#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5req n PRO 5 N 0.00 2.28 -4.38 3.23 -0.02 -1.26 -5.02 135.00 129.83 5req n PRO 5 Ca 0.00 0.80 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 5req n PRO 5 Cb 0.00 -2.46 -0.14 0.00 -0.02 0.00 0.00 33.50 30.89 5req n PRO 5 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 5req s ARG 6 N -1.33 3.44 -0.01 -0.52 1.81 -1.26 -5.06 118.95 116.02 5req s ARG 6 Ca 0.60 -0.63 0.13 0.00 -1.72 0.00 0.00 55.73 54.11 5req s ARG 6 Cb -0.56 -2.82 0.39 0.00 -0.45 0.00 0.00 34.95 31.50 5req s ARG 6 CO 0.57 0.07 1.32 1.19 -0.68 0.00 0.00 175.30 177.77 5req n PHE 7 N 3.99 0.60 0.32 -0.53 3.72 -1.26 -4.45 117.46 119.86 5req n PHE 7 Ca -0.18 -0.29 0.15 0.00 -0.05 0.00 0.00 57.45 57.07 5req n PHE 7 Cb 0.52 -0.01 0.48 0.00 -0.94 0.00 0.00 39.48 39.53 5req n PHE 7 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 5req h ASP 8 N 2.53 0.00 0.00 4.37 2.03 -2.04 -2.95 116.42 120.36 5req h ASP 8 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 5req h ASP 8 Cb 0.61 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.11 5req h ASP 8 CO 0.01 0.00 -0.84 -1.54 -1.03 0.00 0.00 179.24 175.84 5req n SER 9 N -2.85 0.90 -4.72 4.15 3.41 -1.26 -5.00 113.62 108.24 5req n SER 9 Ca 0.02 -0.63 -0.42 0.00 -0.26 0.00 0.00 58.87 57.58 5req n SER 9 Cb 0.37 1.14 -0.03 0.00 -0.26 0.00 0.00 64.21 65.42 5req n SER 9 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 5req s VAL 10 N -2.39 3.16 0.41 -3.33 1.01 -1.12 -5.02 120.40 113.12 5req s VAL 10 Ca 0.03 0.87 -0.15 0.00 0.00 0.00 0.00 61.98 62.72 5req s VAL 10 Cb 0.10 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 5req s VAL 10 CO 0.54 0.09 0.84 -1.81 0.00 0.00 0.00 175.10 174.76 5req s ASP 11 N 0.90 6.71 0.05 3.32 1.01 -1.26 -4.99 116.67 122.39 5req s ASP 11 Ca 0.63 1.39 -0.17 0.00 0.71 0.00 0.00 52.55 55.10 5req s ASP 11 Cb -0.38 -2.42 -0.18 0.00 1.01 0.00 0.00 42.92 40.95 5req s ASP 11 CO 0.33 -0.37 1.23 0.25 0.21 0.00 0.00 175.17 176.81 5req h LEU 12 N 1.62 0.65 0.00 1.23 5.85 -1.97 -3.50 115.31 119.19 5req h LEU 12 Ca -0.48 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 57.59 5req h LEU 12 Cb 1.18 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.02 5req h LEU 12 CO 0.63 1.20 0.00 0.61 -0.34 0.00 0.00 178.44 180.54 5req n GLY 13 N 0.74 -2.85 1.47 3.75 0.00 -1.26 -4.68 105.19 102.36 5req n GLY 13 Ca -0.08 -2.04 0.09 0.00 0.00 0.00 0.00 46.02 43.99 5req n GLY 13 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 5req n ASN 14 N 0.01 4.59 -3.66 1.61 6.94 -1.26 -4.99 115.26 118.49 5req n ASN 14 Ca 0.00 -2.46 -0.29 0.00 -0.02 0.00 0.00 54.58 51.81 5req n ASN 14 Cb 0.00 -0.55 0.01 0.00 -2.36 0.00 0.00 39.78 36.88 5req n ASN 14 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 5req n ALA 15 N 0.97 -2.62 -1.90 -2.53 0.00 -1.26 -4.89 120.51 108.28 5req n ALA 15 Ca 0.25 -0.02 -0.40 0.00 0.00 0.00 0.00 53.44 53.26 5req n ALA 15 Cb 0.86 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 5req n ALA 15 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 5req s PRO 16 N -3.97 4.72 -0.34 0.00 0.04 -1.26 -5.01 135.00 129.18 5req s PRO 16 Ca 0.14 1.61 -0.17 0.00 0.04 0.00 0.00 61.00 62.62 5req s PRO 16 Cb -0.02 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.24 5req s PRO 16 CO 0.88 0.30 0.46 0.08 0.04 0.00 0.00 177.00 178.76 5req s VAL 17 N -0.78 5.07 0.99 -0.36 1.01 -1.26 -5.05 120.40 120.03 5req s VAL 17 Ca 0.45 0.27 -0.13 0.00 0.00 0.00 0.00 61.98 62.57 5req s VAL 17 Cb -0.28 -3.90 0.09 0.00 0.00 0.00 0.00 36.38 32.29 5req s VAL 17 CO 0.34 -0.15 0.51 -2.65 0.00 0.00 0.00 175.10 173.15 5req n PRO 18 N 5.60 -0.70 0.14 2.72 -0.02 -1.26 -4.93 135.00 136.55 5req n PRO 18 Ca -0.06 -0.16 0.01 0.00 -2.02 0.00 0.00 63.50 61.27 5req n PRO 18 Cb 0.49 -1.94 0.35 0.00 -0.02 0.00 0.00 33.50 32.38 5req n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 5req h ALA 19 N -1.79 1.39 -0.63 3.55 0.00 -2.07 -2.95 119.26 116.76 5req h ALA 19 Ca -0.46 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.16 5req h ALA 19 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 5req h ALA 19 CO 0.37 0.43 0.00 -0.40 0.00 0.00 0.00 179.25 179.66 5req n ASP 20 N -4.17 4.81 0.17 0.00 5.75 -1.26 -4.68 116.55 117.17 5req n ASP 20 Ca -0.01 -2.50 -0.15 0.00 -0.01 0.00 0.00 54.79 52.12 5req n ASP 20 Cb 0.36 -0.59 -0.07 0.00 -1.03 0.00 0.00 41.12 39.78 5req n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 5req h ALA 21 N 4.11 -0.71 -0.37 2.12 0.00 -1.88 -0.58 119.26 121.96 5req h ALA 21 Ca 0.00 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.89 5req h ALA 21 Cb 1.50 0.57 -0.09 0.00 0.00 0.00 0.00 17.79 19.77 5req h ALA 21 CO 0.26 -0.95 -0.30 0.00 0.00 0.00 0.00 179.25 178.26 5req h ALA 22 N -0.17 -0.15 0.00 0.00 0.00 -1.85 0.25 119.26 117.35 5req h ALA 22 Ca 0.00 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 5req h ALA 22 Cb 0.65 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 5req h ALA 22 CO -0.14 -0.70 -0.44 0.07 0.00 0.00 0.00 179.25 178.04 5req h ARG 23 N -0.24 0.00 -0.47 0.00 0.11 -1.90 -0.34 114.38 111.53 5req h ARG 23 Ca 0.17 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.13 5req h ARG 23 Cb 0.52 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.59 5req h ARG 23 CO -0.50 0.44 -0.18 0.00 0.10 0.00 0.00 179.97 179.82 5req h ARG 24 N 0.00 0.95 0.03 0.08 3.08 -0.47 -2.53 114.38 115.52 5req h ARG 24 Ca -0.00 -0.40 -0.00 0.00 0.07 0.00 0.00 59.98 59.65 5req h ARG 24 Cb 0.83 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.84 5req h ARG 24 CO 0.06 1.06 -0.01 0.35 -1.07 0.00 0.00 179.97 180.36 5req h PHE 25 N 0.80 -0.04 -0.65 3.04 3.57 -0.03 -2.41 116.94 121.21 5req h PHE 25 Ca 0.11 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.68 5req h PHE 25 Cb 0.76 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.45 5req h PHE 25 CO 0.05 0.00 0.33 0.93 -2.23 0.00 0.00 178.31 177.39 5req h GLU 26 N -0.06 0.58 -0.71 1.11 4.39 -1.00 0.12 114.58 119.00 5req h GLU 26 Ca -0.00 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 5req h GLU 26 Cb 0.05 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 5req h GLU 26 CO 0.01 0.38 0.21 1.49 -1.16 0.00 0.00 179.01 179.94 5req h GLU 27 N 0.59 1.10 -0.65 2.33 4.57 -1.39 -0.62 114.58 120.51 5req h GLU 27 Ca 0.31 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 5req h GLU 27 Cb 0.27 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 5req h GLU 27 CO -0.23 0.94 0.42 -0.07 -1.18 0.00 0.00 179.01 178.89 5req h LEU 28 N 1.06 0.75 -0.25 1.64 3.38 -0.88 0.07 115.31 121.08 5req h LEU 28 Ca 0.23 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.18 5req h LEU 28 Cb 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 5req h LEU 28 CO -0.01 0.56 0.12 0.00 0.09 0.00 0.00 178.44 179.20 5req h ALA 29 N 1.22 0.30 -0.91 1.53 0.00 -0.46 -0.90 119.26 120.05 5req h ALA 29 Ca 0.24 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 5req h ALA 29 Cb -0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 5req h ALA 29 CO -0.05 -0.28 0.58 0.00 0.00 0.00 0.00 179.25 179.50 5req h ALA 30 N 1.13 1.15 -0.00 0.00 0.00 -0.89 -2.57 119.26 118.08 5req h ALA 30 Ca 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 5req h ALA 30 Cb 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 5req h ALA 30 CO -0.07 0.57 -0.34 0.87 0.00 0.00 0.00 179.25 180.27 5req h LYS 31 N 1.23 0.01 0.00 0.00 1.57 -0.68 -2.91 116.57 115.79 5req h LYS 31 Ca 0.33 -0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.96 5req h LYS 31 Cb -0.12 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 5req h LYS 31 CO -0.07 0.34 -0.72 0.00 -0.57 0.00 0.00 179.45 178.44 5req h ALA 32 N 1.66 0.73 0.00 3.86 0.00 -0.81 -3.48 119.26 121.22 5req h ALA 32 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.25 5req h ALA 32 Cb 0.60 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.28 5req h ALA 32 CO 0.04 0.90 0.00 0.41 0.00 0.00 0.00 179.25 180.60 5req n GLY 33 N 0.73 1.60 3.68 0.00 0.00 -1.00 -5.05 105.19 105.14 5req n GLY 33 Ca -0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 5req n GLY 33 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 5req n THR 34 N -1.01 0.38 -0.46 2.61 -1.04 -1.06 -4.97 114.28 108.73 5req n THR 34 Ca 0.00 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 5req n THR 34 Cb 0.00 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 66.69 5req n THR 34 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 5req n GLY 35 N 4.08 2.19 3.85 3.41 0.00 -1.26 -4.86 105.19 112.59 5req n GLY 35 Ca 0.20 -1.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.11 5req n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5req s GLU 36 N 4.50 3.35 0.40 1.61 0.41 -1.26 -4.99 118.70 122.72 5req s GLU 36 Ca 0.00 0.83 -0.25 0.00 -0.41 0.00 0.00 54.97 55.13 5req s GLU 36 Cb 0.00 -2.05 -0.11 0.00 -1.78 0.00 0.00 34.13 30.20 5req s GLU 36 CO 0.00 -0.77 1.12 0.00 -0.49 0.00 0.00 175.26 175.12 5req n ALA 37 N -2.89 0.62 -1.97 5.21 0.00 -1.26 -4.90 120.51 115.31 5req n ALA 37 Ca 0.07 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 5req n ALA 37 Cb 0.54 -2.15 -0.03 0.00 0.00 0.00 0.00 19.45 17.80 5req n ALA 37 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 5req s TRP 38 N -1.21 2.95 -0.32 0.00 -0.00 -0.39 -4.70 118.94 115.26 5req s TRP 38 Ca 0.61 0.61 -0.16 0.00 -0.00 0.00 0.00 56.10 57.16 5req s TRP 38 Cb -0.55 -3.90 -0.02 0.00 -0.00 0.00 0.00 33.47 29.00 5req s TRP 38 CO 0.58 -3.36 0.40 -2.00 -0.00 0.00 0.00 176.95 172.57 5req s GLU 39 N 1.46 3.71 1.03 5.86 2.56 -1.26 -0.00 118.70 132.06 5req s GLU 39 Ca 0.70 -0.22 -0.16 0.00 0.00 0.00 0.00 54.97 55.29 5req s GLU 39 Cb -0.42 -3.76 0.21 0.00 2.00 0.00 0.00 34.13 32.16 5req s GLU 39 CO 0.31 -0.49 1.17 0.95 -0.56 0.00 0.00 175.26 176.64 5req s THR 40 N 2.13 1.86 0.35 -1.70 -4.23 -0.98 -4.93 115.64 108.14 5req s THR 40 Ca 0.14 0.00 0.26 0.00 -1.18 0.00 0.00 61.69 60.91 5req s THR 40 Cb -0.16 -2.69 0.27 0.00 1.34 0.00 0.00 72.50 71.26 5req s THR 40 CO 0.12 0.00 2.01 0.00 -0.54 0.00 0.00 174.62 176.20 5req h ALA 41 N -1.94 1.23 0.00 3.99 0.00 -1.97 -1.34 119.26 119.23 5req h ALA 41 Ca -0.48 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.29 5req h ALA 41 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 5req h ALA 41 CO 0.47 0.19 0.00 0.39 0.00 0.00 0.00 179.25 180.30 5req n GLU 42 N -3.60 0.20 -3.02 0.00 4.71 -1.26 -4.92 120.64 112.74 5req n GLU 42 Ca -0.01 0.26 -0.12 0.00 -0.01 0.00 0.00 57.16 57.27 5req n GLU 42 Cb 0.29 -1.77 0.04 0.00 -1.01 0.00 0.00 31.44 28.98 5req n GLU 42 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 5req n GLN 43 N -2.12 -4.02 -3.88 3.49 6.02 -0.50 -4.97 117.38 111.40 5req n GLN 43 Ca 0.05 0.43 -0.36 0.00 -0.01 0.00 0.00 57.00 57.11 5req n GLN 43 Cb 0.34 -4.24 -0.14 0.00 1.02 0.00 0.00 30.24 27.23 5req n GLN 43 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 5req s ILE 44 N -3.17 3.23 -0.04 5.09 1.01 -1.26 -4.93 121.20 121.12 5req s ILE 44 Ca 0.26 -1.13 -0.30 0.00 0.00 0.00 0.00 60.65 59.49 5req s ILE 44 Cb -0.12 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 5req s ILE 44 CO 0.37 0.01 1.39 -2.16 0.00 0.00 0.00 174.94 174.55 5req s PRO 45 N 1.34 4.27 -0.35 2.79 0.04 -1.26 -2.32 135.00 139.50 5req s PRO 45 Ca -0.02 1.91 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 5req s PRO 45 Cb -0.18 -3.67 0.09 0.00 0.04 0.00 0.00 34.50 30.78 5req s PRO 45 CO -0.01 -0.62 0.09 0.08 0.04 0.00 0.00 177.00 176.58 5req s VAL 46 N 2.81 2.94 0.18 -0.36 1.01 1.00 -4.92 120.40 123.06 5req s VAL 46 Ca 0.63 -1.87 -0.03 0.00 0.00 0.00 0.00 61.98 60.71 5req s VAL 46 Cb -0.29 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.21 5req s VAL 46 CO 0.24 -0.45 0.18 0.61 0.00 0.00 0.00 175.10 175.69 5req n GLY 47 N 4.53 -2.04 0.06 4.51 0.00 -1.26 -1.27 105.19 109.72 5req n GLY 47 Ca -0.05 -1.53 0.12 0.00 0.00 0.00 0.00 46.02 44.56 5req n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 5req n THR 48 N -2.67 0.00 -3.64 2.61 -2.24 -1.26 -4.85 114.28 102.23 5req n THR 48 Ca 0.02 -0.03 -0.09 0.00 -2.27 0.00 0.00 64.05 61.68 5req n THR 48 Cb 0.09 0.32 -0.07 0.00 -2.10 0.00 0.00 70.33 68.58 5req n THR 48 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 5req s LEU 49 N -2.89 -0.86 0.03 3.22 2.96 -1.26 -5.16 118.68 114.72 5req s LEU 49 Ca 0.14 1.47 0.05 0.00 -0.22 0.00 0.00 54.13 55.57 5req s LEU 49 Cb 0.18 2.39 -0.03 0.00 0.50 0.00 0.00 46.19 49.22 5req s LEU 49 CO 0.67 -0.24 -0.11 -0.36 -1.32 0.00 0.00 176.35 174.99 5req s PHE 50 N 1.19 2.75 0.28 5.38 0.08 -1.26 -5.06 117.98 121.34 5req s PHE 50 Ca -0.06 -0.13 0.06 0.00 0.12 0.00 0.00 56.93 56.91 5req s PHE 50 Cb -0.05 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 40.85 5req s PHE 50 CO -0.13 0.34 0.21 0.09 -0.10 0.00 0.00 175.22 175.63 5req n ASN 51 N 1.43 -0.20 0.07 1.36 4.13 -1.26 -4.73 115.26 116.06 5req n ASN 51 Ca -0.15 -2.78 0.06 0.00 1.68 0.00 0.00 54.58 53.39 5req n ASN 51 Cb 0.52 1.25 0.30 0.00 -1.54 0.00 0.00 39.78 40.31 5req n ASN 51 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 5req n GLU 52 N -0.56 0.07 0.25 3.52 0.00 -1.26 -2.51 120.64 120.14 5req n GLU 52 Ca 0.04 0.51 0.13 0.00 0.00 0.00 0.00 57.16 57.84 5req n GLU 52 Cb 0.49 -1.70 0.58 0.00 0.00 0.00 0.00 31.44 30.81 5req n GLU 52 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.13 177.51 5req h ASP 53 N 0.00 0.00 -0.02 -1.84 2.03 -2.02 -2.99 116.42 111.58 5req h ASP 53 Ca 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.26 5req h ASP 53 Cb 0.07 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.56 5req h ASP 53 CO 0.00 0.12 -0.08 -0.37 -1.03 0.00 0.00 179.24 177.88 5req h VAL 54 N 0.00 1.16 0.00 4.15 -1.51 -1.89 -3.28 116.25 114.88 5req h VAL 54 Ca -0.00 -0.67 -0.03 0.00 -1.23 0.00 0.00 66.70 64.77 5req h VAL 54 Cb 0.62 1.13 -0.00 0.00 -2.13 0.00 0.00 31.29 30.90 5req h VAL 54 CO 0.02 0.21 -0.14 1.88 -1.23 0.00 0.00 177.57 178.31 5req h TYR 55 N 0.24 0.00 -0.85 5.19 0.05 -1.77 -3.40 116.97 116.44 5req h TYR 55 Ca 0.05 0.00 0.11 0.00 0.05 0.00 0.00 58.73 58.94 5req h TYR 55 Cb 0.31 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 37.92 5req h TYR 55 CO 0.00 0.14 -0.39 1.17 -1.05 0.00 0.00 178.16 178.03 5req n LYS 56 N -3.71 -0.26 -0.07 4.88 3.00 -1.24 -1.24 118.16 119.52 5req n LYS 56 Ca -0.02 1.29 0.12 0.00 -0.00 0.00 0.00 58.31 59.70 5req n LYS 56 Cb 0.25 -1.91 0.36 0.00 0.00 0.00 0.00 35.03 33.73 5req n LYS 56 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 5req n ASP 57 N -5.18 2.02 -4.70 3.14 8.00 -1.26 -4.88 116.55 113.70 5req n ASP 57 Ca 0.06 -1.73 -0.42 0.00 0.71 0.00 0.00 54.79 53.41 5req n ASP 57 Cb 0.29 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 5req n ASP 57 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 5req s MET 58 N -1.81 4.46 0.00 -1.24 -1.94 -0.37 -4.94 119.30 113.46 5req s MET 58 Ca 0.34 1.28 0.17 0.00 -1.71 0.00 0.00 55.69 55.77 5req s MET 58 Cb 0.19 -3.50 0.43 0.00 2.01 0.00 0.00 34.83 33.96 5req s MET 58 CO 0.29 -0.16 1.35 -0.40 -0.01 0.00 0.00 175.02 176.09 5req n ASP 59 N 4.44 3.32 -0.55 3.03 5.68 -1.26 -4.57 116.55 126.64 5req n ASP 59 Ca 0.06 -1.97 0.07 0.00 -0.50 0.00 0.00 54.79 52.45 5req n ASP 59 Cb 0.50 -0.32 0.06 0.00 -1.14 0.00 0.00 41.12 40.23 5req n ASP 59 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 5req n TRP 60 N 1.05 0.02 0.32 2.11 2.14 -1.26 -4.73 117.44 117.09 5req n TRP 60 Ca 0.17 -0.02 0.21 0.00 2.07 0.00 0.00 57.50 59.92 5req n TRP 60 Cb 0.51 -0.00 1.06 0.00 -0.81 0.00 0.00 31.31 32.07 5req n TRP 