -0.31 0.00 0.00 39.34 34.69 4req n TYR 470 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 4req s ARG 471 N -5.52 3.14 0.44 -0.72 1.81 -1.26 -3.92 118.95 112.92 4req s ARG 471 Ca 0.13 1.78 -0.15 0.00 -1.72 0.00 0.00 55.73 55.78 4req s ARG 471 Cb -0.06 -1.99 -0.08 0.00 -0.45 0.00 0.00 34.95 32.37 4req s ARG 471 CO 0.70 -1.06 0.87 -0.51 -0.68 0.00 0.00 175.30 174.62 4req s LEU 472 N -3.91 3.78 0.05 2.53 1.43 -1.26 -4.98 118.68 116.32 4req s LEU 472 Ca 0.75 1.38 -0.26 0.00 -1.03 0.00 0.00 54.13 54.97 4req s LEU 472 Cb -0.29 -4.28 -0.14 0.00 0.03 0.00 0.00 46.19 41.52 4req s LEU 472 CO 0.32 -0.45 1.40 -0.33 0.23 0.00 0.00 176.35 177.51 4req h GLU 473 N 1.29 -0.84 -5.14 1.70 5.08 -2.00 -3.43 114.58 111.24 4req h GLU 473 Ca -0.47 0.06 -0.49 0.00 -1.00 0.00 0.00 59.36 57.46 4req h GLU 473 Cb 1.18 0.19 -0.30 0.00 0.50 0.00 0.00 28.75 30.33 4req h GLU 473 CO 0.63 -0.56 -0.81 -1.01 -1.00 0.00 0.00 179.01 176.25 4req s HIS 474 N -5.06 1.29 -0.10 4.33 3.76 -1.26 -5.13 115.29 113.12 4req s HIS 474 Ca -0.14 -0.29 -0.26 0.00 -0.15 0.00 0.00 55.06 54.22 4req s HIS 474 Cb 0.02 -0.86 -0.02 0.00 1.11 0.00 0.00 32.58 32.83 4req s HIS 474 CO 0.42 -0.07 0.85 -1.21 -0.85 0.00 0.00 174.74 173.88 4req s GLU 475 N -0.13 4.40 0.64 1.40 0.41 -1.26 -5.03 118.70 119.12 4req s GLU 475 Ca 0.02 1.11 -0.18 0.00 -0.41 0.00 0.00 54.97 55.51 4req s GLU 475 Cb -0.07 -3.51 -0.01 0.00 -1.78 0.00 0.00 34.13 28.75 4req s GLU 475 CO 0.00 -0.17 1.26 -2.14 -0.49 0.00 0.00 175.26 173.72 4req s PRO 476 N 1.56 2.65 0.51 0.39 0.02 -1.26 -4.95 135.00 133.92 4req s PRO 476 Ca 0.42 1.97 -0.23 0.00 0.02 0.00 0.00 61.00 63.18 4req s PRO 476 Cb -0.18 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.41 4req s PRO 476 CO 0.18 -1.50 1.35 -0.35 -0.33 0.00 0.00 177.00 176.35 4req n PRO 477 N -1.87 1.83 -3.91 5.54 -0.04 -1.26 -5.02 135.00 130.27 4req n PRO 477 Ca 0.15 0.66 -0.21 0.00 -0.04 0.00 0.00 63.50 64.06 4req n PRO 477 Cb 0.49 -2.55 -0.17 0.00 -0.04 0.00 0.00 33.50 31.23 4req n PRO 477 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 4req s LEU 478 N -2.99 0.89 -0.13 1.53 2.96 -1.26 -5.11 118.68 114.56 4req s LEU 478 Ca 0.68 -0.09 -0.29 0.00 -0.22 0.00 0.00 54.13 54.21 4req s LEU 478 Cb -0.44 -0.41 -0.02 0.00 0.50 0.00 0.00 46.19 45.83 4req s LEU 478 CO 0.52 -0.14 1.19 -1.81 -1.32 0.00 0.00 176.35 174.79 4req s ASP 479 N 1.53 7.03 0.18 3.68 1.11 -1.26 -5.02 116.67 123.91 4req s ASP 479 Ca -0.02 1.67 0.09 0.00 0.18 0.00 0.00 52.55 54.47 4req s ASP 479 Cb -0.13 -2.55 -0.04 0.00 1.07 0.00 0.00 42.92 41.27 4req s ASP 479 CO -0.03 -0.66 -0.19 0.68 1.18 0.00 0.00 175.17 176.15 4req s VAL 480 N 2.89 1.95 0.15 -1.27 -7.23 -1.26 -4.96 120.40 110.68 4req s VAL 480 Ca 0.53 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 4req s VAL 480 Cb -0.21 -1.94 -0.07 0.00 0.56 0.00 0.00 36.38 34.71 4req s VAL 480 CO 0.16 -0.30 1.23 -0.22 -0.31 0.00 0.00 175.10 175.66 4req s LEU 481 N -2.77 4.42 -0.12 1.32 2.96 -1.26 -5.01 118.68 118.22 4req s LEU 481 Ca 0.18 2.21 0.02 0.00 -0.22 0.00 0.00 54.13 56.32 4req s LEU 481 Cb -0.06 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 43.05 4req s LEU 481 CO 0.08 -0.45 -0.16 -0.75 -1.32 0.00 0.00 176.35 173.75 4req s LYS 482 N 0.25 2.38 -0.06 1.98 2.20 -1.26 -4.56 119.74 120.67 4req s LYS 482 Ca 0.56 -0.62 -0.18 0.00 -0.36 0.00 0.00 55.97 55.38 4req s LYS 482 Cb -0.33 -2.01 -0.05 0.00 -1.51 0.00 0.00 37.83 33.93 4req s LYS 482 CO 0.34 -0.07 0.48 0.08 -0.36 0.00 0.00 175.35 175.82 4req s VAL 483 N 0.99 5.09 -0.60 4.02 1.01 -1.26 -5.01 120.40 124.64 4req s VAL 483 Ca -0.06 0.97 -0.21 0.00 0.00 0.00 0.00 61.98 62.68 4req s VAL 483 Cb -0.15 -3.81 0.07 0.00 0.00 0.00 0.00 36.38 32.49 4req s VAL 483 CO -0.02 0.41 0.84 -0.62 0.00 0.00 0.00 175.10 175.71 4req s ASP 484 N -0.00 6.21 0.15 3.32 2.15 -1.26 -4.93 116.67 122.31 4req s ASP 484 Ca 0.26 -0.97 -0.17 0.00 0.43 0.00 0.00 52.55 52.10 4req s ASP 484 Cb -0.16 -2.37 0.03 0.00 -0.30 0.00 0.00 42.92 40.12 4req s ASP 484 CO 0.12 -1.23 1.77 -1.13 -0.17 0.00 0.00 175.17 174.53 4req h ASN 485 N 9.34 0.21 -0.83 -0.34 -0.73 -1.95 -2.97 115.58 118.32 4req h ASN 485 Ca -0.28 0.02 0.05 0.00 1.87 0.00 0.00 56.30 57.96 4req h ASN 485 Cb 1.08 -0.02 -0.06 0.00 0.27 0.00 0.00 38.32 39.60 4req h ASN 485 CO 1.11 0.16 0.51 0.77 -0.37 0.00 0.00 177.43 179.62 4req h SER 486 N 0.32 0.82 0.23 1.15 4.64 -1.93 -1.86 113.55 116.92 4req h SER 486 Ca 0.14 0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.33 4req h SER 486 Cb 0.07 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 4req h SER 486 CO -0.11 0.53 -0.58 0.00 -0.87 0.00 0.00 176.83 175.80 4req h THR 487 N 0.95 1.36 -0.22 2.95 1.03 -1.96 -2.51 112.91 114.51 4req h THR 487 Ca 0.35 -1.89 -0.06 0.00 -0.01 0.00 0.00 66.41 64.80 4req h THR 487 Cb 0.13 1.91 -0.01 0.00 -1.07 0.00 0.00 68.15 69.11 4req h THR 487 CO -0.16 0.57 -0.11 0.58 -0.01 0.00 0.00 175.52 176.39 4req h VAL 488 N 0.27 1.30 0.13 0.00 2.07 -1.37 -2.23 116.25 116.42 4req h VAL 488 Ca -0.00 -1.18 0.02 0.00 0.82 0.00 0.00 66.70 66.36 4req h VAL 488 Cb 1.09 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 4req h VAL 488 CO 0.10 0.36 -0.27 0.25 0.02 0.00 0.00 177.57 178.03 4req h LEU 489 N 0.18 -0.76 -0.51 2.57 5.85 -1.35 -0.79 115.31 120.50 4req h LEU 489 Ca 0.05 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.90 4req h LEU 489 Cb 0.61 0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 4req h LEU 489 CO 0.03 -0.36 0.26 0.00 -0.34 0.00 0.00 178.44 178.04 4req h ALA 490 N 0.24 0.65 -0.54 1.25 0.00 -1.47 -0.19 119.26 119.20 4req h ALA 490 Ca 0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 4req h ALA 490 Cb 0.50 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 4req h ALA 490 CO -0.15 -0.08 0.31 0.93 0.00 0.00 0.00 179.25 180.26 4req h GLU 491 N 0.51 0.75 -0.29 0.00 5.08 -1.07 -1.02 114.58 118.54 4req h GLU 491 Ca 0.22 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 4req h GLU 491 Cb 0.13 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 4req h GLU 491 CO -0.15 0.56 0.05 1.96 -1.00 0.00 0.00 179.01 180.42 4req h GLN 492 N 0.73 0.48 -0.13 2.33 1.08 -0.86 -2.23 115.11 116.51 4req h GLN 492 Ca 0.19 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 4req h GLN 492 Cb 0.02 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 4req h GLN 492 CO -0.03 0.59 0.08 0.87 -0.95 0.00 0.00 178.83 179.39 4req h LYS 493 N 0.30 0.17 -0.69 1.46 1.57 -0.88 -2.18 116.57 116.32 4req h LYS 493 Ca 0.09 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.96 4req h LYS 493 Cb 0.34 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.54 4req h LYS 493 CO 0.01 0.12 0.31 0.00 -0.57 0.00 0.00 179.45 179.32 4req h ALA 494 N 1.04 0.93 -0.74 3.86 0.00 -1.07 -1.81 119.26 121.48 4req h ALA 494 Ca 0.05 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 4req h ALA 494 Cb -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 4req h ALA 494 CO -0.01 -0.11 0.33 0.87 0.00 0.00 0.00 179.25 180.33 4req h LYS 495 N 0.52 1.08 -0.30 0.00 1.57 -1.23 -1.79 116.57 116.43 4req h LYS 495 Ca 0.35 -0.17 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 4req h LYS 495 Cb 0.41 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 4req h LYS 495 CO -0.30 0.86 -0.42 -0.07 -0.57 0.00 0.00 179.45 178.95 4req h LEU 496 N 1.05 0.79 0.20 2.94 3.38 -0.91 -0.28 115.31 122.49 4req h LEU 496 Ca 0.25 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 4req h LEU 496 Cb 0.15 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.68 4req h LEU 496 CO -0.03 1.11 -0.10 0.58 0.09 0.00 0.00 178.44 180.10 4req h VAL 497 N 0.60 0.88 -0.09 1.22 2.07 -1.23 -1.82 116.25 117.88 4req h VAL 497 Ca 0.04 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.12 4req h VAL 497 Cb 0.98 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 4req h VAL 497 CO 0.09 0.11 -0.19 0.50 0.02 0.00 0.00 177.57 178.10 4req h LYS 498 N -0.51 -0.25 -0.42 1.57 3.64 -1.27 -2.12 116.57 117.22 4req h LYS 498 Ca -0.03 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.46 4req h LYS 498 Cb 0.39 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.18 4req h LYS 498 CO 0.05 -0.16 -0.16 1.25 -2.27 0.00 0.00 179.45 178.15 4req h LEU 499 N -0.26 -0.58 -0.50 5.20 5.85 -0.95 -0.81 115.31 123.26 4req h LEU 499 Ca 0.09 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.96 4req h LEU 499 Cb 0.38 0.33 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 4req h LEU 499 CO -0.24 -0.20 0.32 0.03 -0.34 0.00 0.00 178.44 178.01 4req h ARG 500 N -0.08 0.67 -0.13 1.25 3.08 -1.14 -0.61 114.38 117.42 4req h ARG 500 Ca 0.21 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 4req h ARG 500 Cb 0.39 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 4req h ARG 500 CO -0.48 0.46 0.00 0.00 -1.07 0.00 0.00 179.97 178.88 4req h ALA 501 N 1.17 0.17 0.00 0.04 0.00 -1.06 -3.28 119.26 116.31 4req h ALA 501 Ca 0.18 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 4req h ALA 501 Cb -0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 4req h ALA 501 CO -0.04 -0.14 -0.30 0.93 0.00 0.00 0.00 179.25 179.70 4req h GLU 502 N -0.03 0.00 -7.52 0.00 3.07 -1.01 -3.46 114.58 105.62 4req h GLU 502 Ca 0.04 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 58.44 4req h GLU 502 Cb 0.35 0.00 0.12 0.00 -0.84 0.00 0.00 28.75 28.38 4req h GLU 502 CO 0.01 0.30 0.31 -0.98 -1.40 0.00 0.00 179.01 177.25 4req s ARG 503 N -3.65 1.45 -0.38 2.33 1.70 -0.25 -5.04 118.95 115.11 4req s ARG 503 Ca 0.00 -0.43 -0.12 0.00 -0.47 0.00 0.00 55.73 54.72 4req s ARG 503 Cb 0.11 -2.04 0.02 0.00 -0.57 0.00 0.00 34.95 32.47 4req s ARG 503 CO 0.66 -1.79 0.23 0.34 -1.08 0.00 0.00 175.30 173.66 4req s ASP 504 N -4.72 5.82 0.52 -2.89 -1.08 -1.26 -4.98 116.67 108.08 4req s ASP 504 Ca 0.67 -0.94 0.25 0.00 -0.52 0.00 0.00 52.55 52.01 4req s ASP 504 Cb -0.07 -2.06 1.43 0.00 -1.46 0.00 0.00 42.92 40.76 4req s ASP 504 CO 0.48 -0.39 2.09 -0.65 0.52 0.00 0.00 175.17 177.23 4req h PRO 505 N 8.48 0.00 0.54 4.34 0.11 -1.95 -2.87 132.00 140.66 4req h PRO 505 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.82 4req h PRO 505 Cb 1.11 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.23 4req h PRO 505 CO 0.68 0.11 -0.26 1.05 -0.21 0.00 0.00 178.00 179.37 4req h GLU 506 N 0.00 -0.70 -0.68 1.05 9.09 -2.00 -3.02 114.58 118.32 4req h GLU 506 Ca -0.00 0.05 0.09 0.00 0.05 0.00 0.00 59.36 59.55 4req h GLU 506 Cb 0.26 0.16 -0.11 0.00 -1.65 0.00 0.00 28.75 27.41 4req h GLU 506 CO 0.01 -0.47 -0.46 0.87 0.05 0.00 0.00 179.01 179.01 4req h LYS 507 N -1.02 -0.18 -0.14 1.06 1.57 -1.95 -2.27 116.57 113.64 4req h LYS 507 Ca -0.07 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 4req h LYS 507 Cb 0.56 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.84 4req h LYS 507 CO 0.12 -0.12 -0.49 0.28 -0.57 0.00 0.00 179.45 178.67 4req h VAL 508 N -0.18 0.06 -0.56 0.50 2.07 -1.62 0.24 116.25 116.74 4req h VAL 508 Ca 0.19 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.77 4req h VAL 508 Cb 0.55 0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 4req h VAL 508 CO -0.75 0.00 0.27 0.50 0.02 0.00 0.00 177.57 177.61 4req h LYS 509 N -0.54 0.50 0.56 1.57 3.64 -1.33 0.50 116.57 121.47 4req h LYS 509 Ca 0.05 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 4req h LYS 509 Cb 0.66 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 32.37 4req h LYS 509 CO -0.43 0.33 -0.27 0.00 -2.27 0.00 0.00 179.45 176.81 4req h ALA 510 N 1.32 -0.76 -0.32 5.00 0.00 -1.09 0.45 119.26 123.87 4req h ALA 510 Ca 0.26 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.07 4req h ALA 510 Cb 0.20 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 4req h ALA 510 CO -0.20 -0.93 -0.10 0.00 0.00 0.00 0.00 179.25 178.02 4req h ALA 511 N -0.31 0.18 -0.11 0.00 0.00 -0.15 0.47 119.26 119.34 4req h ALA 511 Ca -0.08 0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.97 4req h ALA 511 Cb 0.58 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 4req h ALA 511 CO 0.12 -0.49 0.01 -0.07 0.00 0.00 0.00 179.25 178.82 4req h LEU 512 N -0.03 -0.02 -1.02 0.00 3.38 0.10 -2.69 115.31 115.03 4req h LEU 512 Ca 0.16 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 4req h LEU 512 Cb 0.27 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 4req h LEU 512 CO -0.35 0.01 0.42 0.44 0.09 0.00 0.00 178.44 179.05 4req h ASP 513 N 0.05 1.00 -0.67 -0.43 3.32 0.10 -2.18 116.42 117.61 4req h ASP 513 Ca 0.05 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.07 4req h ASP 513 Cb 0.05 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 4req h ASP 513 CO -0.08 0.81 0.38 0.50 -1.72 0.00 0.00 179.24 179.14 4req h LYS 514 N 1.12 0.68 0.19 3.56 3.64 0.02 0.49 116.57 126.26 4req h LYS 514 Ca 0.28 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.62 4req h LYS 514 Cb 0.05 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 4req h LYS 514 CO -0.04 0.45 -0.15 0.82 -2.27 0.00 0.00 179.45 178.25 4req h ILE 515 N 0.70 0.66 -0.60 2.00 2.04 -1.06 -0.68 117.51 120.56 4req h ILE 515 Ca 0.30 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.21 4req h ILE 515 Cb 0.19 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 4req h ILE 515 CO -0.18 0.00 0.32 0.74 0.00 0.00 0.00 178.15 179.03 4req h THR 516 N -0.36 0.97 0.33 -0.27 2.02 -1.09 0.13 112.91 114.64 4req h THR 516 Ca -0.01 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.97 4req h THR 516 Cb 0.32 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 4req h THR 516 CO -0.02 0.11 -0.36 -0.25 0.37 0.00 0.00 175.52 175.38 4req h TRP 517 N 0.61 -0.97 -0.67 3.16 7.01 -0.76 0.12 115.95 124.46 4req h TRP 517 Ca 0.26 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.34 4req h TRP 517 Cb 0.16 0.38 -0.06 0.00 -2.10 0.00 0.00 29.16 27.54 4req h TRP 517 CO -0.09 -0.50 0.35 0.00 -2.79 0.00 0.00 178.44 175.42 4req h ALA 518 N -0.25 0.90 -0.44 2.65 0.00 -0.78 0.16 119.26 121.50 4req h ALA 518 Ca -0.02 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.98 4req h ALA 518 Cb 0.66 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 4req h ALA 518 CO -0.08 0.01 0.15 0.00 0.00 0.00 0.00 179.25 179.33 4req h ALA 519 N 1.37 0.52 0.00 0.00 0.00 -0.11 -2.16 119.26 118.88 4req h ALA 519 Ca 0.31 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 4req h ALA 519 Cb 0.24 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 4req h ALA 519 CO -0.21 -0.24 -0.39 0.78 0.00 0.00 0.00 179.25 179.19 4req h GLY 520 N 0.32 0.00 -6.97 0.00 0.00 0.17 -3.40 103.07 93.20 4req h GLY 520 Ca 0.21 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.92 4req h GLY 520 CO -0.21 0.00 -0.65 -1.31 0.00 0.00 0.00 176.54 174.37 4req s ASN 521 N -6.66 4.20 -0.34 0.19 0.01 0.48 -5.08 114.94 107.74 4req s ASN 521 Ca -0.02 -3.67 -0.29 0.00 -0.71 0.00 0.00 52.86 48.17 4req s ASN 521 Cb 0.13 -1.42 0.00 0.00 0.41 0.00 0.00 41.25 40.37 4req s ASN 521 CO 0.70 -0.11 1.41 -2.16 -1.51 0.00 0.00 177.10 175.43 4req s PRO 522 N -1.13 3.73 -0.32 -0.60 0.04 -1.23 -4.73 135.00 130.76 4req s PRO 522 Ca 0.26 1.16 0.03 0.00 0.04 0.00 0.00 61.00 62.49 4req s PRO 522 Cb -0.04 -3.97 0.09 0.00 0.04 0.00 0.00 34.50 30.62 4req s PRO 522 CO -0.16 -1.37 0.03 0.34 0.04 0.00 0.00 177.00 175.88 4req s ASP 523 N 3.59 4.54 0.56 6.66 2.15 -1.26 -5.01 116.67 127.90 4req s ASP 523 Ca 0.61 -1.91 0.29 0.00 0.43 0.00 0.00 52.55 51.98 4req s ASP 523 Cb -0.16 -1.46 1.69 0.00 -0.30 0.00 0.00 42.92 42.68 4req s ASP 523 CO 0.28 -0.35 2.18 -2.24 -0.17 0.00 0.00 175.17 174.87 4req h ASP 524 N 7.74 0.00 -0.04 -0.34 3.04 -1.94 -2.43 116.42 122.44 4req h ASP 524 Ca -0.08 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.71 4req h ASP 524 Cb 1.03 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.32 4req h ASP 524 CO 0.50 0.05 0.00 0.29 -2.04 0.00 0.00 179.24 178.04 4req n LYS 525 N -3.72 1.25 -3.87 4.15 4.01 -1.26 -4.67 118.16 114.04 4req n LYS 525 Ca -0.02 -0.37 -0.33 0.00 -0.51 0.00 0.00 58.31 57.07 4req n LYS 525 Cb 0.15 -1.37 -0.13 0.00 -0.51 0.00 0.00 35.03 33.17 4req n LYS 525 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 4req s ASP 526 N -1.69 4.92 0.26 4.39 2.15 -0.92 -5.00 116.67 120.78 4req s ASP 526 Ca 0.33 -2.42 -0.02 0.00 0.43 0.00 0.00 52.55 50.88 4req s ASP 526 Cb 0.16 -1.74 0.47 0.00 -0.30 0.00 0.00 42.92 41.52 4req s ASP 526 CO 0.27 -0.40 1.82 1.55 -0.17 0.00 0.00 175.17 178.23 4req h PRO 527 N 7.42 0.86 0.00 4.34 0.13 -1.84 -2.91 132.00 139.99 4req h PRO 527 Ca -0.07 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 4req h PRO 527 Cb 0.99 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.93 4req h PRO 527 CO 0.64 0.57 0.00 -0.25 -0.23 0.00 0.00 178.00 178.73 4req n ASP 528 N -4.69 0.46 -0.36 1.44 8.00 -1.26 -1.99 116.55 118.15 4req n ASP 528 Ca 0.16 0.71 0.09 0.00 0.71 0.00 0.00 54.79 56.46 4req n ASP 528 Cb 0.32 -0.77 -0.02 0.00 -0.02 0.00 0.00 41.12 40.63 4req n ASP 528 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 4req n ARG 529 N -2.11 1.40 -1.65 -1.24 0.63 -1.10 -4.78 116.66 107.81 4req n ARG 529 Ca -0.01 -0.75 -0.47 0.00 -0.92 0.00 0.00 57.85 55.70 4req n ARG 529 Cb 0.04 -1.36 -0.04 0.00 0.45 0.00 0.00 32.46 31.54 4req n ARG 529 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 4req n ASN 530 N -0.30 2.61 -0.22 6.15 2.85 -0.84 -4.78 115.26 120.71 4req n ASN 530 Ca 0.07 1.10 -0.01 0.00 -0.11 0.00 0.00 54.58 55.63 4req n ASN 530 Cb 0.38 -1.36 0.10 0.00 1.24 0.00 0.00 39.78 40.14 4req n ASN 530 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 4req h LEU 531 N 5.23 0.47 -0.17 1.20 3.38 -1.91 0.18 115.31 123.68 4req h LEU 531 Ca -0.46 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 4req h LEU 531 Cb 1.28 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 4req h LEU 531 CO 0.83 0.29 0.08 0.25 0.09 0.00 0.00 178.44 179.98 4req h LEU 532 N 0.61 0.23 -0.59 1.67 5.85 -1.91 -0.59 115.31 120.58 4req h LEU 532 Ca 0.30 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.92 4req h LEU 532 Cb 0.25 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 4req h LEU 532 CO -0.22 0.31 0.34 0.50 -0.34 0.00 0.00 178.44 179.03 4req h LYS 533 N 0.14 0.63 0.00 1.25 3.11 -1.74 -1.50 116.57 118.46 4req h LYS 533 Ca 0.06 -0.04 -0.12 0.00 -2.81 0.00 0.00 60.65 57.74 4req h LYS 533 Cb 0.15 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.22 