60 CO 0.00 0.00 0.00 -0.07 2.07 0.00 0.00 177.69 179.69 5req h LEU 61 N 2.65 0.00 -4.35 5.67 3.38 -1.98 -2.74 115.31 117.94 5req h LEU 61 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 5req h LEU 61 Cb 0.57 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 40.90 5req h LEU 61 CO 0.00 0.01 -0.79 -0.67 0.09 0.00 0.00 178.44 177.08 5req n ASP 62 N -3.17 4.51 -4.83 -0.43 2.03 -1.26 -4.93 116.55 108.47 5req n ASP 62 Ca -0.02 -3.63 -0.22 0.00 0.52 0.00 0.00 54.79 51.44 5req n ASP 62 Cb 0.13 -0.43 -0.04 0.00 -0.72 0.00 0.00 41.12 40.06 5req n ASP 62 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 5req s THR 63 N -5.10 2.60 -0.03 5.18 -4.23 -1.03 -5.14 115.64 107.89 5req s THR 63 Ca 0.47 -1.46 0.07 0.00 -1.18 0.00 0.00 61.69 59.60 5req s THR 63 Cb 0.40 -3.01 -0.02 0.00 1.34 0.00 0.00 72.50 71.22 5req s THR 63 CO -0.11 -0.01 -0.25 -0.31 -0.54 0.00 0.00 174.62 173.40 5req s TYR 64 N -2.50 2.37 0.56 3.99 1.51 -1.26 -5.00 117.35 117.02 5req s TYR 64 Ca 0.45 -0.52 -0.21 0.00 -1.01 0.00 0.00 57.07 55.79 5req s TYR 64 Cb -0.01 -1.53 -0.05 0.00 -0.11 0.00 0.00 41.96 40.25 5req s TYR 64 CO 0.26 -0.09 1.21 0.00 -1.11 0.00 0.00 175.55 175.82 5req n ALA 65 N 2.60 1.00 -1.04 3.71 0.00 -1.26 -3.45 120.51 122.07 5req n ALA 65 Ca -0.16 0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.35 5req n ALA 65 Cb 0.51 -2.26 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 5req n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5req n GLY 66 N 0.97 0.51 2.82 0.00 0.00 -0.87 -4.14 105.19 104.47 5req n GLY 66 Ca 0.12 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 5req n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5req s ILE 67 N -1.96 -0.04 0.27 -0.61 1.01 -1.22 -4.72 121.20 113.94 5req s ILE 67 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 5req s ILE 67 Cb 0.00 -0.06 -0.13 0.00 0.01 0.00 0.00 42.46 42.28 5req s ILE 67 CO 0.00 0.05 1.39 -2.65 0.00 0.00 0.00 174.94 173.74 5req n PRO 68 N 3.75 2.13 -0.77 2.79 -0.02 -1.26 -1.24 135.00 140.37 5req n PRO 68 Ca -0.22 0.75 -0.04 0.00 -2.02 0.00 0.00 63.50 61.98 5req n PRO 68 Cb 0.54 -2.40 0.24 0.00 -0.02 0.00 0.00 33.50 31.86 5req n PRO 68 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 5req n PRO 69 N 1.66 3.20 -3.88 0.52 -0.04 -1.26 -4.98 135.00 130.22 5req n PRO 69 Ca 0.09 -2.34 -0.29 0.00 -0.04 0.00 0.00 63.50 60.92 5req n PRO 69 Cb 0.33 -2.01 0.03 0.00 -0.04 0.00 0.00 33.50 31.81 5req n PRO 69 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 5req n PHE 70 N 0.01 -2.29 -0.02 0.54 3.72 -0.37 -3.39 117.46 115.68 5req n PHE 70 Ca 0.30 0.90 -0.02 0.00 -0.05 0.00 0.00 57.45 58.59 5req n PHE 70 Cb 1.13 -4.07 0.25 0.00 -0.94 0.00 0.00 39.48 35.85 5req n PHE 70 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 5req h VAL 71 N -2.09 1.22 -0.01 -4.37 3.04 -1.84 -1.96 116.25 110.24 5req h VAL 71 Ca -0.58 -0.93 0.00 0.00 -1.01 0.00 0.00 66.70 64.18 5req h VAL 71 Cb 1.37 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.67 5req h VAL 71 CO 0.66 0.31 -0.12 1.41 -1.01 0.00 0.00 177.57 178.82 5req n HIS 72 N -4.23 0.00 0.00 3.17 8.25 -1.26 -4.66 115.22 116.48 5req n HIS 72 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 5req n HIS 72 Cb 0.29 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.30 5req n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 5req n GLY 73 N 1.25 3.78 0.16 -1.41 0.00 -0.74 -4.39 105.19 103.85 5req n GLY 73 Ca 0.16 -1.63 -0.08 0.00 0.00 0.00 0.00 46.02 44.47 5req n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5req h PRO 74 N 0.00 0.29 -6.07 1.61 0.13 -1.84 -2.32 132.00 123.81 5req h PRO 74 Ca 0.00 -0.24 -0.66 0.00 -0.87 0.00 0.00 66.00 64.23 5req h PRO 74 Cb 0.00 0.05 -0.12 0.00 0.13 0.00 0.00 31.00 31.05 5req h PRO 74 CO 0.00 0.89 -0.62 0.71 -0.23 0.00 0.00 178.00 178.75 5req s TYR 75 N -3.59 3.16 0.22 1.56 2.02 -1.26 -4.08 117.35 115.39 5req s TYR 75 Ca -0.04 0.15 -0.08 0.00 -0.37 0.00 0.00 57.07 56.72 5req s TYR 75 Cb 0.11 -1.71 0.34 0.00 -0.40 0.00 0.00 41.96 40.29 5req s TYR 75 CO 0.82 0.50 1.74 0.00 -1.57 0.00 0.00 175.55 177.04 5req h ALA 76 N 4.38 0.88 0.00 3.71 0.00 -1.85 -3.16 119.26 123.22 5req h ALA 76 Ca -0.49 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.51 5req h ALA 76 Cb 1.18 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.04 5req h ALA 76 CO 0.58 -0.19 -1.43 0.25 0.00 0.00 0.00 179.25 178.46 5req n THR 77 N -5.00 0.00 -0.94 0.00 -2.24 -1.26 -4.66 114.28 100.18 5req n THR 77 Ca 0.11 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 5req n THR 77 Cb 0.32 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 5req n THR 77 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 5req n MET 78 N -1.83 0.00 0.11 -0.78 0.00 -1.20 -2.94 117.12 110.49 5req n MET 78 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.83 5req n MET 78 Cb 0.43 0.00 0.45 0.00 0.00 0.00 0.00 33.22 34.10 5req n MET 78 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 5req n TYR 79 N 14.00 0.84 -0.36 2.03 4.01 -1.25 -2.20 117.16 134.23 5req n TYR 79 Ca 0.00 0.28 0.04 0.00 -0.16 0.00 0.00 57.90 58.06 5req n TYR 79 Cb 0.00 -0.96 0.19 0.00 -0.31 0.00 0.00 39.34 38.26 5req n TYR 79 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 5req h ALA 80 N 2.41 1.39 0.02 -0.72 0.00 -1.35 -3.21 119.26 117.80 5req h ALA 80 Ca 0.00 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 5req h ALA 80 Cb 0.55 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 5req h ALA 80 CO 0.00 0.34 -1.58 0.34 0.00 0.00 0.00 179.25 178.35 5req n PHE 81 N -4.57 0.87 -3.68 0.00 7.35 -1.09 -4.99 117.46 111.35 5req n PHE 81 Ca 0.16 0.34 -0.10 0.00 -0.76 0.00 0.00 57.45 57.09 5req n PHE 81 Cb 0.24 -1.09 -0.11 0.00 0.35 0.00 0.00 39.48 38.87 5req n PHE 81 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 5req s ARG 82 N -2.41 0.35 0.95 -4.13 3.52 -0.94 -5.10 118.95 111.19 5req s ARG 82 Ca -0.30 0.87 -0.12 0.00 -0.13 0.00 0.00 55.73 56.05 5req s ARG 82 Cb 0.07 0.09 0.16 0.00 -1.56 0.00 0.00 34.95 33.72 5req s ARG 82 CO 0.60 -0.20 1.09 -1.25 -0.81 0.00 0.00 175.30 174.73 5req s PRO 83 N 1.86 0.78 0.97 5.12 0.04 -1.25 -3.78 135.00 138.75 5req s PRO 83 Ca -0.06 0.85 -0.12 0.00 0.04 0.00 0.00 61.00 61.72 5req s PRO 83 Cb -0.10 -1.75 0.14 0.00 0.04 0.00 0.00 34.50 32.83 5req s PRO 83 CO -0.12 -2.58 0.88 -2.67 0.04 0.00 0.00 177.00 172.54 5req n TRP 84 N -4.12 -0.15 -2.90 0.56 2.14 -1.26 -4.95 117.44 106.75 5req n TRP 84 Ca 0.07 0.27 -0.42 0.00 2.07 0.00 0.00 57.50 59.49 5req n TRP 84 Cb 0.55 -1.88 -0.04 0.00 -0.81 0.00 0.00 31.31 29.13 5req n TRP 84 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 5req s THR 85 N -2.52 4.86 -0.33 -1.67 2.01 -0.49 -4.94 115.64 112.57 5req s THR 85 Ca 0.64 1.58 -0.29 0.00 0.31 0.00 0.00 61.69 63.93 5req s THR 85 Cb -0.22 -4.12 -0.00 0.00 0.01 0.00 0.00 72.50 68.17 5req s THR 85 CO 0.62 -0.02 1.49 -0.63 -0.69 0.00 0.00 174.62 175.38 5req s ILE 86 N 2.50 3.85 -0.39 1.82 1.01 -1.26 -1.60 121.20 127.13 5req s ILE 86 Ca 0.36 0.92 0.01 0.00 0.00 0.00 0.00 60.65 61.94 5req s ILE 86 Cb -0.16 -4.00 0.14 0.00 0.01 0.00 0.00 42.46 38.46 5req s ILE 86 CO 0.10 -0.53 0.25 -0.60 0.00 0.00 0.00 174.94 174.15 5req s ARG 87 N 4.78 0.86 -0.22 2.79 3.52 -0.65 -1.05 118.95 128.97 5req s ARG 87 Ca 0.65 -1.69 -0.26 0.00 -0.13 0.00 0.00 55.73 54.30 5req s ARG 87 Cb -0.18 -1.66 -0.00 0.00 -1.56 0.00 0.00 34.95 31.54 5req s ARG 87 CO 0.30 -1.23 0.91 -0.65 -0.81 0.00 0.00 175.30 173.82 5req s GLN 88 N 0.65 4.24 -0.02 5.12 -1.52 -1.26 -3.95 119.66 122.92 5req s GLN 88 Ca 0.20 1.11 -0.30 0.00 -1.95 0.00 0.00 55.36 54.43 5req s GLN 88 Cb -0.19 -3.63 -0.06 0.00 -0.22 0.00 0.00 33.01 28.92 5req s GLN 88 CO -0.03 -0.51 1.57 0.12 -0.25 0.00 0.00 175.29 176.18 5req s PHE 89 N 2.81 2.34 0.14 0.91 5.36 -1.26 -4.01 117.98 124.26 5req s PHE 89 Ca 0.39 0.42 -0.18 0.00 -0.96 0.00 0.00 56.93 56.60 5req s PHE 89 Cb -0.16 -3.84 0.05 0.00 -0.34 0.00 0.00 43.02 38.73 5req s PHE 89 CO 0.08 -3.37 0.47 0.00 -1.46 0.00 0.00 175.22 170.93 5req s ALA 90 N 3.31 -1.13 0.00 11.12 0.00 0.34 -4.93 121.76 130.47 5req s ALA 90 Ca 0.70 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.76 5req s ALA 90 Cb -0.33 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.55 5req s ALA 90 CO 0.28 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.76 5req n GLY 91 N -0.28 3.93 3.58 0.00 0.00 -1.26 -0.31 105.19 110.86 5req n GLY 91 Ca -0.16 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 5req n GLY 91 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 5req s PHE 92 N -0.59 -0.55 0.00 1.61 -0.71 -1.26 -4.05 117.98 112.42 5req s PHE 92 Ca 0.00 1.11 0.00 0.00 -1.04 0.00 0.00 56.93 57.00 5req s PHE 92 Cb 0.00 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 5req s PHE 92 CO 0.00 -0.41 0.00 0.45 -1.34 0.00 0.00 175.22 173.92 5req n SER 93 N 1.41 0.00 -4.98 1.98 2.88 -0.97 -4.15 113.62 109.79 5req n SER 93 Ca -0.14 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.19 5req n SER 93 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 5req n SER 93 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 5req s THR 94 N 0.00 4.00 0.10 2.46 -4.23 -1.26 -1.56 115.64 115.16 5req s THR 94 Ca 0.00 -0.81 -0.31 0.00 -1.18 0.00 0.00 61.69 59.40 5req s THR 94 Cb 0.00 -3.42 -0.11 0.00 1.34 0.00 0.00 72.50 70.30 5req s THR 94 CO 0.00 -0.21 1.61 0.00 -0.54 0.00 0.00 174.62 175.47 5req h ALA 95 N 0.69 -0.72 -0.91 3.99 0.00 -1.83 -1.49 119.26 118.98 5req h ALA 95 Ca -0.46 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.46 5req h ALA 95 Cb 1.26 0.56 -0.13 0.00 0.00 0.00 0.00 17.79 19.48 5req h ALA 95 CO 0.54 -0.95 -0.51 -0.22 0.00 0.00 0.00 179.25 178.11 5req h LYS 96 N -0.68 -0.05 -0.61 0.00 3.11 -1.91 0.30 116.57 116.73 5req h LYS 96 Ca -0.00 0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.74 5req h LYS 96 Cb 0.65 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.87 5req h LYS 96 CO -0.13 -0.03 -0.00 0.93 -2.81 0.00 0.00 179.45 177.40 5req h GLU 97 N -0.05 1.07 -0.33 1.90 5.08 -1.86 -0.95 114.58 119.44 5req h GLU 97 Ca 0.21 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 5req h GLU 97 Cb 0.50 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 5req h GLU 97 CO -0.90 1.05 0.17 0.77 -1.00 0.00 0.00 179.01 179.09 5req h SER 98 N 0.97 0.43 -0.53 1.42 0.02 -0.68 0.04 113.55 115.22 5req h SER 98 Ca 0.17 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 5req h SER 98 Cb 0.57 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 5req h SER 98 CO 0.03 0.42 0.14 -1.13 -1.14 0.00 0.00 176.83 175.16 5req h ASN 99 N 0.40 0.80 -0.09 3.07 -0.73 -0.40 -0.72 115.58 117.90 5req h ASN 99 Ca 0.11 -0.22 0.01 0.00 1.87 0.00 0.00 56.30 58.07 5req h ASN 99 Cb 0.10 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.47 5req h ASN 99 CO -0.02 0.81 0.02 0.00 -0.37 0.00 0.00 177.43 177.87 5req h ALA 100 N 1.02 0.09 -0.42 1.57 0.00 -0.92 -1.42 119.26 119.18 5req h ALA 100 Ca 0.17 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.17 5req h ALA 100 Cb 0.32 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 5req h ALA 100 CO -0.00 -0.45 0.02 0.35 0.00 0.00 0.00 179.25 179.18 5req h PHE 101 N 0.06 0.02 -0.35 0.00 3.57 -0.75 -2.62 116.94 116.86 5req h PHE 101 Ca 0.04 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.61 5req h PHE 101 Cb 0.04 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 5req h PHE 101 CO -0.11 -0.06 0.11 1.88 -2.23 0.00 0.00 178.31 177.90 5req h TYR 102 N 0.14 0.19 -0.61 0.41 0.05 -0.92 -0.70 116.97 115.53 5req h TYR 102 Ca 0.21 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.94 5req h TYR 102 Cb 0.29 -0.03 -0.03 0.00 1.01 0.00 0.00 36.73 37.97 5req h TYR 102 CO -0.26 0.07 0.13 0.00 -1.05 0.00 0.00 178.16 177.05 5req h ARG 103 N 0.25 0.97 -0.35 4.88 3.08 -1.05 0.24 114.38 122.40 5req h ARG 103 Ca 0.16 -0.22 -0.16 0.00 0.07 0.00 0.00 59.98 59.83 5req h ARG 103 Cb 0.15 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 5req h ARG 103 CO -0.18 0.87 -0.41 0.00 -1.07 0.00 0.00 179.97 179.19 5req h ARG 104 N 0.92 0.87 -0.40 0.04 3.08 -1.32 -1.68 114.38 115.88 5req h ARG 104 Ca 0.19 -0.47 -0.02 0.00 0.07 0.00 0.00 59.98 59.76 5req h ARG 104 Cb 0.36 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 5req h ARG 104 CO 0.00 1.11 0.19 -0.91 -1.07 0.00 0.00 179.97 179.29 5req h ASN 105 N 0.70 0.54 -0.38 7.04 2.35 -0.65 -2.07 115.58 123.10 5req h ASN 105 Ca 0.05 -0.14 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 5req h ASN 105 Cb 0.99 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.19 5req h ASN 105 CO 0.10 0.52 0.19 -0.07 -1.65 0.00 0.00 177.43 176.51 5req h LEU 106 N 0.51 0.27 -1.85 1.61 3.38 -0.47 -2.53 115.31 116.23 5req h LEU 106 Ca 0.14 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 5req h LEU 106 Cb 0.13 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 5req h LEU 106 CO -0.02 0.20 0.09 0.00 0.09 0.00 0.00 178.44 178.80 5req h ALA 107 N 1.21 1.89 -0.10 1.53 0.00 -1.13 -2.61 119.26 120.06 5req h ALA 107 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 5req h ALA 107 Cb 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.81 5req h ALA 107 CO -0.12 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.23 5req n ALA 108 N -2.52 2.55 0.00 0.00 0.00 -0.80 -4.93 120.51 114.82 5req n ALA 108 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.10 5req n ALA 108 Cb 0.08 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.37 5req n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5req n GLY 109 N 0.94 1.71 3.77 0.00 0.00 -0.98 -4.98 105.19 105.65 5req n GLY 109 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 5req n GLY 109 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 5req s GLN 110 N 0.00 4.22 -0.20 1.61 0.74 -0.98 -4.92 119.66 120.13 5req s GLN 110 Ca 0.00 2.42 -0.15 0.00 0.05 0.00 0.00 55.36 57.67 5req s GLN 110 Cb 0.00 -3.02 -0.09 0.00 1.10 0.00 0.00 33.01 31.00 5req s GLN 110 CO 0.00 -0.39 -0.18 1.17 -0.55 0.00 0.00 175.29 175.35 5req n LYS 111 N 0.71 0.53 -4.18 1.67 3.00 -0.22 -4.50 118.16 115.17 5req n LYS 111 Ca 0.01 0.40 -0.23 0.00 -0.00 0.00 0.00 58.31 58.48 5req n LYS 111 Cb 0.40 -1.59 -0.07 0.00 0.00 0.00 0.00 35.03 33.77 5req n LYS 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 5req s GLY 112 N -4.83 1.92 0.18 3.14 0.00 -0.61 -4.82 107.32 102.30 5req s GLY 112 Ca -0.27 -1.82 0.01 0.00 0.00 0.00 0.00 44.72 42.64 5req s GLY 112 CO 0.42 -1.78 0.33 1.08 0.00 0.00 0.00 173.10 173.15 5req s LEU 113 N -3.79 4.29 -0.26 0.66 1.43 -0.85 -4.24 118.68 115.91 5req s LEU 113 Ca 0.36 0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 53.71 5req s LEU 113 Cb -0.03 -3.01 0.14 0.00 0.03 0.00 0.00 46.19 43.32 5req s LEU 113 CO 0.22 0.00 0.35 -0.55 0.23 0.00 0.00 176.35 176.60 5req s SER 114 N -3.27 0.74 -0.19 2.29 0.15 -1.26 -0.48 113.70 111.69 5req s SER 114 Ca 0.36 -0.24 -0.28 0.00 0.70 0.00 0.00 55.95 56.50 5req s SER 114 Cb -0.11 0.89 -0.00 0.00 -1.71 0.00 0.00 66.02 65.09 5req s SER 114 CO 0.29 -0.34 0.96 -0.69 1.20 0.00 0.00 173.24 174.66 5req s VAL 115 N 2.48 4.77 -0.19 4.45 1.01 -0.67 -0.50 120.40 131.75 5req s VAL 115 Ca 0.10 1.90 -0.12 0.00 0.00 0.00 0.00 61.98 63.87 5req s VAL 115 Cb -0.14 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 5req s VAL 115 CO -0.24 -0.08 0.21 0.00 0.00 0.00 0.00 175.10 174.99 5req s ALA 116 N 2.63 3.64 0.21 5.51 0.00 0.58 -2.36 121.76 131.96 5req s ALA 116 Ca 0.43 -0.62 0.08 0.00 0.00 0.00 0.00 51.96 51.84 5req s ALA 116 Cb -0.16 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 5req s ALA 116 CO 0.11 0.06 0.03 -0.06 0.00 0.00 0.00 175.76 175.89 5req s PHE 117 N 0.56 2.85 0.96 0.00 0.40 -1.26 -1.41 117.98 120.07 5req s PHE 117 Ca 0.12 -0.15 -0.13 0.00 -0.60 0.00 0.00 56.93 56.16 5req s PHE 117 Cb -0.12 -1.34 0.17 0.00 0.51 0.00 0.00 43.02 42.23 5req s PHE 117 CO 0.02 0.54 1.14 0.16 0.70 0.00 0.00 175.22 177.78 5req s ASP 118 N -3.24 3.07 0.14 1.36 1.47 0.52 -4.07 116.67 115.92 5req s ASP 118 Ca 0.29 0.92 -0.13 0.00 1.18 0.00 0.00 52.55 54.81 5req s ASP 118 Cb -0.08 -1.44 0.01 0.00 -0.34 0.00 0.00 42.92 41.06 5req s ASP 118 CO 0.20 -2.82 1.60 -0.07 0.68 0.00 0.00 175.17 174.76 5req h LEU 119 N -1.68 0.80 -0.34 2.11 3.38 -1.91 -2.72 115.31 114.95 5req h LEU 119 Ca -0.50 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.23 5req h LEU 119 Cb 1.32 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.80 5req h LEU 119 CO 0.57 0.90 -0.03 -0.65 0.09 0.00 0.00 178.44 179.32 5req h PRO 120 N 0.68 0.05 -0.76 1.13 0.11 -1.86 -1.50 132.00 129.84 5req h PRO 120 Ca 0.14 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.30 5req h PRO 120 Cb 0.48 -0.01 -0.06 0.00 0.11 0.00 0.00 31.00 31.52 5req h PRO 120 CO 0.02 0.04 0.46 1.15 -0.21 0.00 0.00 178.00 179.45 5req h THR 121 N 0.06 1.02 -0.44 -1.15 2.02 -1.61 0.62 112.91 113.41 5req h THR 121 Ca 0.17 -0.29 0.04 0.00 0.77 0.00 0.00 66.41 67.10 5req h THR 121 Cb 0.24 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.71 5req h THR 121 CO -0.31 0.15 0.20 0.45 0.37 0.00 0.00 175.52 176.38 5req h HIS 122 N 0.84 0.36 -0.36 3.16 3.86 -0.98 -2.96 115.15 119.07 5req h HIS 122 Ca 0.33 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 5req h HIS 122 Cb 0.16 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.53 5req h HIS 122 CO -0.05 0.17 0.00 0.54 0.86 0.00 0.00 177.93 179.45 5req n ARG 123 N -4.94 2.02 -2.82 2.45 1.74 -0.75 -1.26 116.66 113.09 5req n ARG 123 Ca 0.03 -1.36 -0.09 0.00 -0.77 0.00 0.00 57.85 55.66 5req n ARG 123 Cb 0.13 -1.38 0.03 0.00 -1.02 0.00 0.00 32.46 30.22 5req n ARG 123 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 5req n GLY 124 N 0.96 0.33 3.42 -0.13 0.00 -0.84 -4.92 105.19 104.01 5req n GLY 124 Ca 0.13 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 5req n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 5req s TYR 125 N -3.03 2.50 0.70 1.61 2.02 0.15 -4.18 117.35 117.12 5req s TYR 125 Ca 0.20 -0.30 -0.10 0.00 -0.37 0.00 0.00 57.07 56.50 5req s TYR 125 Cb -0.09 -1.48 0.02 0.00 -0.40 0.00 0.00 41.96 40.01 5req s TYR 125 CO 0.24 0.17 1.07 -0.51 -1.57 0.00 0.00 175.55 174.95 5req s ASP 126 N -1.15 5.33 0.52 2.29 1.01 -1.26 -3.70 116.67 119.70 5req s ASP 126 Ca 0.13 0.99 0.32 0.00 0.71 0.00 0.00 52.55 54.69 5req s ASP 126 Cb -0.10 -1.78 1.24 0.00 1.01 0.00 0.00 42.92 43.29 5req s ASP 126 CO 0.03 -1.37 1.93 0.28 0.21 0.00 0.00 175.17 176.25 5req h SER 127 N -0.62 0.00 0.83 0.27 0.02 -1.95 -2.75 113.55 109.36 5req h SER 127 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 5req h SER 127 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 5req h SER 127 CO 0.63 0.00 -0.51 -0.90 -1.14 0.00 0.00 176.83 174.91 5req n ASP 128 N -3.02 0.61 -4.68 3.07 5.68 -1.26 -4.77 116.55 112.19 5req n ASP 128 Ca 0.01 0.09 -0.47 0.00 -0.50 0.00 0.00 54.79 53.93 5req n ASP 128 Cb 0.32 0.07 -0.04 0.00 -1.14 0.00 0.00 41.12 40.33 5req n ASP 128 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 5req n ASN 129 N -1.94 3.48 -0.30 -1.12 2.85 -1.04 -4.90 115.26 112.30 5req n ASN 129 Ca 0.04 0.99 0.03 0.00 -0.11 0.00 0.00 54.58 55.53 5req n ASN 129 Cb 0.41 -1.41 0.23 0.00 1.24 0.00 0.00 39.78 40.24 5req n ASN 129 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 5req h PRO 130 N 8.57 1.03 0.00 1.20 0.13 -1.89 -3.18 132.00 137.86 5req h PRO 130 Ca -0.48 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.57 5req h PRO 130 Cb 1.26 -0.23 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 5req h PRO 130 CO 0.93 0.68 -0.09 0.00 -0.23 0.00 0.00 178.00 179.29 5req h ARG 131 N 1.06 0.00 -0.30 0.86 3.08 -1.97 -3.12 114.38 113.99 5req h ARG 131 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 5req h ARG 131 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 5req h ARG 131 CO -0.13 0.09 0.00 1.33 -1.07 0.00 0.00 179.97 180.20 5req n VAL 132 N -3.65 1.81 -0.19 2.04 0.24 -1.20 -4.83 118.33 112.55 5req n VAL 132 Ca -0.02 -1.54 0.00 0.00 -2.04 0.00 0.00 64.34 60.75 5req n VAL 132 Cb 0.21 0.03 0.10 0.00 -1.47 0.00 0.00 33.84 32.71 5req n VAL 132 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 5req h ALA 133 N 1.96 0.62 0.00 2.33 0.00 -1.63 -2.65 119.26 119.89 5req h ALA 133 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 5req h ALA 133 Cb 1.19 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 5req h ALA 133 CO 0.15 -0.36 -0.04 0.78 0.00 0.00 0.00 179.25 179.78 5req h GLY 134 N 0.18 0.00 0.37 0.00 0.00 -1.88 -3.07 103.07 98.67 5req h GLY 134 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 5req h GLY 134 CO -0.45 0.00 -0.95 1.22 0.00 0.00 0.00 176.54 176.36 5req n ASP 135 N -3.17 0.74 -4.58 0.19 8.00 -1.02 -4.63 116.55 112.08 5req n ASP 135 Ca -0.00 -0.59 -0.49 0.00 0.71 0.00 0.00 54.79 54.42 5req n ASP 135 Cb 0.28 0.84 -0.05 0.00 -0.02 0.00 0.00 41.12 42.17 5req n ASP 135 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 5req n VAL 136 N -1.65 0.38 -1.36 2.53 0.31 -1.07 -1.94 118.33 115.53 5req n VAL 136 Ca 0.03 -0.23 -0.12 0.00 -0.01 0.00 0.00 64.34 64.01 5req n VAL 136 Cb 0.37 -1.89 -0.05 0.00 -0.91 0.00 0.00 33.84 31.35 5req n VAL 136 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 5req n GLY 137 N 5.45 1.30 0.09 2.92 0.00 -1.26 -4.74 105.19 108.95 5req n GLY 137 Ca 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 5req n GLY 137 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 5req n MET 138 N -2.16 0.63 0.00 1.61 2.00 -0.82 -2.28 117.12 116.10 5req n MET 138 Ca -0.12 0.21 0.05 0.00 0.00 0.00 0.00 57.70 57.83 5req n MET 138 Cb 0.47 -1.77 -0.03 0.00 0.00 0.00 0.00 33.22 31.89 5req n MET 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 5req n ALA 139 N -2.46 3.00 0.00 3.04 0.00 -1.26 -4.82 120.51 118.01 5req n ALA 139 Ca -0.13 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 52.96 5req n ALA 139 Cb 0.91 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 20.03 5req n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5req n GLY 140 N 1.04 -1.24 3.76 0.00 0.00 -1.26 -4.74 105.19 102.77 5req n GLY 140 Ca 0.03 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 5req n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 5req s VAL 141 N -3.00 3.42 -0.46 1.61 0.11 -0.50 -2.66 120.40 118.92 5req s VAL 141 Ca 0.00 1.37 -0.22 0.00 -2.93 0.00 0.00 61.98 60.20 5req s VAL 141 Cb 0.00 -3.85 0.03 0.00 -1.53 0.00 0.00 36.38 31.03 5req s VAL 141 CO 0.00 0.28 0.74 0.00 -3.33 0.00 0.00 175.10 172.79 5req s ALA 142 N -1.23 3.31 -0.21 1.54 0.00 -0.60 -0.35 121.76 124.20 5req s ALA 142 Ca 0.47 -1.13 -0.03 0.00 0.00 0.00 0.00 51.96 51.27 5req s ALA 142 Cb -0.31 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.38 5req s ALA 142 CO 0.40 -1.92 -0.07 0.42 0.00 0.00 0.00 175.76 174.60 5req s ILE 143 N 3.14 3.13 -0.11 0.00 -1.09 -1.26 -4.61 121.20 120.40 5req s ILE 143 Ca 0.27 -0.58 0.01 0.00 -2.23 0.00 0.00 60.65 58.12 5req s ILE 143 Cb -0.13 -2.41 -0.07 0.00 -1.58 0.00 0.00 42.46 38.27 5req s ILE 143 CO 0.21 0.45 -0.10 0.47 -1.23 0.00 0.00 174.94 174.74 5req n ASP 144 N 4.75 3.16 -0.29 3.58 8.00 -1.26 -4.73 116.55 129.77 5req n ASP 144 Ca -0.19 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.26 5req n ASP 144 Cb 0.51 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 5req n ASP 144 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 5req n SER 145 N -2.82 0.00 -0.05 -2.24 3.41 -1.26 -0.48 113.62 110.19 5req n SER 145 Ca -0.19 -0.29 0.01 0.00 -0.26 0.00 0.00 58.87 58.14 5req n SER 145 Cb 0.70 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.97 5req n SER 145 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 5req h ILE 146 N 0.29 1.17 -0.54 -1.33 6.09 -1.85 -2.82 117.51 118.52 5req h ILE 146 Ca 0.00 -0.53 0.11 0.00 -1.37 0.00 0.00 64.86 63.07 5req h ILE 146 Cb 0.00 0.63 -0.11 0.00 0.47 0.00 0.00 36.82 37.82 5req h ILE 146 CO 0.00 0.21 -0.21 1.88 -3.07 0.00 0.00 178.15 176.96 5req h TYR 147 N 0.64 -0.50 -0.35 2.19 -1.99 -1.97 -1.39 116.97 113.59 5req h TYR 147 Ca 0.16 0.06 -0.15 0.00 2.00 0.00 0.00 58.73 60.80 5req h TYR 147 Cb 0.13 0.30 -0.01 0.00 2.00 0.00 0.00 36.73 39.16 5req h TYR 147 CO 0.01 -0.30 -0.35 -0.44 -0.00 0.00 0.00 178.16 177.08 5req h ASP 148 N -0.08 0.91 -0.01 3.88 3.32 -1.86 -2.92 116.42 119.67 5req h ASP 148 Ca 0.25 -0.47 -0.12 0.00 0.02 0.00 0.00 57.03 56.71 5req h ASP 148 Cb 0.47 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 5req h ASP 148 CO -0.59 1.19 -0.38 -0.03 -1.72 0.00 0.00 179.24 177.71 5req h MET 149 N 0.65 0.51 -0.38 3.56 4.05 -1.40 -1.50 114.93 120.42 5req h MET 149 Ca 0.06 -0.24 0.01 0.00 -0.28 0.00 0.00 59.70 59.24 5req h MET 149 Cb 0.94 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.71 5req h MET 149 CO 0.09 0.81 0.24 -0.09 0.23 0.00 0.00 176.91 178.19 5req h ARG 150 N 0.43 0.48 0.00 0.39 2.43 -1.33 -3.14 114.38 113.64 5req h ARG 150 Ca 0.04 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 5req h ARG 150 Cb 0.85 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.27 5req h ARG 150 CO 0.07 0.32 -0.60 0.93 -1.51 0.00 0.00 179.97 179.18 5req h GLU 151 N 0.50 0.00 -0.63 0.20 5.08 -1.28 -2.09 114.58 116.36 5req h GLU 151 Ca 0.14 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.42 5req h GLU 151 Cb -0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 5req h GLU 151 CO -0.04 0.60 0.06 1.25 -1.00 0.00 0.00 179.01 179.88 5req h LEU 152 N 0.00 1.03 -2.93 1.33 5.85 -1.27 -3.18 115.31 116.14 5req h LEU 152 Ca -0.01 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.45 5req h LEU 152 Cb 1.13 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.89 5req h LEU 152 CO 0.08 1.05 0.00 0.49 -0.34 0.00 0.00 178.44 179.72 5req n PHE 153 N -4.20 0.95 -1.67 1.25 3.72 -1.19 -4.37 117.46 111.95 5req n PHE 153 Ca 0.04 -0.55 -0.43 0.00 -0.05 0.00 0.00 57.45 56.46 5req n PHE 153 Cb 0.31 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.73 5req n PHE 153 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 5req n ALA 154 N 1.02 1.73 -0.86 4.37 0.00 -0.79 -1.67 120.51 124.31 5req n ALA 154 Ca 0.21 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.90 5req n ALA 154 Cb 0.65 -2.64 0.00 0.00 0.00 0.00 0.00 19.45 17.46 5req n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5req n GLY 155 N 4.43 0.54 2.72 0.00 0.00 -1.26 -5.00 105.19 106.62 5req n GLY 155 Ca 0.20 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 5req n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5req s ILE 156 N -2.00 1.25 -0.01 -0.61 1.01 -0.67 -5.10 121.20 115.07 5req s ILE 156 Ca 0.00 -2.18 -0.30 0.00 0.00 0.00 0.00 60.65 58.16 5req s ILE 156 Cb 0.00 -1.90 -0.09 0.00 0.01 0.00 0.00 42.46 40.48 5req s ILE 156 CO 0.00 -0.82 2.00 -2.65 0.00 0.00 0.00 174.94 173.47 5req n PRO 157 N 3.97 2.67 0.00 2.79 -0.02 -1.26 -4.91 135.00 138.24 5req n PRO 157 Ca 0.05 0.96 0.15 0.00 -2.02 0.00 0.00 63.50 62.64 5req n PRO 157 Cb 0.37 -2.99 0.79 0.00 -0.02 0.00 0.00 33.50 31.65 5req n PRO 157 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 5req n LEU 158 N 7.96 0.04 0.14 2.45 4.77 -1.26 -1.93 117.00 129.17 5req n LEU 158 Ca 0.22 0.20 0.09 0.00 -0.03 0.00 0.00 56.01 56.48 5req n LEU 158 Cb 0.40 -0.21 0.05 0.00 -2.33 0.00 0.00 43.42 41.32 5req n LEU 158 CO 0.69 0.01 0.30 -2.24 -1.33 0.00 0.00 177.39 174.82 5req h ASP 159 N 0.05 0.00 0.00 -1.43 2.03 -1.91 -3.33 116.42 111.82 5req h ASP 159 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 5req h ASP 159 Cb 0.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 5req h ASP 159 CO 0.00 0.15 -0.83 0.00 -1.03 0.00 0.00 179.24 177.53 5req n GLN 160 N -2.93 2.22 -4.21 4.15 6.02 -1.00 -4.90 117.38 116.73 5req n GLN 160 Ca 0.00 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.00 56.66 5req n GLN 160 Cb 0.61 -1.15 -0.09 0.00 1.02 0.00 0.00 30.24 30.63 5req n GLN 160 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 5req s MET 161 N -2.37 2.31 -0.34 -1.09 1.75 -0.81 -5.06 119.30 113.68 5req s MET 161 Ca 0.03 -0.93 -0.14 0.00 -1.25 0.00 0.00 55.69 53.40 5req s MET 161 Cb 0.09 -2.41 -0.02 0.00 2.84 0.00 0.00 34.83 35.34 5req s MET 161 CO 0.53 0.53 0.28 0.45 -0.65 0.00 0.00 175.02 176.16 5req s SER 162 N -2.19 6.10 -0.15 1.11 0.15 -1.26 -4.32 113.70 113.15 5req s SER 162 Ca 0.23 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.52 5req s SER 162 Cb -0.11 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 5req s SER 162 CO 0.15 -0.27 -0.17 -0.69 1.20 0.00 0.00 173.24 173.46 5req s VAL 163 N 1.81 2.50 -0.00 4.45 1.01 -0.64 -2.00 120.40 127.53 5req s VAL 163 Ca 0.08 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 5req s VAL 163 Cb -0.17 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 5req s VAL 163 CO 0.11 0.53 0.17 -0.55 0.00 0.00 0.00 175.10 175.35 5req s SER 164 N 0.75 6.25 -0.09 3.32 0.15 0.36 -1.59 113.70 122.85 5req s SER 164 Ca -0.07 0.30 -0.01 0.00 0.70 0.00 0.00 55.95 56.87 5req s SER 164 Cb -0.16 -1.93 0.03 0.00 -1.71 0.00 0.00 66.02 62.26 5req s SER 164 CO 0.00 0.25 -0.01 -0.04 1.20 0.00 0.00 173.24 174.65 5req s MET 165 N -1.97 0.76 -0.94 5.44 -1.94 0.38 -1.66 119.30 119.37 5req s MET 165 Ca 0.27 -0.01 -0.19 0.00 -1.71 0.00 0.00 55.69 54.06 5req s MET 165 Cb -0.13 -1.19 0.13 0.00 2.01 0.00 0.00 34.83 35.65 5req s MET 165 CO 0.19 -0.33 1.14 0.99 -0.01 0.00 0.00 175.02 177.00 5req s THR 166 N 1.92 4.70 -0.25 2.05 2.01 -0.99 -1.10 115.64 123.97 5req s THR 166 Ca 0.04 -1.56 -0.08 0.00 0.31 0.00 0.00 61.69 60.41 5req s THR 166 Cb -0.13 -4.79 0.11 0.00 0.01 0.00 0.00 72.50 67.70 5req s THR 166 CO -0.06 -1.53 0.52 -0.32 -0.69 0.00 0.00 174.62 172.55 5req s MET 167 N 2.76 0.44 0.00 4.92 0.00 -1.26 -4.49 119.30 121.67 5req s MET 167 Ca 0.33 1.22 0.00 0.00 0.00 0.00 0.00 55.69 57.24 5req s MET 167 Cb -0.05 0.57 0.00 0.00 0.00 0.00 0.00 34.83 35.35 5req s MET 167 CO -0.09 -0.24 0.00 0.09 0.00 0.00 0.00 175.02 174.77 5req n ASN 168 N 5.42 1.28 0.05 1.11 3.02 -1.26 -1.94 115.26 122.94 5req n ASN 168 Ca -0.10 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.43 5req n ASN 168 Cb 0.49 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.65 5req n ASN 168 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 5req h GLY 169 N 0.00 -0.14 -5.47 7.41 0.00 -1.66 -3.32 103.07 99.89 5req h GLY 169 Ca 0.00 0.05 -0.71 0.00 0.00 0.00 0.00 47.33 46.67 5req h GLY 169 CO 0.00 -0.05 1.37 0.00 0.00 0.00 0.00 176.54 177.86 5req n ALA 170 N -2.09 6.49 -0.08 3.60 0.00 -0.39 -4.67 120.51 123.37 5req n ALA 170 Ca -0.02 -4.01 -0.15 0.00 0.00 0.00 0.00 53.44 49.26 5req n ALA 170 Cb 0.05 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.11 5req n ALA 170 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 5req h VAL 171 N 2.26 1.27 0.56 0.00 3.04 -1.86 -2.60 116.25 118.92 5req h VAL 171 Ca 0.57 -1.74 -0.02 0.00 -1.01 0.00 0.00 66.70 64.50 5req h VAL 171 Cb 0.35 1.66 -0.01 0.00 -2.01 0.00 0.00 31.29 31.28 5req h VAL 171 CO 1.26 0.57 -0.38 -0.07 -1.01 0.00 0.00 177.57 177.93 5req h LEU 172 N 0.65 -0.98 -0.61 3.16 3.38 -1.90 0.24 115.31 119.24 5req h LEU 172 Ca 0.01 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 