4req h LYS 533 CO -0.01 0.42 -0.56 -0.07 -2.81 0.00 0.00 179.45 176.42 4req h LEU 534 N 0.65 0.00 -0.70 5.20 3.38 -0.48 -2.83 115.31 120.53 4req h LEU 534 Ca 0.25 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 4req h LEU 534 Cb 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 4req h LEU 534 CO -0.14 0.56 -0.01 0.00 0.09 0.00 0.00 178.44 178.94 4req h ILE 536 N 0.90 1.10 -0.18 0.00 2.04 -1.12 0.16 117.51 120.41 4req h ILE 536 Ca 0.16 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 4req h ILE 536 Cb 0.54 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 4req h ILE 536 CO 0.03 0.16 -0.05 0.44 0.00 0.00 0.00 178.15 178.73 4req h ASP 537 N 0.90 0.35 -0.28 1.72 3.32 -1.25 -2.05 116.42 119.14 4req h ASP 537 Ca 0.30 -0.38 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 4req h ASP 537 Cb 0.03 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 4req h ASP 537 CO -0.12 0.65 0.15 0.00 -1.72 0.00 0.00 179.24 178.21 4req h ALA 538 N 0.72 0.36 -0.88 3.45 0.00 -0.62 -2.36 119.26 119.93 4req h ALA 538 Ca 0.04 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.91 4req h ALA 538 Cb 0.50 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 4req h ALA 538 CO 0.02 -0.10 0.58 0.78 0.00 0.00 0.00 179.25 180.53 4req h GLY 539 N 0.34 1.25 1.64 0.00 0.00 -0.68 -1.77 103.07 103.85 4req h GLY 539 Ca 0.10 -0.44 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 4req h GLY 539 CO -0.02 0.40 -0.20 -0.09 0.00 0.00 0.00 176.54 176.63 4req h ARG 540 N 1.13 0.43 -0.00 4.80 2.43 -1.29 -2.70 114.38 119.18 4req h ARG 540 Ca 0.34 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 4req h ARG 540 Cb -0.03 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 4req h ARG 540 CO -0.09 0.62 -0.02 0.00 -1.51 0.00 0.00 179.97 178.96 4req n ALA 541 N -2.48 2.57 -1.23 2.80 0.00 -0.79 -4.92 120.51 116.45 4req n ALA 541 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 4req n ALA 541 Cb 0.36 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.34 4req n ALA 541 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 4req n MET 542 N -1.17 0.00 -2.04 0.00 2.81 -0.99 -4.54 117.12 111.18 4req n MET 542 Ca 0.16 0.17 -0.33 0.00 -1.81 0.00 0.00 57.70 55.89 4req n MET 542 Cb 0.22 -2.92 0.01 0.00 -0.71 0.00 0.00 33.22 29.83 4req n MET 542 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 4req s ALA 543 N -2.00 2.72 0.56 3.04 0.00 -0.74 -4.94 121.76 120.39 4req s ALA 543 Ca 0.00 0.43 0.03 0.00 0.00 0.00 0.00 51.96 52.41 4req s ALA 543 Cb 0.00 -3.24 0.05 0.00 0.00 0.00 0.00 23.12 19.92 4req s ALA 543 CO 0.00 -0.83 0.77 0.95 0.00 0.00 0.00 175.76 176.65 4req s THR 544 N -2.41 2.60 0.09 0.00 -4.23 -1.26 -4.60 115.64 105.82 4req s THR 544 Ca 0.64 -0.74 -0.21 0.00 -1.18 0.00 0.00 61.69 60.20 4req s THR 544 Cb -0.17 -2.86 -0.11 0.00 1.34 0.00 0.00 72.50 70.70 4req s THR 544 CO 0.36 0.00 1.65 0.58 -0.54 0.00 0.00 174.62 176.68 4req h VAL 545 N 0.09 1.12 -0.12 2.29 2.07 -0.85 -1.25 116.25 119.60 4req h VAL 545 Ca -0.40 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 4req h VAL 545 Cb 1.29 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 4req h VAL 545 CO 0.48 0.11 0.05 1.23 0.02 0.00 0.00 177.57 179.46 4req h GLY 546 N 0.07 0.18 0.54 2.17 0.00 -1.81 -0.60 103.07 103.62 4req h GLY 546 Ca 0.04 -0.09 0.02 0.00 0.00 0.00 0.00 47.33 47.30 4req h GLY 546 CO -0.01 0.09 -0.25 0.83 0.00 0.00 0.00 176.54 177.20 4req h GLU 547 N 0.05 -0.43 -0.89 4.80 5.08 -1.82 0.70 114.58 122.07 4req h GLU 547 Ca 0.04 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.48 4req h GLU 547 Cb 0.14 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 4req h GLU 547 CO -0.00 -0.28 0.58 0.52 -1.00 0.00 0.00 179.01 178.82 4req h MET 548 N -0.44 1.02 -0.12 2.33 2.86 -1.25 -1.03 114.93 118.30 4req h MET 548 Ca 0.03 -0.06 -0.15 0.00 -2.06 0.00 0.00 59.70 57.46 4req h MET 548 Cb 0.48 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 4req h MET 548 CO -0.16 0.67 -0.59 0.77 1.06 0.00 0.00 176.91 178.67 4req h SER 549 N 1.05 0.44 -0.34 1.22 0.02 -0.65 -3.00 113.55 112.28 4req h SER 549 Ca 0.37 -0.24 -0.12 0.00 -0.84 0.00 0.00 61.79 60.96 4req h SER 549 Cb 0.12 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 4req h SER 549 CO -0.12 0.92 -0.24 0.44 -1.14 0.00 0.00 176.83 176.69 4req h ASP 550 N 0.29 0.80 -0.87 3.07 3.32 -0.36 -1.46 116.42 121.22 4req h ASP 550 Ca -0.00 -0.44 0.18 0.00 0.02 0.00 0.00 57.03 56.79 4req h ASP 550 Cb 1.11 -0.22 -0.11 0.00 0.22 0.00 0.00 39.33 40.33 4req h ASP 550 CO 0.10 1.07 0.41 0.00 -1.72 0.00 0.00 179.24 179.10 4req h ALA 551 N 0.76 1.34 0.01 3.45 0.00 -1.09 0.83 119.26 124.55 4req h ALA 551 Ca 0.07 0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.89 4req h ALA 551 Cb 0.80 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 4req h ALA 551 CO 0.06 -0.21 -0.91 -0.07 0.00 0.00 0.00 179.25 178.13 4req h LEU 552 N 0.52 0.35 -1.23 0.00 3.38 -1.46 -3.33 115.31 113.54 4req h LEU 552 Ca 0.50 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 4req h LEU 552 Cb 0.83 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 4req h LEU 552 CO -0.44 1.09 0.27 -0.08 0.09 0.00 0.00 178.44 179.37 4req h GLU 553 N 0.15 0.80 -0.56 1.13 4.81 0.26 0.35 114.58 121.52 4req h GLU 553 Ca -0.06 -0.10 0.11 0.00 -0.13 0.00 0.00 59.36 59.18 4req h GLU 553 Cb 1.54 -0.15 -0.11 0.00 0.63 0.00 0.00 28.75 30.66 4req h GLU 553 CO 0.14 0.63 -0.22 0.87 -0.73 0.00 0.00 179.01 179.71 4req h LYS 554 N 0.80 -0.08 0.15 1.92 1.79 -1.48 0.69 116.57 120.36 4req h LYS 554 Ca 0.20 0.01 -0.32 0.00 -2.18 0.00 0.00 60.65 58.35 4req h LYS 554 Cb 0.10 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.76 4req h LYS 554 CO -0.03 -0.05 -1.65 0.28 -1.08 0.00 0.00 179.45 176.93 4req h VAL 555 N -0.08 0.93 0.00 0.50 2.07 -1.77 -3.40 116.25 114.50 4req h VAL 555 Ca 0.26 -2.43 -0.16 0.00 0.82 0.00 0.00 66.70 65.18 4req h VAL 555 Cb 0.48 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.93 4req h VAL 555 CO -0.62 0.79 -0.90 -0.26 0.02 0.00 0.00 177.57 176.61 4req h PHE 556 N -0.08 0.00 -0.69 1.57 0.04 -0.68 -3.50 116.94 113.60 4req h PHE 556 Ca -0.34 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.51 4req h PHE 556 Cb 1.94 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 40.06 4req h PHE 556 CO 0.11 0.71 -0.16 0.41 -0.60 0.00 0.00 178.31 178.78 4req n GLY 557 N 1.32 -1.86 3.55 -1.45 0.00 0.24 -4.55 105.19 102.43 4req n GLY 557 Ca -0.02 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.24 4req n GLY 557 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 4req s ARG 558 N -1.93 2.57 0.19 1.61 0.52 -1.26 -4.31 118.95 116.34 4req s ARG 558 Ca 0.00 -0.67 -0.11 0.00 -0.52 0.00 0.00 55.73 54.42 4req s ARG 558 Cb 0.00 -2.48 -0.07 0.00 0.52 0.00 0.00 34.95 32.92 4req s ARG 558 CO 0.00 0.63 0.54 -0.47 0.02 0.00 0.00 175.30 176.02 4req s TYR 559 N -0.85 3.50 -0.05 -0.53 5.04 0.27 -4.77 117.35 119.96 4req s TYR 559 Ca 0.14 0.94 0.03 0.00 -2.44 0.00 0.00 57.07 55.74 4req s TYR 559 Cb -0.11 -2.30 0.00 0.00 0.35 0.00 0.00 41.96 39.91 4req s TYR 559 CO 0.03 0.35 -0.14 0.99 -1.34 0.00 0.00 175.55 175.44 4req s THR 560 N -1.65 1.24 0.22 4.34 2.01 -1.26 -4.95 115.64 115.59 4req s THR 560 Ca 0.43 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 4req s THR 560 Cb -0.13 -1.09 -0.05 0.00 0.01 0.00 0.00 72.50 71.24 4req s THR 560 CO 0.20 0.37 0.46 0.00 -0.69 0.00 0.00 174.62 174.96 4req s ALA 561 N 0.30 3.72 -0.00 7.40 0.00 -1.26 -5.08 121.76 126.84 4req s ALA 561 Ca -0.08 -0.62 -0.18 0.00 0.00 0.00 0.00 51.96 51.07 4req s ALA 561 Cb -0.13 -2.18 -0.06 0.00 0.00 0.00 0.00 23.12 20.76 4req s ALA 561 CO 0.03 0.42 0.52 -1.14 0.00 0.00 0.00 175.76 175.58 4req s GLN 562 N -3.23 4.19 0.03 0.00 0.74 -1.26 -5.02 119.66 115.11 4req s GLN 562 Ca 0.42 0.60 -0.16 0.00 0.05 0.00 0.00 55.36 56.27 4req s GLN 562 Cb -0.11 -3.30 -0.06 0.00 1.10 0.00 0.00 33.01 30.64 4req s GLN 562 CO 0.28 0.49 0.46 0.42 -0.55 0.00 0.00 175.29 176.39 4req s ILE 563 N -0.53 4.94 -0.06 -2.34 -1.09 -1.26 -5.08 121.20 115.78 4req s ILE 563 Ca 0.28 0.94 -0.02 0.00 -2.23 0.00 0.00 60.65 59.61 4req s ILE 563 Cb -0.18 -3.76 0.04 0.00 -1.58 0.00 0.00 42.46 36.98 4req s ILE 563 CO 0.15 0.55 0.11 -0.13 -1.23 0.00 0.00 174.94 174.40 4req s ARG 564 N -1.15 0.02 -0.08 2.79 0.52 -1.26 -5.15 118.95 114.64 4req s ARG 564 Ca 0.26 0.38 0.03 0.00 -0.52 0.00 0.00 55.73 55.89 4req s ARG 564 Cb -0.17 -0.26 0.00 0.00 0.52 0.00 0.00 34.95 35.04 4req s ARG 564 CO 0.15 -0.23 -0.19 0.99 0.02 0.00 0.00 175.30 176.05 4req s THR 565 N 1.58 1.65 0.81 0.02 2.01 -1.26 -4.96 115.64 115.49 4req s THR 565 Ca -0.04 -0.79 -0.11 0.00 0.31 0.00 0.00 61.69 61.06 4req s THR 565 Cb -0.12 -1.45 0.08 0.00 0.01 0.00 0.00 72.50 71.02 4req s THR 565 CO -0.05 0.47 1.09 0.27 -0.69 0.00 0.00 174.62 175.71 4req s ILE 566 N 0.43 3.13 0.01 1.82 -4.36 -1.26 -5.08 121.20 115.89 4req s ILE 566 Ca -0.16 0.37 0.00 0.00 -0.26 0.00 0.00 60.65 60.60 4req s ILE 566 Cb -0.17 -2.92 -0.01 0.00 1.25 0.00 0.00 42.46 40.61 4req s ILE 566 CO 0.06 -0.48 -0.03 -0.94 0.24 0.00 0.00 174.94 173.80 4req s SER 567 N -3.52 0.24 -1.61 4.36 1.04 -1.26 -4.63 113.70 