5req h LEU 172 Cb 1.17 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 42.19 5req h LEU 172 CO 0.12 -0.58 0.30 1.55 0.09 0.00 0.00 178.44 179.93 5req h PRO 173 N -0.91 0.88 -0.25 1.13 0.13 -1.93 -1.77 132.00 129.27 5req h PRO 173 Ca -0.07 -0.12 -0.11 0.00 -0.87 0.00 0.00 66.00 64.83 5req h PRO 173 Cb 0.75 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 5req h PRO 173 CO 0.04 0.70 -0.27 0.82 -0.23 0.00 0.00 178.00 179.06 5req h ILE 174 N 0.84 1.31 -0.71 -3.56 1.08 -1.36 -2.14 117.51 112.96 5req h ILE 174 Ca 0.21 -1.45 -0.04 0.00 -0.39 0.00 0.00 64.86 63.19 5req h ILE 174 Cb 0.10 1.67 -0.03 0.00 -3.07 0.00 0.00 36.82 35.49 5req h ILE 174 CO -0.03 0.46 0.29 0.25 -0.69 0.00 0.00 178.15 178.43 5req h LEU 175 N 0.34 0.98 -0.78 1.44 5.85 -0.49 -2.67 115.31 119.97 5req h LEU 175 Ca 0.04 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.60 5req h LEU 175 Cb 0.84 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 5req h LEU 175 CO 0.07 0.88 0.52 0.00 -0.34 0.00 0.00 178.44 179.56 5req h ALA 176 N 1.14 0.99 0.00 1.25 0.00 -1.33 -2.49 119.26 118.82 5req h ALA 176 Ca 0.24 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 5req h ALA 176 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 5req h ALA 176 CO -0.02 0.41 -0.41 -0.07 0.00 0.00 0.00 179.25 179.16 5req h LEU 177 N 1.06 0.00 -0.10 0.00 3.38 -1.18 0.05 115.31 118.53 5req h LEU 177 Ca 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 5req h LEU 177 Cb -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 5req h LEU 177 CO -0.06 0.41 0.00 0.22 0.09 0.00 0.00 178.44 179.10 5req h TYR 178 N 0.00 0.18 -0.43 1.13 3.20 -1.38 0.27 116.97 119.95 5req h TYR 178 Ca -0.00 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.87 5req h TYR 178 Cb 0.87 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.06 5req h TYR 178 CO 0.00 0.41 0.21 0.28 -1.64 0.00 0.00 178.16 177.42 5req h VAL 179 N -0.10 0.97 -0.48 1.81 2.07 -1.22 0.17 116.25 119.46 5req h VAL 179 Ca 0.03 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 5req h VAL 179 Cb 0.34 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 5req h VAL 179 CO 0.00 0.08 0.23 0.58 0.02 0.00 0.00 177.57 178.48 5req h VAL 180 N 0.42 1.19 -0.12 2.57 2.07 -0.96 -1.34 116.25 120.08 5req h VAL 180 Ca 0.18 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.19 5req h VAL 180 Cb 0.09 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 5req h VAL 180 CO -0.13 0.21 -0.09 0.74 0.02 0.00 0.00 177.57 178.32 5req h THR 181 N 0.63 0.73 -0.35 2.57 2.02 0.28 -2.65 112.91 116.14 5req h THR 181 Ca 0.16 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.42 5req h THR 181 Cb 0.13 0.73 -0.09 0.00 -1.74 0.00 0.00 68.15 67.18 5req h THR 181 CO -0.02 0.00 -0.32 0.00 0.37 0.00 0.00 175.52 175.55 5req h ALA 182 N 0.99 -0.21 -0.73 6.16 0.00 -0.61 -2.99 119.26 121.87 5req h ALA 182 Ca 0.08 0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.24 5req h ALA 182 Cb 0.22 0.68 -0.11 0.00 0.00 0.00 0.00 17.79 18.57 5req h ALA 182 CO -0.18 -0.73 0.16 1.49 0.00 0.00 0.00 179.25 179.98 5req h GLU 183 N -0.27 0.24 0.00 0.00 4.81 -0.94 -1.62 114.58 116.79 5req h GLU 183 Ca 0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 5req h GLU 183 Cb 0.53 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.86 5req h GLU 183 CO -0.50 0.16 0.00 0.93 -0.73 0.00 0.00 179.01 178.86 5req h GLU 184 N 0.25 0.00 -0.00 1.92 5.08 -1.34 -0.15 114.58 120.34 5req h GLU 184 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 5req h GLU 184 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 5req h GLU 184 CO -0.53 0.00 -0.32 1.04 -1.00 0.00 0.00 179.01 178.20 5req n GLN 185 N -2.37 0.04 -0.27 2.33 6.02 -0.81 -4.94 117.38 117.38 5req n GLN 185 Ca 0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 5req n GLN 185 Cb 0.19 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.95 5req n GLN 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 5req n GLY 186 N 1.49 0.86 3.58 1.08 0.00 -0.07 -5.03 105.19 107.10 5req n GLY 186 Ca 0.06 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 5req n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5req s VAL 187 N -2.00 5.28 0.81 1.61 1.01 -0.67 -4.96 120.40 121.48 5req s VAL 187 Ca 0.00 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 5req s VAL 187 Cb 0.00 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 32.87 5req s VAL 187 CO 0.00 0.19 1.09 -0.54 0.00 0.00 0.00 175.10 175.83 5req s LYS 188 N 1.82 1.94 0.43 2.72 1.02 -1.26 -2.99 119.74 123.41 5req s LYS 188 Ca 0.08 0.86 0.12 0.00 0.02 0.00 0.00 55.97 57.05 5req s LYS 188 Cb -0.16 -1.88 0.93 0.00 -0.52 0.00 0.00 37.83 36.19 5req s LYS 188 CO 0.11 -1.78 1.99 -1.35 -0.92 0.00 0.00 175.35 173.40 5req h PRO 189 N -1.21 0.16 0.00 -1.68 0.11 -1.93 -3.10 132.00 124.35 5req h PRO 189 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 5req h PRO 189 Cb 1.26 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 5req h PRO 189 CO 0.56 0.26 0.00 1.05 -0.21 0.00 0.00 178.00 179.66 5req h GLU 190 N 0.16 0.00 -0.00 1.05 9.09 -1.89 -2.98 114.58 120.01 5req h GLU 190 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.45 5req h GLU 190 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.36 5req h GLU 190 CO 0.01 0.00 -0.22 1.04 0.05 0.00 0.00 179.01 179.89 5req n GLN 191 N -2.62 0.64 -2.57 1.06 6.02 -1.17 -4.39 117.38 114.35 5req n GLN 191 Ca 0.03 -0.32 -0.43 0.00 -0.01 0.00 0.00 57.00 56.27 5req n GLN 191 Cb 0.35 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.09 5req n GLN 191 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 5req s LEU 192 N -2.58 3.82 -0.18 1.08 1.43 -1.13 -4.69 118.68 116.44 5req s LEU 192 Ca 0.24 0.91 -0.09 0.00 -1.03 0.00 0.00 54.13 54.16 5req s LEU 192 Cb 0.19 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 5req s LEU 192 CO 0.53 -1.05 0.10 0.00 0.23 0.00 0.00 176.35 176.15 5req s ALA 193 N 4.11 3.58 0.00 4.21 0.00 -1.26 -3.42 121.76 128.98 5req s ALA 193 Ca 0.49 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.74 5req s ALA 193 Cb -0.12 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.96 5req s ALA 193 CO 0.22 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.60 5req n GLY 194 N 3.39 -0.77 3.09 0.00 0.00 -1.24 -1.63 105.19 108.03 5req n GLY 194 Ca -0.17 -1.24 -0.12 0.00 0.00 0.00 0.00 46.02 44.50 5req n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5req s THR 195 N -2.96 0.02 -0.07 2.61 2.01 -0.62 0.22 115.64 116.87 5req s THR 195 Ca 0.00 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 61.85 5req s THR 195 Cb 0.00 -0.34 -0.01 0.00 0.01 0.00 0.00 72.50 72.16 5req s THR 195 CO 0.00 -0.11 -0.24 -0.51 -0.69 0.00 0.00 174.62 173.07 5req s ILE 196 N -0.36 2.13 0.04 1.82 1.10 -1.05 -0.47 121.20 124.41 5req s ILE 196 Ca -0.05 -1.03 -0.26 0.00 -0.51 0.00 0.00 60.65 58.80 5req s ILE 196 Cb -0.03 -1.78 -0.14 0.00 0.15 0.00 0.00 42.46 40.65 5req s ILE 196 CO 0.01 0.57 1.34 -0.61 -2.11 0.00 0.00 174.94 174.13 5req h GLN 197 N 6.15 -0.91 -5.80 3.50 4.15 -1.15 -3.19 115.11 117.86 5req h GLN 197 Ca -0.30 0.06 -0.43 0.00 0.77 0.00 0.00 58.65 58.75 5req h GLN 197 Cb 1.19 0.21 0.03 0.00 0.21 0.00 0.00 27.48 29.11 5req h GLN 197 CO 0.47 -0.60 -0.69 -1.71 -1.93 0.00 0.00 178.83 174.37 5req n ASN 198 N -4.64 -5.42 -3.99 -0.69 4.05 -0.82 -1.23 115.26 102.53 5req n ASN 198 Ca -0.12 -0.59 -0.31 0.00 0.45 0.00 0.00 54.58 54.02 5req n ASN 198 Cb 0.37 -4.32 -0.15 0.00 1.23 0.00 0.00 39.78 36.91 5req n ASN 198 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 5req s ASP 199 N -3.16 4.55 0.21 1.20 -1.08 -1.26 -4.81 116.67 112.33 5req s ASP 199 Ca 0.56 -2.56 0.16 0.00 -0.52 0.00 0.00 52.55 50.20 5req s ASP 199 Cb -0.27 -1.63 0.01 0.00 -1.46 0.00 0.00 42.92 39.56 5req s ASP 199 CO 0.70 -0.31 1.22 -0.29 0.52 0.00 0.00 175.17 177.01 5req h ILE 200 N 6.09 0.65 -0.98 4.11 6.09 -1.90 -3.33 117.51 128.24 5req h ILE 200 Ca -0.06 -2.01 0.06 0.00 -1.37 0.00 0.00 64.86 61.48 5req h ILE 200 Cb 0.96 2.22 -0.06 0.00 0.47 0.00 0.00 36.82 40.40 5req h ILE 200 CO 0.60 0.37 0.63 -0.07 -3.07 0.00 0.00 178.15 176.61 5req h LEU 201 N 0.00 1.02 -0.16 2.19 3.38 -1.99 0.31 115.31 120.07 5req h LEU 201 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 5req h LEU 201 Cb 1.41 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.94 5req h LEU 201 CO 0.05 0.67 0.00 0.07 0.09 0.00 0.00 178.44 179.32 5req h LYS 202 N 1.16 0.00 -0.38 1.13 5.09 -1.92 -2.05 116.57 119.60 5req h LYS 202 Ca 0.41 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 61.10 5req h LYS 202 Cb 0.12 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.44 5req h LYS 202 CO -0.15 0.00 0.04 0.93 -2.09 0.00 0.00 179.45 178.18 5req h GLU 203 N 0.00 0.65 -0.23 0.07 4.39 -1.05 0.30 114.58 118.72 5req h GLU 203 Ca 0.00 -0.19 -0.09 0.00 0.34 0.00 0.00 59.36 59.42 5req h GLU 203 Cb 0.82 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.40 5req h GLU 203 CO 0.00 0.72 -0.21 0.74 -1.16 0.00 0.00 179.01 179.11 5req h PHE 204 N 0.49 0.64 0.07 4.33 0.04 -1.45 -0.40 116.94 120.66 5req h PHE 204 Ca 0.11 -0.19 -0.00 0.00 2.80 0.00 0.00 57.97 60.69 5req h PHE 204 Cb 0.41 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.42 5req h PHE 204 CO 0.03 0.87 -0.03 1.98 -0.60 0.00 0.00 178.31 180.56 5req h MET 205 N 0.23 -0.09 0.00 1.51 4.05 -1.39 -3.45 114.93 115.79 5req h MET 205 Ca 0.04 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 5req h MET 205 Cb 0.75 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.57 5req h MET 205 CO 0.05 0.09 0.00 1.33 0.23 0.00 0.00 176.91 178.62 5req n VAL 206 N -5.05 0.00 0.18 -5.77 0.24 0.87 -4.55 118.33 104.25 5req n VAL 206 Ca -0.08 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.31 5req n VAL 206 Cb 0.13 0.00 0.11 0.00 -1.47 0.00 0.00 33.84 32.61 5req n VAL 206 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 5req h ARG 207 N 0.00 0.00 -5.41 7.34 2.43 -0.89 -3.47 114.38 114.39 5req h ARG 207 Ca 0.00 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.81 5req h ARG 207 Cb 0.00 0.00 0.13 0.00 -0.42 0.00 0.00 29.97 29.68 5req h ARG 207 CO 0.00 0.13 -0.63 0.09 -1.51 0.00 0.00 179.97 178.05 5req n ASN 208 N -3.08 -5.68 -1.57 -3.80 3.02 -0.17 -4.80 115.26 99.17 5req n ASN 208 Ca 0.03 -0.50 0.02 0.00 -0.03 0.00 0.00 54.58 54.09 5req n ASN 208 Cb 0.59 -4.64 0.07 0.00 -0.61 0.00 0.00 39.78 35.19 5req n ASN 208 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 5req n THR 209 N -4.72 0.93 -1.33 3.41 -2.24 -1.26 -4.69 114.28 104.39 5req n THR 209 Ca -0.01 -2.11 -0.30 0.00 -2.27 0.00 0.00 64.05 59.35 5req n THR 209 Cb 0.56 0.60 0.11 0.00 -2.10 0.00 0.00 70.33 69.51 5req n THR 209 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 5req s TYR 210 N -1.71 2.55 0.03 4.78 -0.85 -1.26 -3.31 117.35 117.59 5req s TYR 210 Ca 0.35 1.29 -0.01 0.00 -0.52 0.00 0.00 57.07 58.18 5req s TYR 210 Cb 0.37 -3.11 -0.00 0.00 0.38 0.00 0.00 41.96 39.60 5req s TYR 210 CO -0.11 -2.05 -0.01 -0.89 -1.52 0.00 0.00 175.55 170.98 5req n ILE 211 N -3.65 0.54 -2.66 -3.49 5.41 -1.26 -4.86 119.36 109.39 5req n ILE 211 Ca 0.07 0.19 -0.26 0.00 1.00 0.00 0.00 62.75 63.75 5req n ILE 211 Cb 0.55 -1.29 0.01 0.00 -0.71 0.00 0.00 39.64 38.20 5req n ILE 211 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 5req s TYR 212 N -1.46 3.42 1.04 1.39 2.02 -1.26 -1.52 117.35 120.98 5req s TYR 212 Ca -0.01 0.65 -0.12 0.00 -0.37 0.00 0.00 57.07 57.22 5req s TYR 212 Cb 0.00 -2.41 0.21 0.00 -0.40 0.00 0.00 41.96 39.36 5req s TYR 212 CO 0.01 -0.43 1.07 -2.14 -1.57 0.00 0.00 175.55 172.49 5req s PRO 213 N -4.77 0.05 0.17 -1.71 0.02 -1.26 -4.54 135.00 122.96 5req s PRO 213 Ca 0.49 1.02 -0.15 0.00 0.02 0.00 0.00 61.00 62.38 5req s PRO 213 Cb -0.10 -1.65 0.13 0.00 0.02 0.00 0.00 34.50 32.90 5req s PRO 213 CO 0.43 -3.12 1.71 -1.35 -0.33 0.00 0.00 177.00 174.34 5req h PRO 214 N -2.20 0.15 0.69 5.54 0.11 -1.98 -1.53 132.00 132.78 5req h PRO 214 Ca -0.54 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.53 5req h PRO 214 Cb 1.31 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.39 5req h PRO 214 CO 0.49 0.10 -0.33 0.37 -0.21 0.00 0.00 178.00 178.42 5req h GLN 215 N 0.15 -0.89 -0.83 1.05 -0.00 -1.99 -1.17 115.11 111.43 5req h GLN 215 Ca 0.21 0.06 0.07 0.00 -0.00 0.00 0.00 58.65 58.99 5req h GLN 215 Cb 0.29 0.20 -0.06 0.00 0.00 0.00 0.00 27.48 27.91 5req h GLN 215 CO -0.32 -0.57 0.50 -1.00 0.00 0.00 0.00 178.83 177.44 5req h PRO 216 N -0.98 0.87 -0.65 -2.39 0.13 -1.95 -0.87 132.00 126.16 5req h PRO 216 Ca -0.09 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.01 5req h PRO 216 Cb 0.72 -0.20 -0.04 0.00 0.13 0.00 0.00 31.00 31.62 5req h PRO 216 CO 0.15 0.57 0.40 0.77 -0.23 0.00 0.00 178.00 179.67 5req h SER 217 N 0.89 0.66 0.40 1.44 0.02 -1.18 -1.62 113.55 114.16 5req h SER 217 Ca 0.38 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.24 5req h SER 217 Cb 0.23 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 5req h SER 217 CO -0.20 0.45 -0.41 -0.03 -1.14 0.00 0.00 176.83 175.51 5req h MET 218 N 0.79 0.02 -0.29 3.45 -1.53 -0.79 -2.61 114.93 113.97 5req h MET 218 Ca 0.26 -0.01 -0.12 0.00 -3.44 0.00 0.00 59.70 56.40 5req h MET 218 Cb 0.03 -0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.07 5req h MET 218 CO -0.11 0.43 -0.27 -0.09 0.14 0.00 0.00 176.91 177.01 5req h ARG 219 N 0.02 0.69 -0.34 0.39 2.43 -0.80 -2.50 114.38 114.26 5req h ARG 219 Ca -0.00 -0.36 0.06 0.00 -0.81 0.00 0.00 59.98 58.87 5req h ARG 219 Cb 0.74 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.25 5req h ARG 219 CO 0.05 0.97 0.03 0.82 -1.51 0.00 0.00 179.97 180.33 5req h ILE 220 N 0.44 0.78 -0.23 1.20 2.04 -1.08 -1.55 117.51 119.10 5req h ILE 220 Ca 0.05 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.89 5req h ILE 220 Cb 0.83 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 5req h ILE 220 CO 0.07 0.02 0.04 0.40 0.00 0.00 0.00 178.15 178.68 5req h ILE 221 N 0.13 0.89 -0.26 -0.67 2.04 -1.45 -2.13 117.51 116.07 5req h ILE 221 Ca 0.17 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 5req h ILE 221 Cb 0.21 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 5req h ILE 221 CO -0.25 0.02 0.13 0.77 0.00 0.00 0.00 178.15 178.82 5req h SER 222 N 0.13 0.31 0.46 1.72 4.64 -1.14 -1.15 113.55 118.51 5req h SER 222 Ca 0.11 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.26 5req h SER 222 Cb 0.11 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 5req h SER 222 CO -0.14 0.26 -0.66 -0.33 -0.87 0.00 0.00 176.83 175.09 5req h GLU 223 N 0.35 0.18 -0.24 4.77 5.08 -1.05 -1.06 114.58 122.61 5req h GLU 223 Ca 0.09 -0.14 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 5req h GLU 223 Cb 0.03 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.31 5req h GLU 223 CO -0.01 0.77 -0.46 0.82 -1.00 0.00 0.00 179.01 179.13 5req h ILE 224 N 0.13 1.30 -0.14 3.13 2.04 -0.68 -1.35 117.51 121.94 5req h ILE 224 Ca -0.01 -1.67 0.04 0.00 1.00 0.00 0.00 64.86 64.22 5req h ILE 224 Cb 1.18 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.96 5req h ILE 224 CO 0.10 0.53 -0.11 -0.26 0.00 0.00 0.00 178.15 178.41 5req h PHE 225 N 0.48 -0.26 -0.10 1.37 0.04 -1.12 0.25 116.94 117.60 5req h PHE 225 Ca 0.01 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.81 5req h PHE 225 Cb 1.07 0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.35 5req h PHE 225 CO 0.08 -0.16 0.04 0.00 -0.60 0.00 0.00 178.31 177.67 5req h ALA 226 N 0.99 0.11 0.07 2.45 0.00 -1.14 -0.83 119.26 120.91 5req h ALA 226 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 