108.31 4req s SER 567 Ca 0.62 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.75 4req s SER 567 Cb -0.17 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.00 4req s SER 567 CO 0.56 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.24 4req n GLY 568 N 2.23 -0.21 0.13 7.32 0.00 -1.26 -4.92 105.19 108.48 4req n GLY 568 Ca -0.19 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 4req n GLY 568 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 4req n VAL 569 N -3.89 1.52 0.26 1.61 0.31 -1.26 -3.99 118.33 112.89 4req n VAL 569 Ca -0.22 -0.26 -0.17 0.00 -0.01 0.00 0.00 64.34 63.68 4req n VAL 569 Cb 0.66 -1.97 -0.09 0.00 -0.91 0.00 0.00 33.84 31.53 4req n VAL 569 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 4req h TYR 570 N -1.00 -1.31 -0.50 3.52 5.03 -1.91 -1.46 116.97 119.34 4req h TYR 570 Ca -0.56 0.01 0.05 0.00 2.58 0.00 0.00 58.73 60.81 4req h TYR 570 Cb 1.48 0.52 -0.05 0.00 1.55 0.00 0.00 36.73 40.23 4req h TYR 570 CO -0.11 -0.63 0.24 0.66 -1.32 0.00 0.00 178.16 177.00 4req h SER 571 N -0.92 0.33 -0.41 -2.11 4.64 -1.92 -3.08 113.55 110.09 4req h SER 571 Ca -0.04 0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.31 4req h SER 571 Cb 0.82 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 4req h SER 571 CO -0.09 0.23 0.27 0.50 -0.87 0.00 0.00 176.83 176.87 4req h LYS 572 N 0.47 0.54 -0.04 4.77 3.64 -1.65 -3.25 116.57 121.04 4req h LYS 572 Ca 0.23 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 4req h LYS 572 Cb 0.16 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 4req h LYS 572 CO -0.17 0.36 -0.43 1.49 -2.27 0.00 0.00 179.45 178.42 4req h GLU 573 N 0.55 -0.49 -2.94 1.90 4.57 -1.17 -3.25 114.58 113.76 4req h GLU 573 Ca 0.15 0.03 -0.62 0.00 -1.18 0.00 0.00 59.36 57.74 4req h GLU 573 Cb -0.06 0.11 -0.42 0.00 -0.16 0.00 0.00 28.75 28.23 4req h GLU 573 CO -0.04 -0.33 -0.55 0.28 -1.18 0.00 0.00 179.01 177.20 4req n VAL 574 N -4.85 1.85 -2.29 0.32 0.31 -1.25 -5.01 118.33 107.42 4req n VAL 574 Ca -0.05 -4.95 -0.35 0.00 -0.01 0.00 0.00 64.34 58.97 4req n VAL 574 Cb 0.31 -2.18 -0.00 0.00 -0.91 0.00 0.00 33.84 31.05 4req n VAL 574 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 4req s LYS 575 N -1.66 3.45 -0.39 5.55 0.00 -1.23 -4.22 119.74 121.25 4req s LYS 575 Ca 0.28 1.60 0.00 0.00 0.00 0.00 0.00 55.97 57.85 4req s LYS 575 Cb -0.01 -2.06 0.00 0.00 0.00 0.00 0.00 37.83 35.76 4req s LYS 575 CO -0.14 -0.76 0.00 0.09 0.00 0.00 0.00 175.35 174.53 4req n ASN 576 N -1.16 -2.47 -4.81 0.03 3.02 -1.26 -5.06 115.26 103.55 4req n ASN 576 Ca 0.11 0.03 -0.33 0.00 -0.03 0.00 0.00 54.58 54.35 4req n ASN 576 Cb 0.51 -1.39 -0.05 0.00 -0.61 0.00 0.00 39.78 38.23 4req n ASN 576 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 4req s THR 577 N -2.19 4.10 0.40 3.41 2.01 -1.26 -4.95 115.64 117.16 4req s THR 577 Ca 0.00 1.29 0.15 0.00 0.31 0.00 0.00 61.69 63.44 4req s THR 577 Cb 0.00 -3.53 0.15 0.00 0.01 0.00 0.00 72.50 69.13 4req s THR 577 CO 0.00 -0.30 1.92 1.55 -0.69 0.00 0.00 174.62 177.09 4req h PRO 578 N 1.67 0.00 0.22 4.92 0.13 -1.98 -1.64 132.00 135.32 4req h PRO 578 Ca -0.49 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.35 4req h PRO 578 Cb 1.20 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.36 4req h PRO 578 CO 0.60 0.27 -1.30 0.93 -0.23 0.00 0.00 178.00 178.27 4req h GLU 579 N 0.00 0.47 -0.13 0.86 3.07 -1.96 -2.95 114.58 113.93 4req h GLU 579 Ca -0.00 -0.80 0.00 0.00 -0.50 0.00 0.00 59.36 58.06 4req h GLU 579 Cb 0.49 0.30 -0.01 0.00 -0.84 0.00 0.00 28.75 28.69 4req h GLU 579 CO 0.03 1.38 0.08 0.28 -1.40 0.00 0.00 179.01 179.39 4req h VAL 580 N -0.01 1.05 0.09 3.13 2.07 -1.85 -0.25 116.25 120.47 4req h VAL 580 Ca -0.23 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 4req h VAL 580 Cb 2.01 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 4req h VAL 580 CO 0.24 0.05 -0.05 -0.33 0.02 0.00 0.00 177.57 177.49 4req h GLU 581 N 0.16 -0.12 -0.50 1.57 3.07 -1.41 -0.00 114.58 117.35 4req h GLU 581 Ca 0.05 0.01 0.07 0.00 -0.50 0.00 0.00 59.36 58.98 4req h GLU 581 Cb 0.00 0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 27.88 4req h GLU 581 CO -0.01 -0.08 0.18 1.49 -1.40 0.00 0.00 179.01 179.19 4req h GLU 582 N -0.12 0.34 -0.14 2.33 4.81 -1.42 0.24 114.58 120.62 4req h GLU 582 Ca -0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 4req h GLU 582 Cb 0.10 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 4req h GLU 582 CO 0.01 0.23 0.09 0.00 -0.73 0.00 0.00 179.01 178.61 4req h ALA 583 N 1.33 0.18 0.33 2.92 0.00 -0.84 -1.66 119.26 121.52 4req h ALA 583 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 4req h ALA 583 Cb 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 4req h ALA 583 CO -0.25 -0.34 -0.25 0.00 0.00 0.00 0.00 179.25 178.41 4req h ARG 584 N 0.19 -0.56 -0.63 0.00 3.08 -0.27 -1.87 114.38 114.33 4req h ARG 584 Ca 0.05 0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.25 4req h ARG 584 Cb -0.02 0.13 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 4req h ARG 584 CO -0.01 -0.38 0.20 0.93 -1.07 0.00 0.00 179.97 179.65 4req h GLU 585 N -0.59 0.35 -0.33 0.04 5.08 -0.80 -0.53 114.58 117.81 4req h GLU 585 Ca -0.02 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 4req h GLU 585 Cb 0.51 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 4req h GLU 585 CO -0.01 0.23 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.03 4req h LEU 586 N 0.36 0.55 -0.16 1.33 3.38 -1.20 0.85 115.31 120.43 4req h LEU 586 Ca 0.33 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 4req h LEU 586 Cb 0.45 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 4req h LEU 586 CO -0.36 0.71 -0.09 0.58 0.09 0.00 0.00 178.44 179.37 4req h VAL 587 N 0.52 1.32 -0.77 1.22 2.07 -0.68 -2.18 116.25 117.75 4req h VAL 587 Ca 0.09 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 4req h VAL 587 Cb 0.53 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 4req h VAL 587 CO 0.03 0.35 0.44 -0.08 0.02 0.00 0.00 177.57 178.33 4req h GLU 588 N 0.02 1.07 -0.46 1.57 4.22 -0.89 -2.06 114.58 118.04 4req h GLU 588 Ca 0.03 -0.11 -0.07 0.00 0.08 0.00 0.00 59.36 59.29 4req h GLU 588 Cb 0.58 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 4req h GLU 588 CO 0.03 0.77 0.00 1.49 -2.18 0.00 0.00 179.01 179.12 4req h GLU 589 N 1.06 0.76 -0.32 1.92 4.57 -0.79 -2.69 114.58 119.11 4req h GLU 589 Ca 0.27 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 4req h GLU 589 Cb -0.00 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.48 4req h GLU 589 CO -0.05 0.77 0.17 0.35 -1.18 0.00 0.00 179.01 179.08 4req h PHE 590 N 0.71 0.43 -0.05 0.92 3.04 -0.94 0.55 116.94 121.60 4req h PHE 590 Ca 0.14 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.09 4req h PHE 590 Cb 0.44 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.80 4req h PHE 590 CO 0.02 0.35 -0.03 1.49 -2.02 0.00 0.00 178.31 178.12 4req h GLU 591 N 0.39 -0.03 -0.01 1.11 4.81 -1.15 0.70 114.58 120.39 4req h GLU 591 Ca 0.11 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.38 4req h GLU 591 Cb 0.06 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.40 4req h GLU 591 CO -0.02 -0.02 -0.29 1.96 -0.73 0.00 0.00 179.01 179.91 4req h GLN 592 N -0.03 -0.41 -0.15 1.92 1.08 -1.19 0.58 115.11 116.90 4req h GLN 592 Ca 0.03 0.03 -0.16 0.00 -1.45 0.00 0.00 58.65 57.10 4req h GLN 592 Cb 0.08 0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 4req h GLN 592 CO -0.07 -0.27 -0.58 0.00 -0.95 0.00 0.00 178.83 176.95 4req h ALA 593 N 0.36 0.72 0.00 3.87 0.00 -0.80 -3.35 119.26 120.06 4req h ALA 593 Ca 0.07 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.45 4req h ALA 593 Cb 0.52 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.23 4req h ALA 593 CO -0.25 0.70 -1.40 0.39 0.00 0.00 0.00 179.25 178.69 4req n GLU 594 N -3.93 0.82 -0.42 0.00 -0.58 0.24 -4.98 120.64 111.80 4req n GLU 594 Ca -0.03 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 4req n GLU 594 Cb 0.62 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 4req n GLU 594 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 4req n GLY 595 N 1.45 0.77 3.48 0.62 0.00 0.20 -5.02 105.19 106.69 4req n GLY 595 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 4req n GLY 595 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 4req s ARG 596 N -0.58 0.94 0.65 1.61 1.70 -1.22 -5.03 118.95 117.01 4req s ARG 596 Ca 0.00 -0.32 -0.14 0.00 -0.47 0.00 0.00 55.73 54.80 4req s ARG 596 Cb 0.00 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.81 4req s ARG 596 CO 0.00 -0.41 1.08 1.03 -1.08 0.00 0.00 175.30 175.92 4req s ARG 597 N -3.18 2.99 0.14 3.89 0.52 -1.26 -3.64 118.95 118.42 4req s ARG 597 Ca 0.03 1.22 -0.31 0.00 -0.52 0.00 0.00 55.73 56.15 4req s ARG 597 Cb -0.01 -1.99 -0.09 0.00 0.52 0.00 0.00 34.95 33.38 4req s ARG 597 CO -0.09 -1.07 1.54 -1.25 0.02 0.00 0.00 175.30 174.44 4req s PRO 598 N -4.32 4.23 -0.09 3.54 0.04 -1.26 -4.72 135.00 132.42 4req s PRO 598 Ca 0.63 2.30 0.03 0.00 0.04 0.00 0.00 61.00 64.00 4req s PRO 598 Cb -0.17 -3.22 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 4req s PRO 598 CO 0.43 -0.59 -0.18 0.50 0.04 