5req h ALA 226 Cb 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 5req h ALA 226 CO -0.21 -0.42 -0.03 -0.92 0.00 0.00 0.00 179.25 177.66 5req h TYR 227 N 0.09 -0.09 -0.68 0.00 3.20 -1.00 -2.70 116.97 115.80 5req h TYR 227 Ca 0.04 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 5req h TYR 227 Cb 0.01 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 5req h TYR 227 CO -0.09 0.08 0.26 1.79 -1.64 0.00 0.00 178.16 178.56 5req h THR 228 N -0.24 1.24 -0.73 1.81 1.35 -0.48 -0.14 112.91 115.72 5req h THR 228 Ca -0.01 -0.77 0.07 0.00 -0.55 0.00 0.00 66.41 65.16 5req h THR 228 Cb 0.21 0.48 -0.06 0.00 -1.73 0.00 0.00 68.15 67.05 5req h THR 228 CO 0.02 0.30 0.40 -1.28 -0.25 0.00 0.00 175.52 174.71 5req h SER 229 N 0.96 0.58 0.03 5.36 0.87 -1.19 0.21 113.55 120.38 5req h SER 229 Ca 0.22 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.82 5req h SER 229 Cb 0.22 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 5req h SER 229 CO -0.02 0.36 -0.01 0.00 -0.53 0.00 0.00 176.83 176.62 5req h ALA 230 N 1.39 -0.04 0.00 6.23 0.00 -1.30 -3.42 119.26 122.12 5req h ALA 230 Ca 0.34 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 5req h ALA 230 Cb 0.26 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 5req h ALA 230 CO -0.21 -0.21 -1.76 0.09 0.00 0.00 0.00 179.25 177.16 5req n ASN 231 N -4.81 1.21 -3.61 0.00 3.02 -0.08 -4.88 115.26 106.11 5req n ASN 231 Ca -0.09 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.19 5req n ASN 231 Cb 0.31 1.75 -0.11 0.00 -0.61 0.00 0.00 39.78 41.11 5req n ASN 231 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 5req s MET 232 N -3.14 1.48 0.49 3.52 -1.94 0.73 -2.73 119.30 117.72 5req s MET 232 Ca -0.06 -2.50 0.28 0.00 -1.71 0.00 0.00 55.69 51.69 5req s MET 232 Cb 0.11 -2.22 1.21 0.00 2.01 0.00 0.00 34.83 35.93 5req s MET 232 CO 0.69 -1.32 1.94 -1.00 -0.01 0.00 0.00 175.02 175.32 5req h PRO 233 N 5.73 0.00 -0.02 2.03 0.13 -1.78 -2.72 132.00 135.37 5req h PRO 233 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 5req h PRO 233 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 5req h PRO 233 CO 0.50 0.14 -0.02 1.63 -0.23 0.00 0.00 178.00 180.02 5req n LYS 234 N -3.38 1.82 -3.29 0.86 5.02 -1.26 -4.94 118.16 112.98 5req n LYS 234 Ca -0.00 -1.23 -0.38 0.00 -2.02 0.00 0.00 58.31 54.67 5req n LYS 234 Cb 0.34 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.82 5req n LYS 234 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 5req s TRP 235 N -2.03 3.48 -0.39 2.13 -0.11 -1.02 -3.63 118.94 117.37 5req s TRP 235 Ca 0.34 0.87 -0.27 0.00 1.22 0.00 0.00 56.10 58.26 5req s TRP 235 Cb 0.21 -2.58 0.02 0.00 -1.50 0.00 0.00 33.47 29.61 5req s TRP 235 CO 0.34 0.11 0.98 -0.80 -4.62 0.00 0.00 176.95 172.96 5req s ASN 236 N 0.74 6.69 0.36 5.86 0.01 0.13 -4.84 114.94 123.90 5req s ASN 236 Ca 0.26 0.59 0.26 0.00 -0.71 0.00 0.00 52.86 53.26 5req s ASN 236 Cb -0.15 -2.49 0.83 0.00 0.41 0.00 0.00 41.25 39.85 5req s ASN 236 CO 0.10 -0.94 1.76 0.77 -1.51 0.00 0.00 177.10 177.28 5req h SER 237 N 8.59 0.00 -5.00 -1.22 4.64 -1.69 -2.79 113.55 116.08 5req h SER 237 Ca -0.23 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.02 5req h SER 237 Cb 1.07 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.97 5req h SER 237 CO 1.02 0.00 0.05 -0.51 -0.87 0.00 0.00 176.83 176.52 5req s ILE 238 N -3.30 0.02 -0.60 0.95 2.07 -1.23 -4.66 121.20 114.45 5req s ILE 238 Ca 0.06 -0.15 0.04 0.00 -1.41 0.00 0.00 60.65 59.20 5req s ILE 238 Cb 0.09 -0.89 0.15 0.00 0.13 0.00 0.00 42.46 41.94 5req s ILE 238 CO 0.57 -0.08 0.38 -0.55 -1.91 0.00 0.00 174.94 173.34 5req s SER 239 N -1.28 4.42 -0.41 4.50 0.15 -0.37 -1.37 113.70 119.33 5req s SER 239 Ca -0.11 -3.41 -0.27 0.00 0.70 0.00 0.00 55.95 52.85 5req s SER 239 Cb -0.02 -1.55 -0.03 0.00 -1.71 0.00 0.00 66.02 62.71 5req s SER 239 CO 0.08 -0.16 1.95 -0.63 1.20 0.00 0.00 173.24 175.68 5req s ILE 240 N -0.81 3.32 -0.12 6.45 1.01 0.11 -4.65 121.20 126.51 5req s ILE 240 Ca 0.21 0.29 -0.06 0.00 0.00 0.00 0.00 60.65 61.09 5req s ILE 240 Cb -0.14 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 5req s ILE 240 CO -0.09 -0.44 0.10 -0.44 0.00 0.00 0.00 174.94 174.07 5req s SER 241 N 7.75 6.08 -0.00 3.58 0.01 -1.26 -1.56 113.70 128.30 5req s SER 241 Ca 0.81 0.37 0.00 0.00 1.31 0.00 0.00 55.95 58.45 5req s SER 241 Cb -0.20 -1.92 -0.00 0.00 0.21 0.00 0.00 66.02 64.10 5req s SER 241 CO 0.29 0.39 0.00 0.61 0.41 0.00 0.00 173.24 174.95 5req n GLY 242 N 2.10 0.18 0.31 3.44 0.00 0.11 -4.72 105.19 106.61 5req n GLY 242 Ca -0.19 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 5req n GLY 242 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 5req h TYR 243 N 0.00 -0.77 -0.96 1.61 3.20 -1.78 -2.18 116.97 116.10 5req h TYR 243 Ca 0.00 0.04 0.14 0.00 3.14 0.00 0.00 58.73 62.05 5req h TYR 243 Cb 0.01 0.37 -0.08 0.00 1.54 0.00 0.00 36.73 38.57 5req h TYR 243 CO 0.00 -0.36 0.61 0.45 -1.64 0.00 0.00 178.16 177.21 5req h HIS 244 N -0.32 0.98 -0.81 -3.82 3.86 -1.91 -0.05 115.15 113.08 5req h HIS 244 Ca 0.12 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.33 5req h HIS 244 Cb 0.51 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.63 5req h HIS 244 CO -0.41 0.35 0.40 0.52 0.86 0.00 0.00 177.93 179.65 5req h MET 245 N 0.82 1.15 -0.25 2.45 2.86 -1.79 -1.92 114.93 118.25 5req h MET 245 Ca 0.49 -0.16 -0.08 0.00 -2.06 0.00 0.00 59.70 57.89 5req h MET 245 Cb 0.67 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 5req h MET 245 CO -0.26 0.88 -0.16 0.37 1.06 0.00 0.00 176.91 178.80 5req h GLN 246 N 1.15 0.55 0.00 1.72 4.15 -0.44 0.21 115.11 122.45 5req h GLN 246 Ca 0.28 -0.26 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 5req h GLN 246 Cb 0.09 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.77 5req h GLN 246 CO -0.04 0.82 -0.12 0.93 -1.93 0.00 0.00 178.83 178.49 5req h GLU 247 N 0.27 0.00 0.00 1.69 4.39 -1.16 -2.28 114.58 117.49 5req h GLU 247 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 5req h GLU 247 Cb 0.68 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 5req h GLU 247 CO 0.04 0.12 -0.28 0.00 -1.16 0.00 0.00 179.01 177.74 5req h ALA 248 N 1.88 0.85 0.00 3.43 0.00 -1.31 -3.48 119.26 120.63 5req h ALA 248 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 5req h ALA 248 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 5req h ALA 248 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 5req n GLY 249 N 1.18 -0.61 3.77 0.00 0.00 -0.86 -4.54 105.19 104.13 5req n GLY 249 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 5req n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5req s ALA 250 N -0.34 2.94 0.66 4.61 0.00 0.71 -4.08 121.76 126.26 5req s ALA 250 Ca 0.00 1.00 -0.11 0.00 0.00 0.00 0.00 51.96 52.85 5req s ALA 250 Cb 0.00 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 5req s ALA 250 CO 0.00 -0.78 1.06 0.95 0.00 0.00 0.00 175.76 176.99 5req s THR 251 N -1.51 4.10 0.22 0.00 -4.23 -1.26 -4.56 115.64 108.40 5req s THR 251 Ca 0.65 0.68 -0.09 0.00 -1.18 0.00 0.00 61.69 61.75 5req s THR 251 Cb -0.31 -3.67 0.19 0.00 1.34 0.00 0.00 72.50 70.06 5req s THR 251 CO 0.37 -0.89 1.68 0.00 -0.54 0.00 0.00 174.62 175.24 5req h ALA 252 N -0.49 0.72 0.00 3.99 0.00 -1.95 -1.32 119.26 120.21 5req h ALA 252 Ca -0.44 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 5req h ALA 252 Cb 1.22 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 5req h ALA 252 CO 0.63 -0.35 -0.26 0.38 0.00 0.00 0.00 179.25 179.64 5req h ASP 253 N 0.20 0.00 0.20 0.00 2.03 -1.93 -1.87 116.42 115.05 5req h ASP 253 Ca 0.34 0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 56.34 5req h ASP 253 Cb 0.55 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 39.08 5req h ASP 253 CO -0.48 0.26 -1.37 0.40 -1.03 0.00 0.00 179.24 177.02 5req h ILE 254 N 0.00 1.24 0.41 4.15 1.08 -1.76 -2.62 117.51 120.01 5req h ILE 254 Ca -0.00 -2.59 -0.01 0.00 -0.39 0.00 0.00 64.86 61.87 5req h ILE 254 Cb 0.51 3.00 -0.02 0.00 -3.07 0.00 0.00 36.82 37.24 5req h ILE 254 CO 0.03 0.79 -0.41 -0.08 -0.69 0.00 0.00 178.15 177.79 5req h GLU 255 N -0.03 -0.80 -0.12 2.37 4.81 -1.22 0.68 114.58 120.26 5req h GLU 255 Ca -0.25 0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 5req h GLU 255 Cb 1.99 0.18 -0.06 0.00 0.63 0.00 0.00 28.75 31.49 5req h GLU 255 CO 0.21 -0.53 -0.52 0.52 -0.73 0.00 0.00 179.01 177.95 5req h MET 256 N -0.83 -0.56 -0.71 1.92 2.86 -1.48 -2.14 114.93 113.99 5req h MET 256 Ca -0.04 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 5req h MET 256 Cb 0.74 0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 5req h MET 256 CO -0.07 -0.37 0.46 0.00 1.06 0.00 0.00 176.91 178.00 5req h ALA 257 N -0.22 0.91 -0.14 6.32 0.00 -1.22 -2.50 119.26 122.41 5req h ALA 257 Ca 0.04 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.69 5req h ALA 257 Cb 0.68 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.18 5req h ALA 257 CO -0.42 0.34 -0.72 1.88 0.00 0.00 0.00 179.25 180.33 5req h TYR 258 N 0.97 0.82 -0.21 0.00 0.05 -0.85 -1.66 116.97 116.10 5req h TYR 258 Ca 0.26 -0.35 -0.02 0.00 0.05 0.00 0.00 58.73 58.67 5req h TYR 258 Cb -0.09 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 5req h TYR 258 CO -0.02 1.14 0.06 1.15 -1.05 0.00 0.00 178.16 179.45 5req h THR 259 N 0.43 1.19 -0.31 -2.88 2.02 -1.38 0.15 112.91 112.14 5req h THR 259 Ca -0.03 -0.60 -0.13 0.00 0.77 0.00 0.00 66.41 66.42 5req h THR 259 Cb 1.31 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 5req h THR 259 CO 0.14 0.19 -0.34 -0.07 0.37 0.00 0.00 175.52 175.81 5req h LEU 260 N 0.16 0.71 -0.34 2.58 3.38 -1.48 -0.09 115.31 120.24 5req h LEU 260 Ca 0.07 -0.29 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 5req h LEU 260 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 5req h LEU 260 CO -0.00 0.99 -0.31 0.00 0.09 0.00 0.00 178.44 179.21 5req h ALA 261 N 1.05 0.49 -0.43 1.53 0.00 -1.28 -1.28 119.26 119.34 5req h ALA 261 Ca 0.06 -0.41 0.09 0.00 0.00 0.00 0.00 54.91 54.64 5req h ALA 261 Cb 0.85 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.45 5req h ALA 261 CO 0.07 0.53 -0.13 -0.44 0.00 0.00 0.00 179.25 179.28 5req h ASP 262 N 0.58 -0.48 -0.83 0.00 3.32 -0.39 -2.00 116.42 116.63 5req h ASP 262 Ca 0.06 0.14 0.15 0.00 0.02 0.00 0.00 57.03 57.39 5req h ASP 262 Cb 0.88 0.30 -0.09 0.00 0.22 0.00 0.00 39.33 40.63 5req h ASP 262 CO 0.08 -0.17 0.40 1.23 -1.72 0.00 0.00 179.24 179.06 5req h GLY 263 N -0.03 1.33 0.90 2.75 0.00 -0.63 -1.56 103.07 105.82 5req h GLY 263 Ca 0.21 -0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.33 5req h GLY 263 CO -0.46 -0.05 0.35 -2.08 0.00 0.00 0.00 176.54 174.30 5req h VAL 264 N 0.58 1.08 -0.71 4.60 2.07 -0.53 -1.47 116.25 121.87 5req h VAL 264 Ca 0.45 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.72 5req h VAL 264 Cb 0.65 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 5req h VAL 264 CO -0.37 0.13 0.38 0.44 0.02 0.00 0.00 177.57 178.17 5req h ASP 265 N 0.70 0.89 0.27 0.57 5.19 -0.90 -2.11 116.42 121.03 5req h ASP 265 Ca 0.23 -0.10 -0.05 0.00 -0.62 0.00 0.00 57.03 56.48 5req h ASP 265 Cb 0.00 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 5req h ASP 265 CO -0.09 0.74 -0.26 1.88 -3.12 0.00 0.00 179.24 178.39 5req h TYR 266 N 0.98 0.00 -0.28 4.55 0.05 -1.16 -0.43 116.97 120.69 5req h TYR 266 Ca 0.25 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.89 5req h TYR 266 Cb 0.05 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 5req h TYR 266 CO -0.00 0.26 -0.36 0.82 -1.05 0.00 0.00 178.16 177.83 5req h ILE 267 N 0.00 1.30 -0.41 -2.88 2.04 -0.81 -2.16 117.51 114.59 5req h ILE 267 Ca -0.00 -1.55 -0.00 0.00 1.00 0.00 0.00 64.86 64.31 5req h ILE 267 Cb 0.47 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 5req h ILE 267 CO 0.03 0.50 0.25 0.03 0.00 0.00 0.00 178.15 178.96 5req h ARG 268 N 0.49 0.55 -0.64 2.37 3.08 -1.23 -0.02 114.38 118.98 5req h ARG 268 Ca 0.03 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.13 5req h ARG 268 Cb 0.95 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.81 5req h ARG 268 CO 0.09 0.41 0.26 0.00 -1.07 0.00 0.00 179.97 179.65 5req h ALA 269 N 1.11 0.84 -0.44 0.04 0.00 -1.03 -0.15 119.26 119.63 5req h ALA 269 Ca 0.15 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 5req h ALA 269 Cb -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 5req h ALA 269 CO -0.03 -0.16 -0.13 0.78 0.00 0.00 0.00 179.25 179.71 5req h GLY 270 N 0.45 0.94 0.78 0.00 0.00 -1.10 -3.09 103.07 101.06 5req h GLY 270 Ca 0.32 -0.79 0.07 0.00 0.00 0.00 0.00 47.33 46.93 5req h GLY 270 CO -0.31 0.72 0.63 0.83 0.00 0.00 0.00 176.54 178.42 5req h GLU 271 N 0.70 1.09 0.00 4.80 5.08 -0.29 -2.90 114.58 123.05 5req h GLU 271 Ca 0.11 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 5req h GLU 271 Cb 0.68 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.68 5req h GLU 271 CO 0.05 0.72 0.00 -1.13 -1.00 0.00 0.00 179.01 177.65 5req n SER 272 N -4.50 0.27 -0.93 1.42 3.41 -0.13 -2.46 113.62 110.70 5req n SER 272 Ca 0.15 0.59 0.07 0.00 -0.26 0.00 0.00 58.87 59.42 5req n SER 272 Cb 0.19 -0.64 0.23 0.00 -0.26 0.00 0.00 64.21 63.73 5req n SER 272 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 5req n VAL 273 N -1.83 1.56 0.00 -3.33 0.24 -1.11 -4.98 118.33 108.89 5req n VAL 273 Ca 0.01 -1.