0.00 0.00 177.00 177.20 4req s ARG 599 N 1.30 2.95 -0.01 4.56 3.52 -1.26 -0.67 118.95 129.34 4req s ARG 599 Ca 0.69 -0.78 0.03 0.00 -0.13 0.00 0.00 55.73 55.54 4req s ARG 599 Cb -0.42 -2.40 -0.01 0.00 -1.56 0.00 0.00 34.95 30.56 4req s ARG 599 CO 0.31 0.32 -0.09 -1.50 -0.81 0.00 0.00 175.30 173.53 4req s ILE 600 N 0.02 0.73 -0.34 4.11 2.07 -0.11 -0.77 121.20 126.92 4req s ILE 600 Ca -0.07 -0.39 -0.11 0.00 -1.41 0.00 0.00 60.65 58.67 4req s ILE 600 Cb -0.15 -0.62 -0.00 0.00 0.13 0.00 0.00 42.46 41.82 4req s ILE 600 CO 0.05 0.21 0.20 -0.22 -1.91 0.00 0.00 174.94 173.27 4req s LEU 601 N -0.20 4.39 -0.52 8.50 2.96 -0.71 -0.88 118.68 132.23 4req s LEU 601 Ca 0.03 -0.57 -0.23 0.00 -0.22 0.00 0.00 54.13 53.15 4req s LEU 601 Cb -0.04 -2.06 0.04 0.00 0.50 0.00 0.00 46.19 44.63 4req s LEU 601 CO -0.00 -0.25 0.83 -0.76 -1.32 0.00 0.00 176.35 174.85 4req s LEU 602 N 1.65 4.35 0.06 -0.68 1.43 -0.49 -0.46 118.68 124.53 4req s LEU 602 Ca 0.05 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 4req s LEU 602 Cb -0.18 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 4req s LEU 602 CO 0.08 -1.08 0.11 0.00 0.23 0.00 0.00 176.35 175.68 4req s ALA 603 N 3.50 3.67 -0.31 4.21 0.00 -0.45 -1.36 121.76 131.01 4req s ALA 603 Ca 0.26 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.29 4req s ALA 603 Cb -0.14 -1.55 0.09 0.00 0.00 0.00 0.00 23.12 21.52 4req s ALA 603 CO 0.18 0.76 0.05 0.15 0.00 0.00 0.00 175.76 176.89 4req s LYS 604 N -2.30 1.23 0.19 0.00 -0.14 -1.26 -1.13 119.74 116.33 4req s LYS 604 Ca 0.29 -1.41 0.07 0.00 -1.36 0.00 0.00 55.97 53.56 4req s LYS 604 Cb -0.12 -2.64 -0.04 0.00 -1.68 0.00 0.00 37.83 33.35 4req s LYS 604 CO 0.22 -0.89 0.09 -1.64 -0.76 0.00 0.00 175.35 172.37 4req s MET 605 N 1.26 2.69 2.17 1.68 -1.94 -1.26 -2.81 119.30 121.10 4req s MET 605 Ca 0.07 -1.03 0.00 0.00 -1.71 0.00 0.00 55.69 53.02 4req s MET 605 Cb -0.18 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.17 4req s MET 605 CO -0.14 0.45 0.00 0.41 -0.01 0.00 0.00 175.02 175.73 4req n GLY 606 N -0.49 -1.03 0.35 -0.03 0.00 -0.17 -3.96 105.19 99.86 4req n GLY 606 Ca -0.08 -1.22 0.14 0.00 0.00 0.00 0.00 46.02 44.86 4req n GLY 606 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4req n GLN 607 N -0.01 1.43 -1.69 1.61 1.13 -1.26 -3.82 117.38 114.76 4req n GLN 607 Ca 0.00 -0.70 -0.53 0.00 -1.94 0.00 0.00 57.00 53.83 4req n GLN 607 Cb 0.00 -1.49 -0.06 0.00 0.11 0.00 0.00 30.24 28.81 4req n GLN 607 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 4req n ASP 608 N -0.17 2.82 -0.95 1.08 -0.08 -1.25 -4.88 116.55 113.11 4req n ASP 608 Ca 0.19 1.04 0.09 0.00 -1.51 0.00 0.00 54.79 54.60 4req n ASP 608 Cb 0.30 -1.26 0.20 0.00 2.34 0.00 0.00 41.12 42.70 4req n ASP 608 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 4req n GLY 609 N 4.12 1.98 3.73 0.27 0.00 -1.26 -4.61 105.19 109.42 4req n GLY 609 Ca 0.24 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 4req n GLY 609 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 4req s HIS 610 N -1.15 3.19 0.00 1.61 3.76 -1.26 -4.65 115.29 116.79 4req s HIS 610 Ca 0.33 1.05 0.00 0.00 -0.15 0.00 0.00 55.06 56.29 4req s HIS 610 Cb 0.18 -3.70 0.00 0.00 1.11 0.00 0.00 32.58 30.18 4req s HIS 610 CO 0.25 -2.32 0.04 -0.40 -0.85 0.00 0.00 174.74 171.46 4req n ASP 611 N 3.11 0.00 -0.04 1.40 5.68 -1.26 -4.83 116.55 120.60 4req n ASP 611 Ca 0.09 -1.00 -0.09 0.00 -0.50 0.00 0.00 54.79 53.29 4req n ASP 611 Cb 0.42 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.37 4req n ASP 611 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 4req h ARG 612 N 0.00 0.10 -0.20 0.11 2.43 -1.92 0.84 114.38 115.74 4req h ARG 612 Ca 0.00 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 4req h ARG 612 Cb 0.54 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 4req h ARG 612 CO 0.00 0.07 0.00 0.78 -1.51 0.00 0.00 179.97 179.31 4req h GLY 613 N 0.11 0.38 0.76 2.80 0.00 -1.98 -1.17 103.07 103.96 4req h GLY 613 Ca 0.09 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.20 4req h GLY 613 CO -0.14 0.25 0.47 -1.61 0.00 0.00 0.00 176.54 175.52 4req h GLN 614 N 0.11 0.86 -0.10 4.80 4.15 -1.84 -0.54 115.11 122.54 4req h GLN 614 Ca 0.06 -0.05 -0.21 0.00 0.77 0.00 0.00 58.65 59.21 4req h GLN 614 Cb 0.39 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 27.89 4req h GLN 614 CO 0.01 0.57 -0.80 0.87 -1.93 0.00 0.00 178.83 177.54 4req h LYS 615 N 0.88 0.62 -0.28 1.69 1.79 -0.79 -2.22 116.57 118.26 4req h LYS 615 Ca 0.33 -0.54 -0.16 0.00 -2.18 0.00 0.00 60.65 58.11 4req h LYS 615 Cb 0.12 0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.89 4req h LYS 615 CO -0.15 1.15 -0.45 -0.24 -1.08 0.00 0.00 179.45 178.68 4req h VAL 616 N 0.41 1.29 -0.29 0.50 3.04 -0.92 -2.50 116.25 117.78 4req h VAL 616 Ca -0.05 -1.64 0.00 0.00 -1.01 0.00 0.00 66.70 64.00 4req h VAL 616 Cb 1.42 1.65 -0.01 0.00 -2.01 0.00 0.00 31.29 32.34 4req h VAL 616 CO 0.15 0.53 0.19 0.40 -1.01 0.00 0.00 177.57 177.83 4req h ILE 617 N 0.55 1.07 0.06 3.17 1.08 -1.17 -1.43 117.51 120.85 4req h ILE 617 Ca 0.02 -0.13 0.02 0.00 -0.39 0.00 0.00 64.86 64.38 4req h ILE 617 Cb 1.05 0.64 -0.05 0.00 -3.07 0.00 0.00 36.82 35.40 4req h ILE 617 CO 0.10 0.07 -0.45 0.00 -0.69 0.00 0.00 178.15 177.18 4req h ALA 618 N 1.11 -0.78 -0.40 1.87 0.00 -1.26 0.60 119.26 120.40 4req h ALA 618 Ca 0.11 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 4req h ALA 618 Cb -0.04 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 4req h ALA 618 CO -0.03 -1.01 0.01 0.00 0.00 0.00 0.00 179.25 178.23 4req h THR 619 N -0.65 1.26 -0.62 0.00 1.03 -1.46 -1.01 112.91 111.46 4req h THR 619 Ca 0.03 -0.98 -0.09 0.00 -0.01 0.00 0.00 66.41 65.35 4req h THR 619 Cb 0.69 1.10 -0.02 0.00 -1.07 0.00 0.00 68.15 68.85 4req h THR 619 CO -0.29 0.33 0.04 0.00 -0.01 0.00 0.00 175.52 175.59 4req h ALA 620 N 0.89 0.83 -0.29 0.00 0.00 -1.16 -1.36 119.26 118.17 4req h ALA 620 Ca 0.12 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 4req h ALA 620 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 4req h ALA 620 CO 0.02 0.65 -0.33 1.88 0.00 0.00 0.00 179.25 181.46 4req h TYR 621 N 0.98 0.74 -0.34 0.00 -1.99 -0.83 -2.01 116.97 113.52 4req h TYR 621 Ca 0.18 -0.19 -0.05 0.00 2.00 0.00 0.00 58.73 60.67 4req h TYR 621 Cb 0.52 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.07 4req h TYR 621 CO 0.04 0.89 0.02 0.00 -0.00 0.00 0.00 178.16 179.10 4req h ALA 622 N 1.10 0.45 0.00 3.88 0.00 -0.99 -1.10 119.26 122.60 4req h ALA 622 Ca 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 4req h ALA 622 Cb 0.83 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 4req h ALA 622 CO 0.07 0.20 -0.10 -0.44 0.00 0.00 0.00 179.25 178.98 4req h ASP 623 N 0.40 0.00 0.12 0.00 3.32 -1.02 -2.70 116.42 116.54 4req h ASP 623 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 4req h ASP 623 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 4req h ASP 623 CO 0.01 0.10 -0.21 0.18 -1.72 0.00 0.00 179.24 177.61 4req n LEU 624 N -3.62 1.40 0.00 1.55 4.77 -0.78 -4.97 117.00 115.35 4req n LEU 624 Ca -0.02 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 4req n LEU 624 Cb 0.22 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 4req n LEU 624 CO 0.29 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 4req n GLY 625 N 1.31 0.64 3.77 -0.72 0.00 -1.02 -4.46 105.19 104.72 4req n GLY 625 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 4req n GLY 625 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4req s PHE 626 N -2.00 2.64 -0.37 1.61 0.40 -0.44 -4.65 117.98 115.17 4req s PHE 626 Ca 0.00 1.55 -0.17 0.00 -0.60 0.00 0.00 56.93 57.71 4req s PHE 626 Cb 0.00 -3.11 0.00 0.00 0.51 0.00 0.00 43.02 40.42 4req s PHE 626 CO 0.00 -1.69 0.44 -0.51 0.70 0.00 0.00 175.22 174.16 4req s ASP 627 N -2.92 6.23 -0.17 1.36 1.01 0.15 -4.37 116.67 117.96 4req s ASP 627 Ca 0.64 -0.28 -0.05 0.00 0.71 0.00 0.00 52.55 53.57 4req s ASP 627 Cb -0.19 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.48 4req s ASP 627 CO 0.47 -0.46 -0.01 -0.69 0.21 0.00 0.00 175.17 174.69 4req s VAL 628 N 2.20 4.11 -0.19 -1.27 1.01 -1.26 -0.93 120.40 124.07 4req s VAL 628 Ca 0.15 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 4req s VAL 628 Cb -0.16 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 4req s VAL 628 CO 0.13 0.48 -0.01 -1.81 0.00 0.00 0.00 175.10 173.88 4req s ASP 629 N 0.46 4.80 -0.43 3.32 1.01 -0.06 -4.99 116.67 120.79 4req s ASP 629 Ca -0.02 -0.19 -0.17 0.00 0.71 0.00 0.00 52.55 52.89 4req s ASP 629 Cb -0.14 -1.81 0.03 0.00 1.01 0.00 0.00 42.92 42.01 4req s ASP 629 CO 0.02 0.09 0.41 -0.69 0.21 0.00 0.00 175.17 175.21 4req s VAL 630 N 0.84 5.13 0.59 -1.27 1.01 -1.26 -1.39 120.40 124.05 4req s VAL 630 Ca 0.00 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.32 4req s VAL 630 Cb -0.14 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 4req s VAL 630 CO 0.02 -0.42 1.11 -0.83 0.00 0.00 0.00 175.10 174.98 4req s GLY 631 N 1.87 2.41 0.46 4.51 0.00 -0.47 -4.97 107.32 111.13 4req s GLY 631 Ca 0.10 0.68 -0.20 0.00 0.00 0.00 0.00 44.72 45.30 4req s GLY 631 CO 0.12 1.03 0.97 2.56 0.00 0.00 0.00 173.10 177.78 4req s PRO 632 N -3.66 4.11 0.96 2.90 0.04 -1.26 -4.74 135.00 133.35 4req s PRO 632 Ca 0.70 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.72 4req s PRO 632 Cb -0.22 -2.16 0.17 0.00 0.04 0.00 0.00 34.50 32.33 4req s PRO 632 CO 0.33 -0.13 1.09 -0.51 0.04 0.00 0.00 177.00 177.82 4req s LEU 633 N -3.44 1.90 -1.83 -3.56 1.43 -1.26 -4.01 118.68 107.91 4req s LEU 633 Ca 0.62 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 4req s LEU 633 Cb -0.10 -3.69 0.00 0.00 0.03 0.00 0.00 46.19 42.43 4req s LEU 633 CO 0.18 -2.99 0.00 0.49 0.23 0.00 0.00 176.35 174.27 4req n PHE 634 N -4.10 -0.27 -2.53 0.29 3.72 -1.25 -5.02 117.46 108.30 4req n PHE 634 Ca 0.06 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.07 4req n PHE 634 Cb 0.56 -3.28 -0.04 0.00 -0.94 0.00 0.00 39.48 35.77 4req n PHE 634 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 4req s GLN 635 N -3.98 4.56 0.83 -1.08 -0.21 -1.12 -4.61 119.66 114.04 4req s GLN 635 Ca 0.00 1.69 -0.12 0.00 0.02 0.00 0.00 55.36 56.95 4req s GLN 635 Cb 0.00 -3.05 0.09 0.00 1.00 0.00 0.00 33.01 31.05 4req s GLN 635 CO 0.00 0.17 1.14 0.95 -2.12 0.00 0.00 175.29 175.43 4req s THR 636 N -1.28 2.43 0.41 -0.19 -4.23 -1.26 -1.00 115.64 110.51 4req s THR 636 Ca 0.47 0.14 0.07 0.00 -1.18 0.00 0.00 61.69 61.19 4req s THR 636 Cb -0.29 -3.00 0.27 0.00 1.34 0.00 0.00 72.50 70.82 4req s THR 636 CO 0.37 -0.18 2.06 -0.65 -0.54 0.00 0.00 174.62 175.67 4req h PRO 637 N -1.16 0.55 -0.24 3.99 0.11 -1.93 -2.08 132.00 131.24 4req h PRO 637 Ca -0.48 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 4req h PRO 637 Cb 1.31 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 4req h PRO 637 CO 0.63 0.37 0.02 0.93 -0.21 0.00 0.00 178.00 179.74 4req h GLU 638 N 0.57 0.40 -0.49 1.05 3.07 -1.92 -0.41 114.58 116.85 4req h GLU 638 Ca 0.15 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.87 4req h GLU 638 Cb -0.06 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 4req h GLU 638 CO -0.03 0.55 0.18 0.93 -1.40 0.00 0.00 179.01 179.23 4req h GLU 639 N 0.19 0.74 -0.26 2.33 5.08 -1.87 0.56 114.58 121.35 4req h GLU 639 Ca 0.07 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 4req h GLU 639 Cb 0.36 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 4req h GLU 639 CO 0.01 0.68 0.15 1.15 -1.00 0.00 0.00 179.01 180.00 4req h THR 640 N 0.65 1.11 0.17 1.13 2.02 -1.23 0.25 112.91 117.01 4req h THR 640 Ca 0.16 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 4req h THR 640 Cb 0.23 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 4req h THR 640 CO -0.01 0.11 -0.08 0.00 0.37 0.00 0.00 175.52 175.91 4req h ALA 641 N 1.04 -0.23 -0.29 6.16 0.00 -0.82 0.11 119.26 125.22 4req h ALA 641 Ca 0.09 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.00 4req h ALA 641 Cb 0.04 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 4req h ALA 641 CO -0.02 -0.60 -0.22 -0.09 0.00 0.00 0.00 179.25 178.33 4req h ARG 642 N -0.29 -0.19 -0.81 0.00 2.43 -0.69 0.12 114.38 114.95 4req h ARG 642 Ca -0.02 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 4req h ARG 642 Cb 0.23 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.78 4req h ARG 642 CO 0.04 -0.13 0.53 0.37 -1.51 0.00 0.00 179.97 179.27 4req h GLN 643 N -0.20 1.01 -0.14 0.20 4.15 -0.30 -1.35 115.11 118.47 4req h GLN 643 Ca 0.15 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 4req h GLN 643 Cb 0.44 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 4req h GLN 643 CO -0.41 0.67 0.08 0.00 -1.93 0.00 0.00 178.83 177.23 4req h ALA 644 N 1.32 0.18 0.11 3.38 0.00 0.50 -2.01 119.26 122.75 4req h ALA 644 Ca 0.31 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 4req h ALA 644 Cb -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.70 4req h ALA 644 CO -0.10 -0.29 -0.05 0.28 0.00 0.00 0.00 179.25 179.10 4req h VAL 645 N 0.13 0.95 -0.88 0.00 2.07 -0.62 -2.30 116.25 115.60 4req h VAL 645 Ca 0.05 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.47 4req h VAL 645 Cb 0.07 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 4req h VAL 645 CO -0.01 0.05 0.50 -0.33 0.02 0.00 0.00 177.57 177.81 4req h GLU 646 N -0.25 0.76 -0.00 1.57 5.08 -1.20 -2.00 114.58 118.53 4req h GLU 646 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 4req h GLU 646 Cb 0.20 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.28 4req h GLU 646 CO 0.02 0.50 -0.09 0.00 -1.00 0.00 0.00 179.01 178.45 4req n ALA 647 N -2.38 2.73 -3.51 3.43 0.00 -0.76 -4.96 120.51 115.06 4req n ALA 647 Ca 0.16 -0.27 -0.20 0.00 0.00 0.00 0.00 53.44 53.13 4req n ALA 647 Cb 0.36 -1.34 0.06 0.00 0.00 0.00 0.00 19.45 18.53 4req n ALA 647 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 4req n ASP 648 N -0.87 -3.27 -4.90 0.00 2.03 -0.75 -4.97 116.55 103.82 4req n ASP 648 Ca 0.16 -0.76 -0.29 0.00 0.52 0.00 0.00 54.79 54.41 4req n ASP 648 Cb 0.27 -4.54 0.06 0.00 -0.72 0.00 0.00 41.12 36.18 4req n ASP 648 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 4req s VAL 649 N -3.49 2.95 -0.09 5.18 -7.23 -1.13 -4.92 120.40 111.66 4req s VAL 649 Ca 0.17 0.20 0.04 0.00 -1.81 0.00 0.00 61.98 60.58 4req s VAL 649 Cb -0.04 -3.29 -0.24 0.00 0.56 0.00 0.00 36.38 33.37 4req s VAL 649 CO 0.78 -0.36 0.47 1.41 -0.31 0.00 0.00 175.10 177.09 4req n HIS 650 N -3.03 1.03 -3.86 2.82 8.25 0.05 -4.83 115.22 115.65 4req n HIS 650 Ca 0.07 0.29 -0.12 0.00 -0.26 0.00 0.00 57.72 57.70 4req n HIS 650 Cb 0.59 -1.16 -0.11 0.00 1.12 0.00 0.00 29.99 30.42 4req n HIS 650 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 4req s VAL 651 N -2.57 0.04 -0.39 1.59 0.11 -1.12 -1.28 120.40 116.79 4req s VAL 651 Ca -0.14 -0.37 -0.11 0.00 -2.93 0.00 0.00 61.98 58.44 4req s VAL 651 Cb 0.07 -0.31 0.04 0.00 -1.53 0.00 0.00 36.38 34.66 4req s VAL 651 CO 0.79 -0.20 0.23 -0.69 -3.33 0.00 0.00 175.10 171.90 4req s VAL 652 N -0.67 4.56 -1.05 2.04 1.01 0.18 -1.74 120.40 124.74 4req s VAL 652 Ca -0.08 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 60.78 4req s VAL 652 Cb -0.05 -3.60 0.16 0.00 0.00 0.00 0.00 36.38 32.89 4req s VAL 652 CO 0.01 -0.31 1.23 -0.83 0.00 0.00 0.00 175.10 175.20 4req s GLY 653 N 1.70 2.24 0.19 4.51 0.00 0.39 -1.36 107.32 114.99 4req s GLY 653 Ca 0.02 -3.10 -0.30 0.00 0.00 0.00 0.00 44.72 41.34 4req s GLY 653 CO 0.06 1.95 1.25 0.14 0.00 0.00 0.00 173.10 176.49 4req s VAL 654 N 1.87 3.41 -0.30 1.40 1.01 -0.39 -1.35 120.40 126.04 4req s VAL 654 Ca 0.36 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.54 4req s VAL 654 Cb -0.05 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.67 4req s VAL 654 CO -0.05 0.18 -0.01 -0.55 0.00 0.00 0.00 175.10 174.67 4req s SER 655 N 0.22 4.53 -0.15 3.32 0.15 -0.28 -0.24 113.70 121.25 4req s SER 655 Ca 0.54 -1.78 0.01 0.00 0.70 0.00 0.00 55.95 55.42 4req s SER 655 Cb -0.34 -1.52 0.02 0.00 -1.71 0.00 0.00 66.02 62.47 4req s SER 655 CO 0.37 -0.30 -0.16 -0.55 1.20 0.00 0.00 173.24 173.80 4req s SER 656 N 1.06 2.77 0.00 5.45 0.15 0.75 -4.60 113.70 119.27 4req s SER 656 Ca 0.03 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.16 4req s SER 656 Cb -0.19 -1.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 4req s SER 656 CO -0.08 -0.03 0.09 0.18 1.20 0.00 0.00 173.24 174.61 4req n LEU 657 N 4.64 0.19 -0.66 3.45 4.32 -1.26 -1.74 117.00 125.93 4req n LEU 657 Ca -0.18 -0.37 0.09 0.00 -0.02 0.00 0.00 56.01 55.53 4req n LEU 657 Cb 0.50 0.00 0.28 0.00 -1.62 0.00 0.00 43.42 42.58 4req n LEU 657 CO 0.23 0.05 0.71 0.00 -1.22 0.00 0.00 177.39 177.16 4req n ALA 658 N -0.36 2.48 -1.15 -1.18 0.00 -1.26 -4.73 120.51 114.31 4req n ALA 658 Ca 0.00 -0.62 -0.05 0.00 0.00 0.00 0.00 53.44 52.77 4req n ALA 658 Cb 0.04 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 4req n ALA 658 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4req n GLY 659 N 1.15 0.78 1.31 0.00 0.00 -1.26 -4.42 105.19 102.75 4req n GLY 659 Ca 0.15 -0.67 0.09 0.00 0.00 0.00 0.00 46.02 45.59 4req n GLY 659 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4req n GLY 660 N -2.18 2.86 0.35 -0.02 0.00 -1.26 -4.66 105.19 100.27 4req n GLY 660 Ca -0.05 -0.78 0.10 0.00 0.00 0.00 0.00 46.02 45.29 4req n GLY 660 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 4req h HIS 661 N 3.52 0.52 0.00 1.61 -0.00 -1.91 -2.15 115.15 116.74 4req h HIS 661 Ca 0.00 0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.33 4req h HIS 661 Cb 1.26 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 28.49 4req h HIS 661 CO 0.60 0.26 -0.27 -0.07 -0.00 0.00 0.00 177.93 178.45 4req h LEU 662 N 0.50 0.00 0.01 6.12 3.38 -1.97 -1.65 115.31 121.69 4req h LEU 662 Ca 0.28 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.85 4req h LEU 662 Cb 0.46 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 4req h LEU 662 CO -0.09 0.27 -2.42 0.35 0.09 0.00 0.00 178.44 176.65 4req n THR 663 N -3.96 1.53 -0.27 0.22 -2.24 -1.15 -4.53 114.28 103.88 4req n THR 663 Ca -0.02 -0.49 -0.05 0.00 -2.27 0.00 0.00 64.05 61.23 4req n THR 663 Cb 0.34 -1.64 0.06 0.00 -2.10 0.00 0.00 70.33 67.00 4req n THR 663 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 4req h LEU 664 N -0.40 0.85 0.30 3.22 3.38 -1.40 -2.80 115.31 118.46 4req h LEU 664 Ca -0.60 