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.01 5req n VAL 273 Cb 0.12 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.69 5req n VAL 273 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 5req n GLY 274 N 0.37 0.30 3.73 7.63 0.00 -1.03 -4.88 105.19 111.32 5req n GLY 274 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 5req n GLY 274 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 5req s LEU 275 N 0.00 4.52 0.67 0.99 1.43 -1.16 -5.02 118.68 120.12 5req s LEU 275 Ca 0.00 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.75 5req s LEU 275 Cb 0.00 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.67 5req s LEU 275 CO 0.00 -0.01 1.09 0.21 0.23 0.00 0.00 176.35 177.86 5req s ASN 276 N -0.24 5.19 0.31 2.29 3.84 -1.26 -4.01 114.94 121.07 5req s ASN 276 Ca 0.45 1.87 -0.01 0.00 0.21 0.00 0.00 52.86 55.38 5req s ASN 276 Cb -0.23 -2.53 0.50 0.00 -0.55 0.00 0.00 41.25 38.43 5req s ASN 276 CO 0.29 -1.57 1.98 1.62 -2.79 0.00 0.00 177.10 176.63 5req h VAL 277 N -0.19 1.19 0.00 -5.21 3.04 -1.95 -2.51 116.25 110.63 5req h VAL 277 Ca -0.46 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 64.87 5req h VAL 277 Cb 1.23 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 5req h VAL 277 CO 0.55 0.19 0.00 0.47 -1.01 0.00 0.00 177.57 177.77 5req n ASP 278 N -4.42 0.38 0.13 3.17 8.00 -1.26 -0.53 116.55 122.01 5req n ASP 278 Ca 0.09 0.61 0.13 0.00 0.71 0.00 0.00 54.79 56.33 5req n ASP 278 Cb 0.04 -0.69 0.28 0.00 -0.02 0.00 0.00 41.12 40.73 5req n ASP 278 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 5req h GLN 279 N 0.00 0.00 0.00 -1.24 4.20 -1.83 -3.42 115.11 112.83 5req h GLN 279 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 5req h GLN 279 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 5req h GLN 279 CO 0.00 0.00 0.00 1.97 -0.67 0.00 0.00 178.83 180.13 5req n PHE 280 N -2.49 0.00 -0.06 2.96 -1.74 -0.99 -4.67 117.46 110.48 5req n PHE 280 Ca 0.04 0.00 -0.05 0.00 -0.56 0.00 0.00 57.45 56.89 5req n PHE 280 Cb 0.47 0.00 0.16 0.00 1.52 0.00 0.00 39.48 41.63 5req n PHE 280 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 5req h ALA 281 N 0.00 1.06 0.00 1.98 0.00 -1.05 -2.58 119.26 118.67 5req h ALA 281 Ca 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 5req h ALA 281 Cb 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 5req h ALA 281 CO 0.00 0.57 -0.00 -1.35 0.00 0.00 0.00 179.25 178.47 5req h PRO 282 N 0.61 0.00 -0.52 0.00 0.11 -1.80 -1.73 132.00 128.68 5req h PRO 282 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 5req h PRO 282 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 5req h PRO 282 CO 0.04 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.37 5req n ARG 283 N -3.73 3.03 -2.73 1.05 5.12 -0.98 -4.93 116.66 113.48 5req n ARG 283 Ca -0.03 -2.49 -0.40 0.00 -1.93 0.00 0.00 57.85 52.99 5req n ARG 283 Cb 0.09 -1.55 -0.05 0.00 -1.16 0.00 0.00 32.46 29.78 5req n ARG 283 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 5req s LEU 284 N -1.36 4.59 0.16 0.55 1.43 -0.65 -1.97 118.68 121.43 5req s LEU 284 Ca 0.39 1.90 0.04 0.00 -1.03 0.00 0.00 54.13 55.43 5req s LEU 284 Cb 0.23 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.80 5req s LEU 284 CO 0.22 0.07 -0.08 -0.94 0.23 0.00 0.00 176.35 175.85 5req s SER 285 N -0.75 1.76 0.47 2.29 1.04 -0.47 -4.68 113.70 113.37 5req s SER 285 Ca 0.43 -1.06 0.03 0.00 0.48 0.00 0.00 55.95 55.83 5req s SER 285 Cb -0.25 0.00 -0.03 0.00 0.10 0.00 0.00 66.02 65.83 5req s SER 285 CO 0.31 -0.38 0.01 -0.36 0.98 0.00 0.00 173.24 173.80 5req s PHE 286 N -3.36 2.07 -0.26 5.02 0.40 -0.44 0.04 117.98 121.44 5req s PHE 286 Ca 0.19 -0.87 -0.07 0.00 -0.60 0.00 0.00 56.93 55.57 5req s PHE 286 Cb 0.03 -1.65 0.12 0.00 0.51 0.00 0.00 43.02 42.04 5req s PHE 286 CO 0.02 0.28 0.54 0.12 0.70 0.00 0.00 175.22 176.88 5req s PHE 287 N -2.84 -1.13 0.17 0.36 5.36 -0.60 -0.59 117.98 118.70 5req s PHE 287 Ca 0.16 1.85 0.07 0.00 -0.96 0.00 0.00 56.93 58.04 5req s PHE 287 Cb 0.04 0.53 -0.04 0.00 -0.34 0.00 0.00 43.02 43.22 5req s PHE 287 CO 0.08 -0.63 0.01 -1.58 -1.46 0.00 0.00 175.22 171.64 5req s TRP 288 N 2.76 2.88 0.17 10.12 0.52 -0.14 0.08 118.94 135.33 5req s TRP 288 Ca 0.00 -0.12 -0.14 0.00 0.02 0.00 0.00 56.10 55.87 5req s TRP 288 Cb -0.13 -1.40 -0.07 0.00 -1.15 0.00 0.00 33.47 30.72 5req s TRP 288 CO -0.17 0.51 0.56 0.20 0.02 0.00 0.00 176.95 178.08 5req s GLY 289 N -2.91 2.43 -0.31 0.98 0.00 -1.26 -1.39 107.32 104.85 5req s GLY 289 Ca 0.28 -0.14 0.01 0.00 0.00 0.00 0.00 44.72 44.87 5req s GLY 289 CO 0.19 0.11 0.05 -0.42 0.00 0.00 0.00 173.10 173.04 5req s ILE 290 N -1.55 1.53 0.00 0.90 -1.09 -0.39 -4.84 121.20 115.75 5req s ILE 290 Ca 0.40 -1.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.09 5req s ILE 290 Cb -0.14 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 38.65 5req s ILE 290 CO 0.20 -0.55 0.00 0.61 -1.23 0.00 0.00 174.94 173.96 5req n GLY 291 N 4.59 -0.33 0.16 6.18 0.00 -1.26 -0.21 105.19 114.31 5req n GLY 291 Ca -0.01 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.38 5req n GLY 291 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 5req h MET 292 N 0.00 0.00 -5.48 1.61 2.86 -1.96 -3.41 114.93 108.55 5req h MET 292 Ca 0.00 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.96 5req h MET 292 Cb 0.00 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 31.54 5req h MET 292 CO 0.00 0.00 1.68 1.21 1.06 0.00 0.00 176.91 180.86 5req s ASN 293 N -5.22 6.83 0.10 1.22 3.84 -1.26 -4.89 114.94 115.56 5req s ASN 293 Ca 0.08 -2.40 -0.19 0.00 0.21 0.00 0.00 52.86 50.56 5req s ASN 293 Cb 0.09 -2.51 -0.05 0.00 -0.55 0.00 0.00 41.25 38.24 5req s ASN 293 CO 0.60 -1.09 1.34 0.15 -2.79 0.00 0.00 177.10 175.31 5req h PHE 294 N 7.96 -1.16 -0.81 0.43 3.57 -1.93 -1.62 116.94 123.39 5req h PHE 294 Ca 0.34 0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.90 5req h PHE 294 Cb 0.91 0.58 -0.04 0.00 2.79 0.00 0.00 35.95 40.19 5req h PHE 294 CO 1.28 -0.24 0.47 0.74 -2.23 0.00 0.00 178.31 178.32 5req h PHE 295 N -0.04 1.07 -0.52 0.41 0.04 -1.97 -1.67 116.94 114.25 5req h PHE 295 Ca 0.09 -0.01 -0.10 0.00 2.80 0.00 0.00 57.97 60.75 5req h PHE 295 Cb 0.27 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.05 5req h PHE 295 CO -0.94 0.73 -0.06 1.98 -0.60 0.00 0.00 178.31 179.41 5req h MET 296 N 1.12 0.93 -0.24 1.51 4.05 -1.87 -2.41 114.93 118.02 5req h MET 296 Ca 0.29 -0.31 -0.04 0.00 -0.28 0.00 0.00 59.70 59.36 5req h MET 296 Cb -0.02 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.69 5req h MET 296 CO -0.05 0.96 -0.02 0.93 0.23 0.00 0.00 176.91 178.96 5req h GLU 297 N 0.85 0.44 -0.24 0.39 4.39 -1.07 0.11 114.58 119.45 5req h GLU 297 Ca 0.15 -0.15 0.03 0.00 0.34 0.00 0.00 59.36 59.73 5req h GLU 297 Cb 0.58 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 5req h GLU 297 CO 0.04 0.63 0.04 0.28 -1.16 0.00 0.00 179.01 178.84 5req h VAL 298 N 0.20 0.88 -0.79 3.13 2.07 -1.32 -2.14 116.25 118.27 5req h VAL 298 Ca 0.07 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.58 5req h VAL 298 Cb 0.44 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 5req h VAL 298 CO 0.02 0.02 0.50 0.00 0.02 0.00 0.00 177.57 178.13 5req h ALA 299 N 1.18 1.06 -0.26 1.67 0.00 -1.30 -3.04 119.26 118.57 5req h ALA 299 Ca 0.11 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.04 5req h ALA 299 Cb 0.11 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 5req h ALA 299 CO -0.15 0.28 0.01 -0.22 0.00 0.00 0.00 179.25 179.17 5req h LYS 300 N 0.94 0.09 -0.81 0.00 3.64 -0.12 0.33 116.57 120.65 5req h LYS 300 Ca 0.33 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 5req h LYS 300 Cb 0.07 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 5req h LYS 300 CO -0.13 0.06 0.42 -0.07 -2.27 0.00 0.00 179.45 177.46 5req h LEU 301 N 0.10 1.03 -0.14 5.20 4.07 -1.45 0.20 115.31 124.32 5req h LEU 301 Ca 0.12 -0.10 -0.05 0.00 0.08 0.00 0.00 57.88 57.94 5req h LEU 301 Cb 0.15 -0.26 -0.00 0.00 1.08 0.00 0.00 40.66 41.63 5req h LEU 301 CO -0.20 0.84 -0.10 0.03 -1.08 0.00 0.00 178.44 177.94 5req h ARG 302 N 1.14 0.31 -0.46 1.13 3.08 -1.39 -2.65 114.38 115.54 5req h ARG 302 Ca 0.28 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 60.10 5req h ARG 302 Cb 0.06 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 5req h ARG 302 CO -0.04 0.67 -0.05 0.00 -1.07 0.00 0.00 179.97 179.47 5req h ALA 303 N 0.63 0.62 -0.32 0.04 0.00 -0.75 -2.92 119.26 116.56 5req h ALA 303 Ca 0.03 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.69 5req h ALA 303 Cb 0.60 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 5req h ALA 303 CO 0.03 0.47 -0.05 0.00 0.00 0.00 0.00 179.25 179.70 5req h ALA 304 N 0.89 0.24 -0.58 0.00 0.00 -0.67 -1.51 119.26 117.64 5req h ALA 304 Ca 0.12 0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.26 5req h ALA 304 Cb 0.58 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 5req h ALA 304 CO 0.03 -0.44 0.06 0.00 0.00 0.00 0.00 179.25 178.90 5req h ARG 305 N 0.04 0.17 -0.53 0.00 3.08 -1.29 -1.09 114.38 114.77 5req h ARG 305 Ca 0.15 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 5req h ARG 305 Cb 0.23 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 5req h ARG 305 CO -0.30 0.12 -0.09 0.52 -1.07 0.00 0.00 179.97 179.14 5req h MET 306 N 0.18 0.98 -0.56 0.04 2.86 -1.28 -2.69 114.93 114.46 5req h MET 306 Ca 0.30 -0.35 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 5req h MET 306 Cb 0.47 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 5req h MET 306 CO -0.45 1.02 0.10 -0.07 1.06 0.00 0.00 176.91 178.57 5req h LEU 307 N 0.88 0.87 -0.35 1.22 3.38 -0.87 -1.95 115.31 118.49 5req h LEU 307 Ca 0.14 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.86 5req h LEU 307 Cb 0.64 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 5req h LEU 307 CO 0.04 0.91 0.23 -0.25 0.09 0.00 0.00 178.44 179.46 5req h TRP 308 N 0.81 0.44 -0.15 1.13 -0.00 -1.22 0.15 115.95 117.10 5req h TRP 308 Ca 0.17 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 59.09 5req h TRP 308 Cb 0.40 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.39 5req h TRP 308 CO 0.03 0.28 0.02 0.00 -0.00 0.00 0.00 178.44 178.77 5req h ALA 309 N 1.13 0.14 0.01 2.65 0.00 -1.40 0.20 119.26 122.00 5req h ALA 309 Ca 0.13 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.10 5req h ALA 309 Cb -0.05 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 5req h ALA 309 CO -0.03 -0.42 -0.21 -0.22 0.00 0.00 0.00 179.25 178.37 5req h LYS 310 N 0.08 -0.33 -0.15 0.00 3.64 -1.06 -0.17 116.57 118.57 5req h LYS 310 Ca 0.07 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 5req h LYS 310 Cb 0.07 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 5req h LYS 310 CO -0.10 -0.22 -0.05 -0.07 -2.27 0.00 0.00 179.45 176.74 5req h LEU 311 N -0.35 -0.17 -1.19 5.20 3.38 -0.38 -2.81 115.31 118.98 5req h LEU 311 Ca 0.06 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 5req h LEU 311 Cb 0.42 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 5req h LEU 311 CO -0.19 -0.07 -0.25 0.58 0.09 0.00 0.00 178.44 178.61 5req h VAL 312 N -0.02 1.24 -0.86 1.22 2.07 -0.56 -3.07 116.25 116.27 5req h VAL 312 Ca 0.08 -1.11 0.16 0.00 0.82 0.00 0.00 66.70 66.65 5req h VAL 312 Cb 0.13 1.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.25 5req h VAL 312 CO -0.17 0.34 0.56 -0.74 0.02 0.00 0.00 177.57 177.58 5req h HIS 313 N 0.23 0.67 -0.97 1.57 6.17 -0.75 -2.72 115.15 119.36 5req h HIS 313 Ca 0.04 0.02 0.22 0.00 0.71 0.00 0.00 60.37 61.36 5req h HIS 313 Cb 0.57 -0.21 -0.08 0.00 2.52 0.00 0.00 27.41 30.21 5req h HIS 313 CO 0.01 0.23 0.63 1.96 0.71 0.00 0.00 177.93 181.47 5req h GLN 314 N 0.55 0.45 0.00 5.26 4.20 -1.53 -2.30 115.11 121.75 5req h GLN 314 Ca 0.44 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.12 5req h GLN 314 Cb 0.87 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.55 5req h GLN 314 CO -0.18 0.30 0.00 1.19 -0.67 0.00 0.00 178.83 179.46 5req n PHE 315 N -4.58 0.00 -2.81 2.96 3.72 -1.02 -4.97 117.46 110.76 5req n PHE 315 Ca 0.22 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.51 5req n PHE 315 Cb 0.74 -0.20 0.05 0.00 -0.94 0.00 0.00 39.48 39.14 5req n PHE 315 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 5req n GLY 316 N 1.05 -0.43 3.77 1.37 0.00 -0.86 -4.90 105.19 105.19 5req n GLY 316 Ca 0.16 0.22 -0.39 0.00 0.00 0.00 0.00 46.02 46.01 5req n GLY 316 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 5req s PRO 317 N -4.25 3.98 -0.08 1.61 0.04 -1.26 -4.93 135.00 130.11 5req s PRO 317 Ca 0.23 2.08 0.19 0.00 0.04 0.00 0.00 61.00 63.54 5req s PRO 317 Cb -0.03 -2.73 -0.24 0.00 0.04 0.00 0.00 34.50 31.53 5req s PRO 317 CO 0.52 -0.46 0.41 1.63 0.04 0.00 0.00 177.00 179.14 5req n LYS 318 N 0.11 0.66 -3.37 4.56 4.76 -1.26 -4.84 118.16 118.78 5req n LYS 318 Ca 0.04 0.01 -0.39 0.00 -2.87 0.00 0.00 58.31 55.10 5req n LYS 318 Cb 0.44 -1.61 -0.08 0.00 -1.84 0.00 0.00 35.03 31.95 5req n LYS 318 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 5req s ASN 319 N -5.31 6.41 0.46 4.39 3.84 -1.26 -4.99 114.94 118.49 5req s ASN 319 Ca -0.07 0.49 0.17 0.00 0.21 0.00 0.00 52.86 53.65 5req s ASN 319 Cb 0.09 -2.24 1.10 0.00 -0.55 0.00 0.00 41.25 39.66 5req s ASN 319 CO 0.85 -0.12 2.02 1.55 -2.79 0.00 0.00 177.10 178.60 5req h PRO 320 N 7.57 0.00 0.00 0.43 0.13 -2.02 -2.35 132.00 135.76 5req h PRO 320 Ca -0.34 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.77 5req h PRO 320 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 5req h PRO 320 CO 0.71 0.16 -0.06 0.87 -0.23 0.00 0.00 178.00 179.45 5req h LYS 321 N 0.00 0.00 -0.83 0.86 1.57 -1.96 -2.81 116.57 113.40 5req h LYS 321 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 5req h LYS 321 Cb 0.31 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 5req h LYS 321 CO 0.02 0.06 0.47 0.77 -0.57 0.00 0.00 179.45 180.19 5req h SER 322 N 0.00 1.03 0.78 0.86 0.02 -1.70 -2.74 113.55 111.81 5req h SER 322 Ca -0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 5req h SER 322 Cb 0.16 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.44 5req h SER 322 CO 0.01 0.82 0.00 0.23 -1.14 0.00 0.00 176.83 176.74 5req n MET 323 N -4.35 0.18 -2.69 3.45 2.81 -1.06 -4.54 117.12 110.92 5req n MET 323 Ca 0.09 0.02 -0.42 0.00 -1.81 0.00 0.00 57.70 55.57 5req n MET 323 Cb 0.09 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.07 5req n MET 323 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 5req s SER 324 N -2.82 7.34 -0.44 7.83 1.04 -1.03 -3.48 113.70 122.15 5req s SER 324 Ca 0.19 1.68 -0.20 0.00 0.48 0.00 0.00 55.95 58.11 5req s SER 324 Cb 0.19 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.76 5req s SER 324 CO 0.48 -0.29 0.60 -0.22 0.98 0.00 0.00 173.24 174.79 5req s LEU 325 N 1.07 4.59 -0.30 2.42 0.20 -1.26 -4.99 118.68 120.41 5req s LEU 325 Ca 0.52 -0.43 -0.08 0.00 0.69 0.00 0.00 54.13 54.83 5req s LEU 325 Cb -0.22 -2.65 -0.00 0.00 -0.43 0.00 0.00 46.19 42.90 5req s LEU 325 CO 0.28 -0.74 0.12 -0.13 -0.29 0.00 0.00 176.35 175.59 5req s ARG 326 N 2.66 3.27 0.05 1.98 0.52 -1.26 -4.69 118.95 121.49 5req s ARG 326 Ca 0.20 -0.75 0.07 0.00 -0.52 0.00 0.00 55.73 54.73 5req s ARG 326 Cb -0.15 -3.48 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 5req s ARG 326 CO 0.18 -0.41 -0.20 -0.08 0.02 0.00 0.00 175.30 174.81 5req s THR 327 N 1.57 1.58 0.25 0.02 -1.32 -1.26 -1.33 115.64 115.15 5req s THR 327 Ca 0.04 -1.23 -0.03 0.00 -1.21 0.00 0.00 61.69 59.27 5req s THR 327 Cb -0.17 -1.39 -0.05 0.00 -1.51 0.00 0.00 72.50 69.38 5req s THR 327 CO 0.05 0.12 0.48 -2.28 -2.21 0.00 0.00 174.62 170.78 5req s HIS 328 N -0.88 3.48 0.03 9.09 2.46 0.24 -0.03 115.29 129.68 5req s HIS 328 Ca 0.06 0.49 0.01 0.00 0.47 0.00 0.00 55.06 56.10 5req s HIS 328 Cb -0.09 -1.98 -0.02 0.00 -0.13 0.00 0.00 32.58 30.36 5req s HIS 328 CO 0.02 0.26 -0.05 -1.12 -2.47 0.00 0.00 174.74 171.39 5req s SER 329 N -3.20 0.48 -0.02 9.88 0.01 -0.60 -0.97 113.70 119.28 5req s SER 329 Ca 0.41 -0.46 0.02 0.00 1.31 0.00 0.00 55.95 57.23 5req s SER 329 Cb -0.11 0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.19 5req s SER 329 CO 0.30 -0.22 -0.05 -1.58 0.41 0.00 0.00 173.24 172.10 5req s GLN 330 N -1.31 0.58 0.59 12.44 0.74 -0.49 -1.47 119.66 130.75 5req s GLN 330 Ca -0.11 -0.16 -0.19 0.00 0.05 0.00 0.00 55.36 54.95 5req s GLN 330 Cb -0.09 -0.59 -0.03 0.00 1.10 0.00 0.00 33.01 33.40 5req s GLN 330 CO -0.00 0.04 1.24 0.95 -0.55 0.00 0.00 175.29 176.97 5req s THR 331 N 0.28 2.44 -0.23 -0.34 -4.23 -0.99 -1.27 115.64 111.31 5req s THR 331 Ca -0.03 0.29 -0.29 0.00 -1.18 0.00 0.00 61.69 60.47 5req s THR 331 Cb -0.07 -3.12 -0.03 0.00 1.34 0.00 0.00 72.50 70.62 5req s THR 331 CO -0.00 -0.05 1.69 -0.55 -0.54 0.00 0.00 174.62 175.16 5req s SER 332 N -1.46 6.26 0.12 3.99 0.15 0.70 -4.71 113.70 118.75 5req s SER 332 Ca 0.77 1.61 -0.19 0.00 0.70 0.00 0.00 55.95 58.85 5req s SER 332 Cb -0.33 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.40 5req s SER 332 CO 0.36 -1.36 1.74 1.23 1.20 0.00 0.00 173.24 176.42 5req h GLY 333 N 12.13 0.37 0.10 9.45 0.00 -1.90 -2.93 103.07 120.30 5req h GLY 333 Ca -0.35 -0.16 0.20 0.00 0.00 0.00 0.00 47.33 47.02 5req h GLY 333 CO 1.00 0.15 0.61 -0.25 0.00 0.00 0.00 176.54 178.06 5req h TRP 334 N 0.31 1.04 0.00 5.60 7.01 -1.91 -2.64 115.95 125.36 5req h TRP 334 Ca 0.09 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.12 5req h TRP 334 Cb 0.03 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 26.78 5req h TRP 334 CO -0.04 0.21 -0.02 0.66 -2.79 0.00 0.00 178.44 176.46 5req h SER 335 N 0.72 0.00 -3.76 2.65 4.64 -1.92 -3.43 113.55 112.45 5req h SER 335 Ca 0.58 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.41 5req h SER 335 Cb 0.96 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.02 