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.32 4req h LEU 664 Cb 1.78 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.32 4req h LEU 664 CO -0.20 0.62 -0.14 0.58 0.09 0.00 0.00 178.44 179.39 4req h VAL 665 N 1.00 0.74 -0.82 1.22 2.07 -1.56 -2.55 116.25 116.35 4req h VAL 665 Ca 0.27 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.48 4req h VAL 665 Cb -0.11 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 4req h VAL 665 CO -0.06 0.07 0.54 1.55 0.02 0.00 0.00 177.57 179.69 4req h PRO 666 N -0.57 1.08 -0.69 1.57 0.13 -1.76 -1.40 132.00 130.37 4req h PRO 666 Ca -0.04 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 4req h PRO 666 Cb 0.42 -0.24 -0.03 0.00 0.13 0.00 0.00 31.00 31.27 4req h PRO 666 CO 0.07 0.71 0.30 0.00 -0.23 0.00 0.00 178.00 178.85 4req h ALA 667 N 1.30 1.24 -0.42 -0.56 0.00 -1.47 -2.28 119.26 117.06 4req h ALA 667 Ca 0.30 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 4req h ALA 667 Cb -0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 4req h ALA 667 CO -0.06 0.57 -0.05 1.25 0.00 0.00 0.00 179.25 180.95 4req h LEU 668 N 0.98 0.78 -0.04 0.00 6.46 -0.85 -1.68 115.31 120.97 4req h LEU 668 Ca 0.24 -0.34 0.01 0.00 -0.12 0.00 0.00 57.88 57.67 4req h LEU 668 Cb 0.15 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 4req h LEU 668 CO -0.03 0.93 -0.04 -0.09 -0.62 0.00 0.00 178.44 178.60 4req h ARG 669 N 0.61 -0.05 -0.37 1.25 9.65 -1.17 -1.28 114.38 123.02 4req h ARG 669 Ca 0.11 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.90 4req h ARG 669 Cb 0.57 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.14 4req h ARG 669 CO 0.03 -0.04 -0.16 0.87 2.80 0.00 0.00 179.97 183.48 4req h LYS 670 N -0.06 0.67 -0.31 0.20 1.57 -1.42 -2.34 116.57 114.87 4req h LYS 670 Ca 0.03 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 4req h LYS 670 Cb 0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 4req h LYS 670 CO -0.07 0.79 -0.12 1.49 -0.57 0.00 0.00 179.45 180.97 4req h GLU 671 N 0.60 0.64 -0.49 3.15 4.57 -0.92 0.04 114.58 122.17 4req h GLU 671 Ca 0.10 -0.27 0.06 0.00 -1.18 0.00 0.00 59.36 58.07 4req h GLU 671 Cb 0.61 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.13 4req h GLU 671 CO 0.04 0.84 0.21 -0.07 -1.18 0.00 0.00 179.01 178.85 4req h LEU 672 N 0.40 0.25 -0.42 1.64 3.38 -1.14 -1.43 115.31 117.99 4req h LEU 672 Ca 0.07 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 4req h LEU 672 Cb 0.64 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 4req h LEU 672 CO 0.04 0.18 0.17 0.44 0.09 0.00 0.00 178.44 179.36 4req h ASP 673 N 0.41 0.57 0.59 -0.43 5.19 -1.35 -1.19 116.42 120.21 4req h ASP 673 Ca 0.23 -0.16 -0.02 0.00 -0.62 0.00 0.00 57.03 56.46 4req h ASP 673 Cb 0.20 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.56 4req h ASP 673 CO -0.20 0.58 -0.08 0.50 -3.12 0.00 0.00 179.24 176.91 4req h LYS 674 N 0.53 0.00 -0.38 3.56 3.64 -0.30 -2.74 116.57 120.88 4req h LYS 674 Ca 0.14 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 4req h LYS 674 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 4req h LYS 674 CO -0.01 0.08 0.00 1.28 -2.27 0.00 0.00 179.45 178.53 4req n LEU 675 N -3.35 2.31 -0.52 5.20 4.77 -0.60 -4.93 117.00 119.88 4req n LEU 675 Ca -0.01 -1.10 -0.05 0.00 -0.03 0.00 0.00 56.01 54.82 4req n LEU 675 Cb 0.26 -0.25 -0.00 0.00 -2.33 0.00 0.00 43.42 41.10 4req n LEU 675 CO 0.28 0.55 -0.06 0.61 -1.33 0.00 0.00 177.39 177.44 4req n GLY 676 N 1.22 0.19 2.35 -0.72 0.00 -1.03 -5.01 105.19 102.19 4req n GLY 676 Ca 0.16 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 4req n GLY 676 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4req n ARG 677 N -1.46 1.10 0.15 1.61 5.12 -0.46 -4.93 116.66 117.81 4req n ARG 677 Ca -0.05 -3.65 0.13 0.00 -1.93 0.00 0.00 57.85 52.35 4req n ARG 677 Cb 0.54 -1.64 0.44 0.00 -1.16 0.00 0.00 32.46 30.64 4req n ARG 677 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 4req h PRO 678 N 4.51 0.00 0.00 5.56 0.13 -1.85 -3.07 132.00 137.28 4req h PRO 678 Ca 0.15 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.25 4req h PRO 678 Cb 0.83 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 4req h PRO 678 CO 0.55 0.00 -0.15 0.38 -0.23 0.00 0.00 178.00 178.55 4req h ASP 679 N 0.00 0.00 -3.03 1.44 2.03 -1.94 -3.44 116.42 111.48 4req h ASP 679 Ca 0.00 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.75 4req h ASP 679 Cb 0.61 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.10 4req h ASP 679 CO 0.00 0.15 0.74 -0.63 -1.03 0.00 0.00 179.24 178.48 4req s ILE 680 N -3.28 4.08 0.55 4.15 1.01 -1.16 -4.92 121.20 121.62 4req s ILE 680 Ca 0.04 1.42 -0.06 0.00 0.00 0.00 0.00 60.65 62.05 4req s ILE 680 Cb 0.07 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 4req s ILE 680 CO 0.66 -0.00 0.87 -0.76 0.00 0.00 0.00 174.94 175.71 4req s LEU 681 N 2.28 3.40 -0.07 2.97 1.43 -0.40 -4.91 118.68 123.38 4req s LEU 681 Ca 0.58 0.92 0.03 0.00 -1.03 0.00 0.00 54.13 54.63 4req s LEU 681 Cb -0.27 -3.84 0.01 0.00 0.03 0.00 0.00 46.19 42.12 4req s LEU 681 CO 0.23 -0.82 -0.15 -0.63 0.23 0.00 0.00 176.35 175.21 4req s ILE 682 N -2.91 1.38 0.13 -0.59 1.01 -1.26 -0.65 121.20 118.31 4req s ILE 682 Ca 0.51 -0.62 0.09 0.00 0.00 0.00 0.00 60.65 60.63 4req s ILE 682 Cb -0.10 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 4req s ILE 682 CO 0.46 0.41 -0.18 0.42 0.00 0.00 0.00 174.94 176.05 4req s THR 683 N 0.58 2.79 -0.07 2.92 -4.23 -0.47 -0.96 115.64 116.21 4req s THR 683 Ca -0.16 -1.60 0.03 0.00 -1.18 0.00 0.00 61.69 58.78 4req s THR 683 Cb -0.16 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.39 4req s THR 683 CO 0.05 0.05 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.35 4req s VAL 684 N -1.27 1.26 0.22 2.29 1.01 -0.66 -1.27 120.40 121.98 4req s VAL 684 Ca 0.19 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.65 4req s VAL 684 Cb -0.10 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 4req s VAL 684 CO 0.10 0.38 -0.02 -0.83 0.00 0.00 0.00 175.10 174.74 4req s GLY 685 N 0.61 1.48 0.00 4.51 0.00 0.66 -0.85 107.32 113.73 4req s GLY 685 Ca -0.15 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 42.85 4req s GLY 685 CO 0.04 -1.65 0.00 0.61 0.00 0.00 0.00 173.10 172.10 4req n GLY 686 N -0.38 0.36 3.42 0.20 0.00 -0.71 -0.18 105.19 107.90 4req n GLY 686 Ca -0.06 -2.15 -0.44 0.00 0.00 0.00 0.00 46.02 43.37 4req n GLY 686 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4req s VAL 687 N 0.00 4.71 -0.13 1.61 1.01 -0.71 -3.87 120.40 123.02 4req s VAL 687 Ca 0.00 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 4req s VAL 687 Cb 0.00 -4.48 0.04 0.00 0.00 0.00 0.00 36.38 31.95 4req s VAL 687 CO 0.00 -1.10 0.04 -0.63 0.00 0.00 0.00 175.10 173.41 4req s ILE 688 N 3.02 0.29 0.54 2.22 1.01 -1.26 -4.64 121.20 122.38 4req s ILE 688 Ca 0.16 -0.13 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 4req s ILE 688 Cb -0.21 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.55 4req s ILE 688 CO 0.09 -0.01 1.34 -2.84 0.00 0.00 0.00 174.94 173.53 4req s PRO 689 N 1.99 3.16 0.39 2.79 0.02 -1.26 -4.92 135.00 137.17 4req s PRO 689 Ca 0.02 2.20 0.12 0.00 0.02 0.00 0.00 61.00 63.36 4req s PRO 689 Cb -0.15 -2.25 0.92 0.00 0.02 0.00 0.00 34.50 33.05 4req s PRO 689 CO -0.07 -1.16 1.92 1.49 -0.33 0.00 0.00 177.00 178.85 4req h GLU 690 N 1.46 0.54 -0.81 5.54 4.22 -1.96 -2.58 114.58 121.00 4req h GLU 690 Ca -0.51 -0.03 0.18 0.00 0.08 0.00 0.00 59.36 59.08 4req h GLU 690 Cb 1.30 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.37 4req h GLU 690 CO 0.57 0.36 0.55 1.96 -2.18 0.00 0.00 179.01 180.27 4req h GLN 691 N 0.56 0.36 -0.01 1.92 7.50 -1.97 -2.50 115.11 120.98 4req h GLN 691 Ca 0.37 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.50 4req h GLN 691 Cb 0.66 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 28.10 4req h GLN 691 CO -0.13 0.24 -0.24 -0.25 -1.50 0.00 0.00 178.83 176.94 4req n ASP 692 N -4.48 0.96 -0.26 1.46 8.00 -0.97 -4.55 116.55 116.72 4req n ASP 692 Ca 0.16 -0.85 -0.05 0.00 0.71 0.00 0.00 54.79 54.76 4req n ASP 692 Cb 0.62 0.11 0.06 0.00 -0.02 0.00 0.00 41.12 41.90 4req n ASP 692 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 4req h PHE 693 N 1.13 0.95 -0.43 1.24 -1.00 -1.56 -1.99 116.94 115.29 4req h PHE 693 Ca 0.00 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.74 4req h PHE 693 Cb 0.49 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 4req h PHE 693 CO 0.00 0.63 0.09 -0.44 -1.61 0.00 0.00 178.31 176.99 4req h ASP 694 N 0.99 0.66 -0.37 2.17 3.32 -1.81 -1.58 116.42 119.81 4req h ASP 694 Ca 0.26 -0.24 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 4req h ASP 694 Cb -0.05 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 4req h ASP 694 CO -0.05 0.74 0.02 -0.08 -1.72 0.00 0.00 179.24 178.14 4req h GLU 695 N 0.57 0.65 -0.44 3.56 4.81 -1.85 -0.44 114.58 121.43 4req h GLU 695 Ca 0.13 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 4req h GLU 695 Cb 0.34 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 4req h GLU 695 CO 0.00 0.74 0.29 -0.07 -0.73 0.00 0.00 179.01 179.24 4req h LEU 696 N 0.47 0.49 -0.52 1.64 3.38 -1.26 -0.68 115.31 118.83 