5req h SER 335 CO -0.38 0.02 0.25 -0.76 -0.87 0.00 0.00 176.83 175.09 5req s LEU 336 N -7.65 4.33 0.32 5.97 1.43 -1.00 -5.04 118.68 117.04 5req s LEU 336 Ca -0.05 1.66 0.08 0.00 -1.03 0.00 0.00 54.13 54.79 5req s LEU 336 Cb 0.15 -3.86 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 5req s LEU 336 CO 0.56 -0.04 0.22 0.42 0.23 0.00 0.00 176.35 177.74 5req s THR 337 N -1.60 3.53 -0.82 5.49 -4.23 -1.26 -4.73 115.64 112.02 5req s THR 337 Ca 0.48 -1.50 0.23 0.00 -1.18 0.00 0.00 61.69 59.72 5req s THR 337 Cb -0.17 -3.14 -0.10 0.00 1.34 0.00 0.00 72.50 70.42 5req s THR 337 CO 0.22 -0.22 1.12 0.00 -0.54 0.00 0.00 174.62 175.21 5req n ALA 338 N -1.25 3.76 -2.74 3.99 0.00 -1.26 -4.62 120.51 118.38 5req n ALA 338 Ca -0.03 -0.43 -0.35 0.00 0.00 0.00 0.00 53.44 52.62 5req n ALA 338 Cb 0.60 -0.97 -0.09 0.00 0.00 0.00 0.00 19.45 18.99 5req n ALA 338 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 5req s GLN 339 N -3.09 3.17 -0.71 0.00 1.11 -1.26 -4.67 119.66 114.21 5req s GLN 339 Ca 0.07 -0.36 -0.10 0.00 0.01 0.00 0.00 55.36 54.98 5req s GLN 339 Cb 0.16 -2.90 0.01 0.00 -1.01 0.00 0.00 33.01 29.28 5req s GLN 339 CO 0.79 0.66 0.63 -3.47 0.01 0.00 0.00 175.29 173.90 5req n ASP 340 N 2.30 -5.57 0.26 5.90 2.03 -1.26 -4.86 116.55 115.34 5req n ASP 340 Ca -0.19 -0.58 0.15 0.00 0.52 0.00 0.00 54.79 54.69 5req n ASP 340 Cb 0.54 -2.36 0.54 0.00 -0.72 0.00 0.00 41.12 39.11 5req n ASP 340 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 5req h VAL 341 N 0.49 0.11 0.00 5.18 -1.51 -1.83 -3.15 116.25 115.54 5req h VAL 341 Ca -0.50 -0.74 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 5req h VAL 341 Cb 1.33 1.66 0.00 0.00 -2.13 0.00 0.00 31.29 32.15 5req h VAL 341 CO 0.32 0.04 0.00 -1.22 -1.23 0.00 0.00 177.57 175.48 5req n TYR 342 N -3.14 0.00 0.19 5.19 4.02 -1.26 -2.14 117.16 120.01 5req n TYR 342 Ca 0.01 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.95 5req n TYR 342 Cb 0.38 -0.10 0.39 0.00 -0.02 0.00 0.00 39.34 39.99 5req n TYR 342 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 5req h ASN 343 N 0.00 0.00 -0.59 7.72 2.35 -1.91 -3.04 115.58 120.11 5req h ASN 343 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 5req h ASN 343 Cb 0.10 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 5req h ASN 343 CO 0.00 0.36 0.39 0.78 -1.65 0.00 0.00 177.43 177.31 5req h ASN 344 N 0.00 0.63 -0.44 5.81 2.35 -1.65 -1.19 115.58 121.10 5req h ASN 344 Ca -0.00 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.77 5req h ASN 344 Cb 0.71 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.89 5req h ASN 344 CO 0.05 0.44 0.21 0.58 -1.65 0.00 0.00 177.43 177.06 5req h VAL 345 N 0.74 0.95 -0.01 2.81 2.07 -1.70 0.19 116.25 121.29 5req h VAL 345 Ca 0.23 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 5req h VAL 345 Cb 0.01 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 5req h VAL 345 CO -0.06 0.08 0.01 0.58 0.02 0.00 0.00 177.57 178.20 5req h VAL 346 N 0.42 1.11 -0.30 2.57 2.07 -1.61 -2.08 116.25 118.43 5req h VAL 346 Ca 0.19 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.45 5req h VAL 346 Cb 0.11 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 5req h VAL 346 CO -0.14 0.08 0.03 0.03 0.02 0.00 0.00 177.57 177.59 5req h ARG 347 N -0.11 0.13 -0.30 1.57 3.08 -0.84 -2.01 114.38 115.89 5req h ARG 347 Ca 0.00 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 5req h ARG 347 Cb 0.13 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 5req h ARG 347 CO -0.00 0.08 -0.22 1.15 -1.07 0.00 0.00 179.97 179.92 5req h THR 348 N 0.13 1.26 -0.54 2.04 2.02 -0.68 -2.42 112.91 114.73 5req h THR 348 Ca 0.14 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 5req h THR 348 Cb 0.17 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 5req h THR 348 CO -0.22 0.40 0.28 0.00 0.37 0.00 0.00 175.52 176.36 5req h ILE 350 N 0.73 1.28 -0.55 0.00 1.08 -1.23 -2.21 117.51 116.61 5req h ILE 350 Ca 0.19 -1.39 -0.11 0.00 -0.39 0.00 0.00 64.86 63.17 5req h ILE 350 Cb 0.08 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 5req h ILE 350 CO -0.03 0.46 -0.07 -0.33 -0.69 0.00 0.00 178.15 177.49 5req h GLU 351 N 0.64 1.02 -0.85 2.37 5.08 -1.31 -2.17 114.58 119.36 5req h GLU 351 Ca 0.08 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 5req h GLU 351 Cb 0.78 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 5req h GLU 351 CO 0.06 1.05 0.48 0.00 -1.00 0.00 0.00 179.01 179.60 5req h ALA 352 N 0.94 1.24 -0.14 3.43 0.00 -1.07 -1.48 119.26 122.18 5req h ALA 352 Ca 0.15 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.96 5req h ALA 352 Cb 0.63 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 5req h ALA 352 CO 0.04 0.62 -0.01 0.52 0.00 0.00 0.00 179.25 180.43 5req h MET 353 N 1.18 0.04 -0.45 0.00 2.86 -1.15 -1.71 114.93 115.70 5req h MET 353 Ca 0.30 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.94 5req h MET 353 Cb 0.00 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 5req h MET 353 CO -0.05 0.03 0.28 0.00 1.06 0.00 0.00 176.91 178.22 5req h ALA 354 N 1.12 0.57 -0.06 6.32 0.00 -1.04 0.79 119.26 126.95 5req h ALA 354 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 5req h ALA 354 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 5req h ALA 354 CO -0.11 0.05 0.02 0.00 0.00 0.00 0.00 179.25 179.21 5req h ALA 355 N 1.14 0.06 0.00 0.00 0.00 -1.16 0.51 119.26 119.81 5req h ALA 355 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 5req h ALA 355 Cb -0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 5req h ALA 355 CO -0.03 -0.45 -0.53 1.79 0.00 0.00 0.00 179.25 180.03 5req h THR 356 N 0.06 1.20 0.00 0.00 1.35 -1.27 -1.34 112.91 112.91 5req h THR 356 Ca 0.02 -1.94 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 5req h THR 356 Cb 0.01 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 5req h THR 356 CO -0.02 0.52 -0.25 0.00 -0.25 0.00 0.00 175.52 175.52 5req n GLN 357 N -3.65 0.19 0.00 4.72 6.02 0.26 -1.51 117.38 123.41 5req n GLN 357 Ca -0.01 0.11 0.14 0.00 -0.01 0.00 0.00 57.00 57.23 5req n GLN 357 Cb 0.59 -1.68 0.53 0.00 1.02 0.00 0.00 30.24 30.71 5req n GLN 357 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 5req n GLY 358 N 1.38 -0.70 2.42 1.08 0.00 0.16 -4.71 105.19 104.81 5req n GLY 358 Ca 0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 5req n GLY 358 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 5req n HIS 359 N -0.70 -1.30 -1.90 1.61 8.25 -0.57 -4.52 115.22 116.09 5req n HIS 359 Ca 0.15 0.51 -0.34 0.00 -0.26 0.00 0.00 57.72 57.78 5req n HIS 359 Cb 0.30 -3.59 0.04 0.00 1.12 0.00 0.00 29.99 27.86 5req n HIS 359 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 5req s THR 360 N -3.21 3.13 -0.13 1.59 -1.32 -0.58 -4.88 115.64 110.24 5req s THR 360 Ca 0.11 0.59 0.18 0.00 -1.21 0.00 0.00 61.69 61.36 5req s THR 360 Cb -0.01 -3.14 -0.14 0.00 -1.51 0.00 0.00 72.50 67.70 5req s THR 360 CO 0.41 -0.27 0.78 0.00 -2.21 0.00 0.00 174.62 173.33 5req n GLN 361 N -2.06 0.63 -3.72 7.08 3.00 0.96 -4.66 117.38 118.60 5req n GLN 361 Ca 0.11 0.18 -0.10 0.00 -0.01 0.00 0.00 57.00 57.17 5req n GLN 361 Cb 0.51 -1.78 -0.06 0.00 0.00 0.00 0.00 30.24 28.92 5req n GLN 361 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 5req s SER 362 N -5.66 -0.12 -0.09 1.08 1.04 -1.00 -1.40 113.70 107.55 5req s SER 362 Ca -0.03 -0.35 -0.09 0.00 0.48 0.00 0.00 55.95 55.95 5req s SER 362 Cb 0.09 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.64 5req s SER 362 CO 0.82 -0.75 0.26 -0.22 0.98 0.00 0.00 173.24 174.33 5req s LEU 363 N -2.58 1.01 -0.07 2.42 2.96 -0.62 -1.56 118.68 120.24 5req s LEU 363 Ca 0.01 0.50 0.01 0.00 -0.22 0.00 0.00 54.13 54.44 5req s LEU 363 Cb 0.02 0.90 -0.03 0.00 0.50 0.00 0.00 46.19 47.58 5req s LEU 363 CO -0.09 -0.10 -0.09 -2.28 -1.32 0.00 0.00 176.35 172.47 5req s HIS 364 N 0.08 2.89 -0.18 5.38 5.65 -0.54 -1.64 115.29 126.92 5req s HIS 364 Ca -0.01 -0.06 0.01 0.00 0.25 0.00 0.00 55.06 55.25 5req s HIS 364 Cb -0.02 -1.71 0.02 0.00 -1.18 0.00 0.00 32.58 29.69 5req s HIS 364 CO 0.00 0.26 -0.20 0.95 -0.65 0.00 0.00 174.74 175.11 5req s THR 365 N -0.68 2.05 1.04 0.89 -4.23 -1.26 -2.36 115.64 111.08 5req s THR 365 Ca 0.10 -0.94 -0.12 0.00 -1.18 0.00 0.00 61.69 59.55 5req s THR 365 Cb -0.11 -1.85 0.21 0.00 1.34 0.00 0.00 72.50 72.09 5req s THR 365 CO 0.01 0.53 1.07 0.20 -0.54 0.00 0.00 174.62 175.90 5req s ASN 366 N 1.29 2.15 0.24 3.99 0.01 -1.26 -4.78 114.94 116.58 5req s ASN 366 Ca 0.05 1.51 0.07 0.00 -0.71 0.00 0.00 52.86 53.79 5req s ASN 366 Cb -0.13 -2.20 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 5req s ASN 366 CO -0.13 -3.47 0.12 -0.44 -1.51 0.00 0.00 177.10 171.67 5req s SER 367 N -2.96 5.20 0.58 -1.22 0.01 -1.26 -4.55 113.70 109.50 5req s SER 367 Ca 0.66 -0.35 0.28 0.00 1.31 0.00 0.00 55.95 57.85 5req s SER 367 Cb -0.22 -1.23 1.59 0.00 0.21 0.00 0.00 66.02 66.37 5req s SER 367 CO 0.60 -0.00 2.05 0.17 0.41 0.00 0.00 173.24 176.47 5req h LEU 368 N 1.80 0.00 -2.97 2.44 8.10 -1.88 -2.31 115.31 120.49 5req h LEU 368 Ca -0.47 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.44 5req h LEU 368 Cb 1.23 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 41.41 5req h LEU 368 CO 0.61 0.00 0.10 -0.90 -4.11 0.00 0.00 178.44 174.13 5req n ASP 369 N -3.85 4.24 -0.30 0.17 5.68 -1.26 -4.69 116.55 116.54 5req n ASP 369 Ca 0.04 -2.77 0.19 0.00 -0.50 0.00 0.00 54.79 51.74 5req n ASP 369 Cb 0.42 -0.66 0.46 0.00 -1.14 0.00 0.00 41.12 40.20 5req n ASP 369 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 5req h GLU 370 N 2.44 0.49 -0.01 0.11 4.57 -1.58 -0.63 114.58 119.97 5req h GLU 370 Ca 0.09 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 5req h GLU 370 Cb 1.73 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 30.21 5req h GLU 370 CO 0.45 0.32 -0.19 0.00 -1.18 0.00 0.00 179.01 178.41 5req n ALA 371 N -2.45 2.95 -0.06 2.92 0.00 -1.26 -4.37 120.51 118.24 5req n ALA 371 Ca 0.23 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 53.11 5req n ALA 371 Cb 0.73 -1.13 -0.05 0.00 0.00 0.00 0.00 19.45 19.00 5req n ALA 371 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 5req n ILE 372 N -0.38 0.70 -3.78 0.00 5.41 -0.67 -4.77 119.36 115.86 5req n ILE 372 Ca 0.14 -0.19 -0.02 0.00 1.00 0.00 0.00 62.75 63.67 5req n ILE 372 Cb 0.36 -1.52 0.00 0.00 -0.71 0.00 0.00 39.64 37.77 5req n ILE 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 5req s ALA 373 N -2.23 -1.80 0.59 -1.39 0.00 -0.33 -4.50 121.76 112.09 5req s ALA 373 Ca -0.17 0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.68 5req s ALA 373 Cb 0.06 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 5req s ALA 373 CO 0.23 -1.06 1.24 1.28 0.00 0.00 0.00 175.76 177.46 5req n LEU 374 N -0.57 5.24 -4.77 0.00 4.77 -1.26 -4.19 117.00 116.22 5req n LEU 374 Ca -0.05 0.89 -0.40 0.00 -0.03 0.00 0.00 56.01 56.42 5req n LEU 374 Cb 0.61 -1.52 0.02 0.00 -2.33 0.00 0.00 43.42 40.19 5req n LEU 374 CO 0.16 -1.02 1.08 -2.84 -1.33 0.00 0.00 177.39 173.44 5req s PRO 375 N -3.00 3.68 0.47 3.23 0.01 -1.26 -3.97 135.00 134.16 5req s PRO 375 Ca 0.76 2.45 -0.05 0.00 0.01 0.00 0.00 61.00 64.17 5req s PRO 375 Cb -0.41 -2.66 0.10 0.00 0.01 0.00 0.00 34.50 31.54 5req s PRO 375 CO 0.46 -0.83 0.65 0.25 0.01 0.00 0.00 177.00 177.53 5req n THR 376 N -0.20 0.00 -0.04 0.99 -2.24 -1.26 -4.83 114.28 106.70 5req n THR 376 Ca 0.05 -0.69 -0.16 0.00 -2.27 0.00 0.00 64.05 60.98 5req n THR 376 Cb 0.42 -1.45 -0.07 0.00 -2.10 0.00 0.00 70.33 67.13 5req n THR 376 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 5req h ASP 377 N -0.67 0.83 0.04 3.42 3.32 -1.98 -1.05 116.42 120.33 5req h ASP 377 Ca -0.21 -0.60 -0.00 0.00 0.02 0.00 0.00 57.03 56.24 5req h ASP 377 Cb 0.66 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.96 5req h ASP 377 CO 0.18 1.29 -0.02 0.15 -1.72 0.00 0.00 179.24 179.12 5req h PHE 378 N 0.42 -0.04 -0.68 4.55 3.57 -2.00 -2.30 116.94 120.47 5req h PHE 378 Ca -0.03 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 5req h PHE 378 Cb 1.23 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.95 5req h PHE 378 CO 0.09 0.19 0.36 0.66 -2.23 0.00 0.00 178.31 177.38 5req h SER 379 N -0.27 0.85 0.14 0.41 4.64 -1.94 -2.89 113.55 114.49 5req h SER 379 Ca -0.00 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.16 5req h SER 379 Cb 0.25 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 5req h SER 379 CO 0.01 0.71 -0.20 0.00 -0.87 0.00 0.00 176.83 176.48 5req h ALA 380 N 1.18 1.54 -0.11 5.18 0.00 -1.20 -2.78 119.26 123.06 5req h ALA 380 Ca 0.24 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 5req h ALA 380 Cb 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 5req h ALA 380 CO -0.04 0.34 -0.64 -0.09 0.00 0.00 0.00 179.25 178.82 5req h ARG 381 N 0.11 0.42 -0.08 0.00 2.43 -1.21 -1.08 114.38 114.96 5req h ARG 381 Ca 0.02 -0.30 -0.01 0.00 -0.81 0.00 0.00 59.98 58.88 5req h ARG 381 Cb 0.42 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 5req h ARG 381 CO 0.03 0.92 0.01 0.82 -1.51 0.00 0.00 179.97 180.24 5req h ILE 382 N 0.30 1.21 -0.74 1.20 2.04 -1.45 0.15 117.51 120.23 5req h ILE 382 Ca -0.01 -0.65 0.12 0.00 1.00 0.00 0.00 64.86 65.32 5req h ILE 382 Cb 1.18 1.49 -0.08 0.00 -0.74 0.00 0.00 36.82 38.67 5req h ILE 382 CO 0.11 0.18 0.34 0.00 0.00 0.00 0.00 178.15 178.78 5req h ALA 383 N 0.78 1.04 -0.01 1.87 0.00 -1.49 -0.45 119.26 121.00 5req h ALA 383 Ca 0.02 0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 5req h ALA 383 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 5req h ALA 383 CO 0.00 -0.11 -0.83 -0.09 0.00 0.00 0.00 179.25 178.22 5req h ARG 384 N 0.54 0.23 0.00 0.00 2.43 -1.04 -3.25 114.38 113.29 5req h ARG 384 Ca 0.39 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 5req h ARG 384 Cb 0.49 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 5req h ARG 384 CO -0.33 0.93 -0.38 -0.91 -1.51 0.00 0.00 179.97 177.78 5req h ASN 385 N 0.14 0.00 -0.11 -3.80 -0.26 -0.56 -2.08 115.58 108.90 5req h ASN 385 Ca -0.04 0.00 0.04 0.00 -0.56 0.00 0.00 56.30 55.74 5req h ASN 385 Cb 1.44 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.65 5req h ASN 385 CO 0.13 0.38 -0.17 0.74 -1.06 0.00 0.00 177.43 177.45 5req h THR 386 N 0.00 0.56 -0.30 2.81 2.02 -1.12 -0.11 112.91 116.78 5req h THR 386 Ca -0.00 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 5req h THR 386 Cb 0.80 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 5req h THR 386 CO 0.05 0.00 -0.37 1.56 0.37 0.00 0.00 175.52 177.13 5req h GLN 387 N -0.22 0.69 -0.52 6.66 4.20 -1.62 -2.33 115.11 121.98 5req h GLN 387 Ca 0.09 -0.34 -0.10 0.00 0.06 0.00 0.00 58.65 58.36 5req h GLN 387 Cb 0.35 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 5req h GLN 387 CO -0.24 0.95 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.73 5req h LEU 388 N 0.58 0.96 -0.43 1.46 3.38 -1.05 -1.37 115.31 118.84 5req h LEU 388 Ca 0.05 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.72 5req h LEU 388 Cb 0.89 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 5req h LEU 388 CO 0.08 1.07 0.22 0.15 0.09 0.00 0.00 178.44 180.04 5req h PHE 389 N 0.83 0.40 -0.68 1.13 3.57 -1.07 0.77 116.94 121.89 5req h PHE 389 Ca 0.14 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.58 5req h PHE 389 Cb 0.62 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 5req h PHE 389 CO 0.04 0.21 0.12 -0.07 -2.23 0.00 0.00 178.31 176.38 5req h LEU 390 N 0.43 1.07 -0.44 0.59 3.38 -1.21 0.41 115.31 119.54 5req h LEU 390 Ca 0.18 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 5req