4req h LEU 696 Ca 0.11 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 4req h LEU 696 Cb 0.43 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 4req h LEU 696 CO 0.02 0.35 0.12 0.03 0.09 0.00 0.00 178.44 179.05 4req h ARG 697 N 0.58 0.84 -0.22 1.13 3.08 -1.17 -1.02 114.38 117.60 4req h ARG 697 Ca 0.16 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 4req h ARG 697 Cb -0.05 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 4req h ARG 697 CO -0.04 0.80 -0.10 0.87 -1.07 0.00 0.00 179.97 180.43 4req h LYS 698 N 0.73 0.34 0.00 0.04 1.57 -0.58 -2.58 116.57 116.09 4req h LYS 698 Ca 0.16 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 4req h LYS 698 Cb 0.35 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.61 4req h LYS 698 CO 0.00 0.45 0.00 -0.25 -0.57 0.00 0.00 179.45 179.08 4req n ASP 699 N -4.27 0.29 0.00 0.86 8.00 -0.30 -4.92 116.55 116.20 4req n ASP 699 Ca 0.00 0.54 0.00 0.00 0.71 0.00 0.00 54.79 56.04 4req n ASP 699 Cb 0.27 -0.61 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 4req n ASP 699 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4req n GLY 700 N 0.93 1.08 3.66 0.44 0.00 -0.90 -4.35 105.19 106.05 4req n GLY 700 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 4req n GLY 700 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4req s ALA 701 N -1.15 3.62 -0.65 4.61 0.00 -0.44 -4.18 121.76 123.57 4req s ALA 701 Ca 0.00 0.58 0.23 0.00 0.00 0.00 0.00 51.96 52.77 4req s ALA 701 Cb 0.00 -3.67 0.19 0.00 0.00 0.00 0.00 23.12 19.63 4req s ALA 701 CO 0.00 -1.30 1.16 1.33 0.00 0.00 0.00 175.76 176.95 4req n VAL 702 N 5.49 0.23 -3.74 0.00 0.24 -0.13 -4.14 118.33 116.27 4req n VAL 702 Ca 0.15 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 62.09 4req n VAL 702 Cb 0.44 0.09 -0.11 0.00 -1.47 0.00 0.00 33.84 32.79 4req n VAL 702 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 4req s GLU 703 N -3.17 0.37 -0.15 7.34 0.41 -1.26 -5.06 118.70 117.17 4req s GLU 703 Ca 0.05 0.53 0.00 0.00 -0.41 0.00 0.00 54.97 55.15 4req s GLU 703 Cb 0.14 0.12 0.02 0.00 -1.78 0.00 0.00 34.13 32.63 4req s GLU 703 CO 0.76 -0.08 -0.14 0.42 -0.49 0.00 0.00 175.26 175.74 4req s ILE 704 N 0.52 1.57 -0.32 -1.63 1.01 -1.26 -1.65 121.20 119.44 4req s ILE 704 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.96 4req s ILE 704 Cb -0.04 -1.50 0.07 0.00 0.01 0.00 0.00 42.46 41.00 4req s ILE 704 CO -0.03 0.43 0.03 -0.31 0.00 0.00 0.00 174.94 175.06 4req s TYR 705 N 1.48 3.44 0.65 3.97 2.02 -0.03 -4.99 117.35 123.88 4req s TYR 705 Ca 0.04 -2.31 0.01 0.00 -0.37 0.00 0.00 57.07 54.44 4req s TYR 705 Cb -0.13 -2.48 0.09 0.00 -0.40 0.00 0.00 41.96 39.04 4req s TYR 705 CO -0.10 -0.88 0.90 0.95 -1.57 0.00 0.00 175.55 174.84 4req s THR 706 N 1.13 2.32 0.31 -0.71 -4.23 -1.26 -1.74 115.64 111.45 4req s THR 706 Ca 0.00 -0.67 -0.28 0.00 -1.18 0.00 0.00 61.69 59.57 4req s THR 706 Cb -0.20 -2.65 -0.13 0.00 1.34 0.00 0.00 72.50 70.86 4req s THR 706 CO -0.04 0.00 1.07 -2.65 -0.54 0.00 0.00 174.62 172.46 4req n PRO 707 N -2.60 1.51 0.00 3.99 -0.02 -1.25 -2.17 135.00 134.46 4req n PRO 707 Ca 0.13 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 4req n PRO 707 Cb 0.60 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 4req n PRO 707 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4req n GLY 708 N 1.12 0.98 3.61 -1.23 0.00 -1.26 -4.77 105.19 103.64 4req n GLY 708 Ca 0.08 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.63 4req n GLY 708 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 4req n THR 709 N -2.00 0.85 -3.07 2.61 -1.04 -0.92 -4.94 114.28 105.76 4req n THR 709 Ca 0.00 -0.21 -0.40 0.00 -2.04 0.00 0.00 64.05 61.40 4req n THR 709 Cb 0.00 -1.04 -0.05 0.00 -1.82 0.00 0.00 70.33 67.42 4req n THR 709 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 4req s VAL 710 N -0.09 5.02 0.11 12.58 1.01 -1.26 -5.00 120.40 132.77 4req s VAL 710 Ca 0.72 1.33 -0.28 0.00 0.00 0.00 0.00 61.98 63.76 4req s VAL 710 Cb -0.79 -4.00 -0.08 0.00 0.00 0.00 0.00 36.38 31.51 4req s VAL 710 CO 0.51 0.16 1.62 0.40 0.00 0.00 0.00 175.10 177.79 4req h ILE 711 N 5.00 0.33 -0.64 2.22 2.04 -1.95 -1.87 117.51 122.65 4req h ILE 711 Ca -0.35 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 4req h ILE 711 Cb 1.16 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 4req h ILE 711 CO 0.78 0.00 0.36 1.55 0.00 0.00 0.00 178.15 180.84 4req h PRO 712 N -0.52 0.87 -0.62 2.37 0.13 -1.94 -2.25 132.00 130.03 4req h PRO 712 Ca 0.04 -0.08 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 4req h PRO 712 Cb 0.56 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.48 4req h PRO 712 CO -0.20 0.63 0.25 0.93 -0.23 0.00 0.00 178.00 179.39 4req h GLU 713 N 0.88 0.93 -0.06 0.86 5.08 -1.82 -2.21 114.58 118.25 4req h GLU 713 Ca 0.23 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 4req h GLU 713 Cb 0.00 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 4req h GLU 713 CO -0.04 0.79 -0.45 0.66 -1.00 0.00 0.00 179.01 178.96 4req h SER 714 N 0.87 0.14 0.23 1.42 4.64 -0.85 -2.42 113.55 117.57 4req h SER 714 Ca 0.21 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 4req h SER 714 Cb 0.20 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 4req h SER 714 CO -0.02 0.58 -0.11 0.00 -0.87 0.00 0.00 176.83 176.41 4req h ALA 715 N 1.43 -0.30 0.01 5.18 0.00 -1.10 -1.10 119.26 123.37 4req h ALA 715 Ca 0.01 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.79 4req h ALA 715 Cb 0.85 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 4req h ALA 715 CO 0.07 -0.54 -0.37 0.82 0.00 0.00 0.00 179.25 179.22 4req h ILE 716 N -0.56 0.23 -0.02 0.00 2.04 -1.39 -0.11 117.51 117.70 4req h ILE 716 Ca -0.03 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 4req h ILE 716 Cb 0.41 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 4req h ILE 716 CO 0.05 0.00 -0.37 0.77 0.00 0.00 0.00 178.15 178.60 4req h SER 717 N -0.53 0.04 -0.14 1.72 4.64 -1.45 -2.28 113.55 115.54 4req h SER 717 Ca 0.05 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 4req h SER 717 Cb 0.61 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 4req h SER 717 CO -0.29 0.40 -0.21 0.25 -0.87 0.00 0.00 176.83 176.12 4req h LEU 718 N 0.03 0.43 0.19 5.97 5.85 -0.79 -2.69 115.31 124.31 4req h LEU 718 Ca 0.00 -0.52 0.01 0.00 0.84 0.00 0.00 57.88 58.20 4req h LEU 718 Cb 0.67 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 4req h LEU 718 CO 0.05 0.87 -0.21 0.58 -0.34 0.00 0.00 178.44 179.39 4req h VAL 719 N 0.01 0.54 -0.50 1.05 2.07 -0.99 0.11 116.25 118.55 4req h VAL 719 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 4req h VAL 719 Cb 0.78 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 4req h VAL 719 CO 0.05 0.00 0.13 0.11 0.02 0.00 0.00 177.57 177.88 4req h LYS 720 N -0.44 0.27 -0.23 1.57 1.57 -1.45 -0.15 116.57 117.70 4req h LYS 720 Ca 0.01 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 4req h LYS 720 Cb 0.42 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 4req h LYS 720 CO -0.06 0.18 0.12 -0.22 -0.57 0.00 0.00 179.45 178.90 4req h LYS 721 N 0.27 0.25 0.15 3.15 1.63 -1.19 -0.69 116.57 120.15 4req h LYS 721 Ca 0.25 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.02 4req h LYS 721 Cb 0.31 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.88 4req h LYS 721 CO -0.30 0.17 -0.08 1.25 -3.45 0.00 0.00 179.45 177.04 4req h LEU 722 N 0.26 -0.21 -0.01 5.20 5.85 -0.32 -2.04 115.31 124.05 4req h LEU 722 Ca 0.09 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.84 4req h LEU 722 Cb 0.01 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 4req h LEU 722 CO -0.05 -0.14 -0.06 0.03 -0.34 0.00 0.00 178.44 177.88 4req h ARG 723 N -0.22 -0.10 -1.00 1.25 3.08 -0.83 -1.07 114.38 115.48 4req h ARG 723 Ca -0.02 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.18 4req h ARG 723 Cb 0.18 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.16 4req h ARG 723 CO 0.02 -0.07 0.63 0.00 -1.07 0.00 0.00 179.97 179.48 4req h ALA 724 N 0.89 1.56 -0.01 0.04 0.00 -1.10 -0.41 119.26 120.22 4req h ALA 724 Ca 0.03 0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 4req h ALA 724 Cb 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 4req h ALA 724 CO -0.07 0.17 -0.89 1.03 0.00 0.00 0.00 179.25 179.49 4req h SER 725 N 0.95 0.43 0.83 0.00 0.87 -1.08 -3.34 113.55 112.20 4req h SER 725 Ca 0.52 -0.33 -0.17 0.00 -1.23 0.00 0.00 61.79 60.57 4req h SER 725 Cb 0.58 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 4req h SER 725 CO -0.29 1.13 -0.82 -0.07 -0.53 0.00 0.00 176.83 176.25 4req h LEU 726 N 0.19 0.00 -6.83 2.23 3.38 -0.16 -3.35 115.31 110.77 4req h LEU 726 Ca -0.06 0.00 -0.80 0.00 0.09 0.00 0.00 57.88 57.11 4req h LEU 726 Cb 1.51 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.98 4req h LEU 726 CO 0.15 0.82 0.75 0.47 0.09 0.00 0.00 178.44 180.71 4req n ASP 727 N -3.55 6.40 0.00 -0.43 9.92 -0.26 -5.09 116.55 123.54 4req n ASP 727 Ca -0.00 -3.44 0.00 0.00 -0.53 0.00 0.00 54.79 50.82 4req n ASP 727 Cb 0.79 -1.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.03 4req n ASP 727 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33