h LEU 390 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 5req h LEU 390 CO -0.12 1.05 0.13 1.56 0.09 0.00 0.00 178.44 181.15 5req h GLN 391 N 1.04 0.69 0.11 1.13 4.20 -0.99 -3.30 115.11 117.99 5req h GLN 391 Ca 0.21 -0.15 -0.37 0.00 0.06 0.00 0.00 58.65 58.40 5req h GLN 391 Cb 0.43 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 5req h GLN 391 CO 0.01 0.67 -2.06 1.04 -0.67 0.00 0.00 178.83 177.83 5req n GLN 392 N -4.55 0.75 -0.03 1.46 6.02 0.24 -4.70 117.38 116.57 5req n GLN 392 Ca 0.00 0.25 0.01 0.00 -0.01 0.00 0.00 57.00 57.26 5req n GLN 392 Cb 0.19 -1.69 -0.09 0.00 1.02 0.00 0.00 30.24 29.67 5req n GLN 392 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 5req n GLU 393 N -3.46 1.13 -0.02 -1.09 1.02 0.10 -4.77 120.64 113.56 5req n GLU 393 Ca -0.34 -0.07 -0.03 0.00 -0.02 0.00 0.00 57.16 56.71 5req n GLU 393 Cb 1.04 -1.28 0.22 0.00 -0.02 0.00 0.00 31.44 31.40 5req n GLU 393 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 5req h SER 394 N 0.00 0.55 0.00 1.62 4.64 -1.57 -3.47 113.55 115.32 5req h SER 394 Ca -0.13 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 5req h SER 394 Cb 1.02 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 5req h SER 394 CO 0.01 0.70 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 5req n GLY 395 N -0.61 0.55 0.46 -0.77 0.00 -1.26 -4.94 105.19 98.62 5req n GLY 395 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.13 5req n GLY 395 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 5req n THR 396 N -2.91 0.17 0.00 2.61 -2.24 -1.26 -3.72 114.28 106.94 5req n THR 396 Ca 0.00 -0.29 0.07 0.00 -2.27 0.00 0.00 64.05 61.56 5req n THR 396 Cb 0.00 0.26 -0.13 0.00 -2.10 0.00 0.00 70.33 68.36 5req n THR 396 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 5req n THR 397 N 0.13 0.46 0.19 4.28 -2.24 -1.26 -4.57 114.28 111.27 5req n THR 397 Ca 0.16 -0.59 0.06 0.00 -2.27 0.00 0.00 64.05 61.41 5req n THR 397 Cb 0.28 -0.22 0.55 0.00 -2.10 0.00 0.00 70.33 68.85 5req n THR 397 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 5req h ARG 398 N 0.00 0.14 -5.99 -0.78 0.11 -1.85 -2.66 114.38 103.35 5req h ARG 398 Ca -0.10 -0.01 -0.68 0.00 0.10 0.00 0.00 59.98 59.28 5req h ARG 398 Cb 1.26 -0.03 -0.25 0.00 1.11 0.00 0.00 29.97 32.06 5req h ARG 398 CO 0.01 0.14 -0.78 0.08 0.10 0.00 0.00 179.97 179.52 5req s VAL 399 N -5.06 2.98 -0.37 0.08 1.01 -1.26 -4.59 120.40 113.19 5req s VAL 399 Ca -0.06 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 5req s VAL 399 Cb 0.17 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.37 5req s VAL 399 CO 0.69 0.57 1.31 -0.63 0.00 0.00 0.00 175.10 177.04 5req s ILE 400 N -0.35 4.08 -0.59 2.22 1.01 -1.26 -3.96 121.20 122.35 5req s ILE 400 Ca 0.03 1.17 -0.12 0.00 0.00 0.00 0.00 60.65 61.73 5req s ILE 400 Cb -0.12 -4.25 0.02 0.00 0.01 0.00 0.00 42.46 38.11 5req s ILE 400 CO 0.02 -0.66 0.64 -0.67 0.00 0.00 0.00 174.94 174.28 5req n ASP 401 N 8.06 -7.24 -0.34 3.58 2.03 -1.26 -4.87 116.55 116.51 5req n ASP 401 Ca 0.15 0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.52 5req n ASP 401 Cb 0.47 -4.47 0.14 0.00 -0.72 0.00 0.00 41.12 36.54 5req n ASP 401 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 5req h PRO 402 N 1.21 1.09 0.00 -0.67 0.13 -1.84 -1.44 132.00 130.47 5req h PRO 402 Ca -0.15 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 5req h PRO 402 Cb 1.10 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 31.98 5req h PRO 402 CO 0.26 0.72 0.00 -1.49 -0.23 0.00 0.00 178.00 177.26 5req h TRP 403 N 1.12 0.00 -0.81 1.56 4.06 -1.90 -3.46 115.95 116.51 5req h TRP 403 Ca 0.38 0.00 -0.71 0.00 2.06 0.00 0.00 58.89 60.62 5req h TRP 403 Cb 0.07 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 5req h TRP 403 CO -0.02 0.00 0.54 0.45 -3.56 0.00 0.00 178.44 175.86 5req n SER 404 N -2.41 0.95 0.00 -3.49 2.88 -0.54 -0.39 113.62 110.62 5req n SER 404 Ca 0.01 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 5req n SER 404 Cb 0.22 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 5req n SER 404 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 5req n GLY 405 N 3.19 2.93 3.57 0.46 0.00 -1.26 -5.02 105.19 109.06 5req n GLY 405 Ca 0.25 -0.37 -0.58 0.00 0.00 0.00 0.00 46.02 45.32 5req n GLY 405 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 5req n SER 406 N 0.56 0.75 -0.04 1.61 2.88 0.48 -4.83 113.62 115.02 5req n SER 406 Ca 0.00 1.15 -0.11 0.00 -1.33 0.00 0.00 58.87 58.58 5req n SER 406 Cb 0.00 -1.00 -0.05 0.00 -0.75 0.00 0.00 64.21 62.41 5req n SER 406 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 5req h ALA 407 N 3.97 0.19 -0.04 -1.46 0.00 -1.89 0.45 119.26 120.47 5req h ALA 407 Ca -0.49 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.34 5req h ALA 407 Cb 1.39 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 5req h ALA 407 CO 0.75 -0.21 -0.15 -0.92 0.00 0.00 0.00 179.25 178.72 5req h TYR 408 N 0.07 -0.39 -0.51 0.00 3.20 -1.89 -1.30 116.97 116.15 5req h TYR 408 Ca 0.05 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 5req h TYR 408 Cb 0.19 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 5req h TYR 408 CO -0.01 -0.22 0.12 0.28 -1.64 0.00 0.00 178.16 176.69 5req h VAL 409 N -0.23 1.24 -0.66 1.81 2.07 -1.87 -1.81 116.25 116.79 5req h VAL 409 Ca 0.06 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 5req h VAL 409 Cb 0.32 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 5req h VAL 409 CO -0.18 0.31 0.35 -0.33 0.02 0.00 0.00 177.57 177.74 5req h GLU 410 N 0.70 0.94 -0.46 1.57 4.39 -0.98 -1.42 114.58 119.31 5req h GLU 410 Ca 0.16 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 5req h GLU 410 Cb 0.34 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 5req h GLU 410 CO 0.00 0.72 0.26 1.49 -1.16 0.00 0.00 179.01 180.33 5req h GLU 411 N 0.91 0.64 -0.63 2.33 4.57 -0.79 -1.94 114.58 119.67 5req h GLU 411 Ca 0.23 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 5req h GLU 411 Cb 0.07 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 5req h GLU 411 CO -0.03 0.49 0.24 -0.07 -1.18 0.00 0.00 179.01 178.46 5req h LEU 412 N 0.61 0.85 -0.03 1.64 3.38 -1.22 0.07 115.31 120.60 5req h LEU 412 Ca 0.16 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.03 5req h LEU 412 Cb 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 5req h LEU 412 CO -0.03 0.76 -0.04 0.74 0.09 0.00 0.00 178.44 179.97 5req h THR 413 N 0.91 0.88 -0.29 0.22 2.02 -1.14 0.99 112.91 116.50 5req h THR 413 Ca 0.21 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.39 5req h THR 413 Cb 0.19 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 5req h THR 413 CO -0.02 0.00 0.18 -0.25 0.37 0.00 0.00 175.52 175.80 5req h TRP 414 N -0.06 0.38 -0.18 3.16 -0.00 -1.04 -0.53 115.95 117.68 5req h TRP 414 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 5req h TRP 414 Cb 0.10 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.16 29.13 5req h TRP 414 CO -0.13 0.27 0.08 -0.44 -0.00 0.00 0.00 178.44 178.22 5req h ASP 415 N 0.37 0.24 -0.41 2.65 3.32 -0.81 -1.98 116.42 119.80 5req h ASP 415 Ca 0.10 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.91 5req h ASP 415 Cb -0.00 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 5req h ASP 415 CO -0.02 0.31 -0.17 -0.07 -1.72 0.00 0.00 179.24 177.57 5req h LEU 416 N 0.15 0.86 -0.16 1.55 3.38 -0.84 -1.93 115.31 118.31 5req h LEU 416 Ca 0.06 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.67 5req h LEU 416 Cb 0.14 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 5req h LEU 416 CO -0.01 1.06 -0.03 0.00 0.09 0.00 0.00 178.44 179.55 5req h ALA 417 N 0.83 0.11 -0.21 1.53 0.00 -1.04 0.59 119.26 121.06 5req h ALA 417 Ca 0.10 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 5req h ALA 417 Cb 0.72 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 5req h ALA 417 CO 0.05 -0.48 0.02 0.00 0.00 0.00 0.00 179.25 178.84 5req h ARG 418 N 0.01 0.36 -0.64 0.00 3.08 -1.37 -1.76 114.38 114.06 5req h ARG 418 Ca 0.08 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 5req h ARG 418 Cb 0.11 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 5req h ARG 418 CO -0.16 0.53 0.38 0.87 -1.07 0.00 0.00 179.97 180.52 5req h LYS 419 N 0.13 0.87 -0.10 0.04 1.57 -1.18 -1.68 116.57 116.22 5req h LYS 419 Ca 0.06 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.60 5req h LYS 419 Cb 0.36 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 5req h LYS 419 CO 0.01 0.62 -0.63 0.00 -0.57 0.00 0.00 179.45 178.88 5req h ALA 420 N 1.19 0.72 -0.62 3.86 0.00 -0.96 -3.04 119.26 120.42 5req h ALA 420 Ca 0.23 -0.56 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 5req h ALA 420 Cb -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 5req h ALA 420 CO -0.04 0.73 0.18 2.35 0.00 0.00 0.00 179.25 182.47 5req h TRP 421 N 0.27 1.01 -0.57 0.00 2.91 -0.99 -2.22 115.95 116.36 5req h TRP 421 Ca -0.01 -0.11 0.01 0.00 1.13 0.00 0.00 58.89 59.91 5req h TRP 421 Cb 1.17 -0.29 -0.03 0.00 -0.51 0.00 0.00 29.16 29.50 5req h TRP 421 CO 0.04 0.83 0.37 0.78 -1.03 0.00 0.00 178.44 179.43 5req h GLY 422 N 0.89 0.80 1.26 2.65 0.00 -1.33 -1.63 103.07 105.70 5req h GLY 422 Ca 0.20 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 5req h GLY 422 CO -0.00 0.27 0.25 0.45 0.00 0.00 0.00 176.54 177.51 5req h HIS 423 N 0.74 0.96 -0.39 5.60 3.86 -1.41 -2.75 115.15 121.77 5req h HIS 423 Ca 0.22 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.32 5req h HIS 423 Cb -0.05 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.11 5req h HIS 423 CO -0.04 0.74 0.08 0.82 0.86 0.00 0.00 177.93 180.39 5req h ILE 424 N 0.93 1.23 -0.38 2.45 2.04 -1.00 -1.70 117.51 121.08 5req h ILE 424 Ca 0.22 -0.81 0.06 0.00 1.00 0.00 0.00 64.86 65.32 5req h ILE 424 Cb 0.19 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 5req h ILE 424 CO -0.02 0.28 0.08 1.56 0.00 0.00 0.00 178.15 180.06 5req h GLN 425 N 0.48 0.21 0.02 2.37 4.20 -1.25 -0.81 115.11 120.33 5req h GLN 425 Ca 0.12 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 5req h GLN 425 Cb 0.33 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.07 5req h GLN 425 CO 0.00 0.14 -0.01 0.93 -0.67 0.00 0.00 178.83 179.22 5req h GLU 426 N 0.21 -0.03 -0.59 1.46 5.08 -1.45 -2.55 114.58 116.72 5req h GLU 426 Ca 0.18 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.63 5req h GLU 426 Cb 0.21 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.39 5req h GLU 426 CO -0.23 0.11 0.22 0.28 -1.00 0.00 0.00 179.01 178.38 5req h VAL 427 N -0.15 0.78 0.00 3.13 2.07 -1.13 -2.23 116.25 118.72 5req h VAL 427 Ca -0.00 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 5req h VAL 427 Cb 0.14 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 5req h VAL 427 CO 0.00 0.07 -0.30 -0.08 0.02 0.00 0.00 177.57 177.28 5req h GLU 428 N 0.40 0.00 -0.08 1.57 4.81 -1.13 -0.87 114.58 119.27 5req h GLU 428 Ca 0.29 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.40 5req h GLU 428 Cb 0.35 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 5req h GLU 428 CO -0.29 0.30 -0.48 0.87 -0.73 0.00 0.00 179.01 178.68 5req h LYS 429 N 0.00 0.21 -0.45 1.92 6.56 -0.97 -3.21 116.57 120.63 5req h LYS 429 Ca -0.00 -0.11 0.00 0.00 -1.06 0.00 0.00 60.65 59.47 5req h LYS 429 Cb 0.55 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 5req h LYS 429 CO 0.04 0.65 0.00 1.55 -2.06 0.00 0.00 179.45 179.63 5req n VAL 430 N -3.97 0.60 0.00 0.50 3.14 -1.05 -4.92 118.33 112.62 5req n VAL 430 Ca -0.02 -0.61 0.00 0.00 -2.96 0.00 0.00 64.34 60.76 5req n VAL 430 Cb 0.53 0.32 0.00 0.00 -1.06 0.00 0.00 33.84 33.63 5req n VAL 430 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 5req n GLY 431 N 1.23 0.52 0.00 7.55 0.00 -1.21 -4.68 105.19 108.60 5req n GLY 431 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 5req n GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5req n GLY 432 N -1.34 -1.56 0.16 -0.02 0.00 -0.35 -4.68 105.19 97.41 5req n GLY 432 Ca 0.00 -2.23 -0.03 0.00 0.00 0.00 0.00 46.02 43.75 5req n GLY 432 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 5req h MET 433 N 4.81 0.15 -0.39 1.61 2.86 -1.83 -1.40 114.93 120.75 5req h MET 433 Ca 0.00 -0.10 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 5req h MET 433 Cb 0.00 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 5req h MET 433 CO 0.00 0.70 -0.08 0.00 1.06 0.00 0.00 176.91 178.60 5req h ALA 434 N 1.27 0.54 -0.59 6.32 0.00 -1.95 0.24 119.26 125.09 5req h ALA 434 Ca -0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 5req h ALA 434 Cb 1.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 5req h ALA 434 CO 0.09 0.39 -0.03 0.87 0.00 0.00 0.00 179.25 180.56 5req h LYS 435 N 0.55 1.06 -0.38 0.00 1.57 -1.83 -2.26 116.57 115.28 5req h LYS 435 Ca 0.10 -0.35 -0.13 0.00 -1.87 0.00 0.00 60.65 58.40 5req h LYS 435 Cb 0.59 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 5req h LYS 435 CO 0.04 1.05 -0.29 0.00 -0.57 0.00 0.00 179.45 179.68 5req h ALA 436 N 0.97 0.77 -0.38 3.86 0.00 -1.10 -2.99 119.26 120.39 5req h ALA 436 Ca 0.16 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 5req h ALA 436 Cb 0.59 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 5req h ALA 436 CO 0.04 0.65 -0.18 0.82 0.00 0.00 0.00 179.25 180.57 5req h ILE 437 N 0.69 1.26 -0.18 0.00 2.04 -0.50 -3.15 117.51 117.67 5req h ILE 437 Ca 0.08 -1.25 -0.06 0.00 1.00 0.00 0.00 64.86 64.62 5req h ILE 437 Cb 0.83 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 5req h ILE 437 CO 0.07 0.42 -0.16 1.05 0.00 0.00 0.00 178.15 179.53 5req h GLU 438 N 0.64 0.30 -0.27 2.37 -0.00 -1.26 -1.95 114.58 114.40 5req h GLU 438 Ca 0.10 -0.08 -0.01 0.00 -0.00 0.00 0.00 59.36 59.36 5req h GLU 438 Cb 0.66 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 29.36 5req h GLU 438 CO 0.05 0.47 0.11 0.87 -0.00 0.00 0.00 179.01 180.51 5req h LYS 439 N 0.28 0.37 0.00 1.06 1.57 -1.52 -3.47 116.57 114.86 5req h LYS 439 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 5req h LYS 439 Cb 0.46 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.70 5req h LYS 439 CO 0.03 0.31 0.00 0.41 -0.57 0.00 0.00 179.45 179.62 5req n GLY 440 N -1.31 0.73 0.32 3.86 0.00 -0.74 -5.01 105.19 103.04 5req n GLY 440 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 5req n GLY 440 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 5req h ILE 441 N 0.00 0.42 -0.51 -0.61 1.08 -1.82 -2.51 117.51 113.55 5req h ILE 441 Ca 0.00 -0.13 0.09 0.00 -0.39 0.00 0.00 64.86 64.43 5req h ILE 441 Cb 0.00 0.47 -0.10 0.00 -3.07 0.00 0.00 36.82 34.12 5req h ILE 441 CO 0.00 0.02 -0.34 -0.65 -0.69 0.00 0.00 178.15 176.49 5req h PRO 442 N -0.85 -0.20 -0.70 2.37 0.11 -1.91 0.28 132.00 131.11 5req h PRO 442 Ca -0.08 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.06 5req h PRO 442 Cb 0.62 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.73 5req h PRO 442 CO 0.13 -0.13 0.45 -0.22 -0.21 0.00 0.00 178.00 178.02 5req h LYS 443 N -0.20 0.89 -0.60 1.05 3.64 -1.79 -2.15 116.57 117.39 5req h LYS 443 Ca 0.20 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.43 5req h LYS 443 Cb 0.55 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 5req h LYS 443 CO -0.63 0.59 -0.01 0.52 -2.27 0.00 0.00 179.45 177.65 5req h MET 444 N 0.92 1.07 -0.32 1.90 2.86 -0.68 0.59 114.93 121.26 5req h MET 444 Ca 0.26 -0.35 0.05 0.00 -2.06 0.00 0.00 59.70 57.60 5req h MET 444 Cb -0.07 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.46 5req h MET 444 CO -0.07 1.05 0.06 -0.09 1.06 0.00 0.00 176.91 178.92 5req h ARG 445 N 0.97 0.17 -0.69 1.72 9.65 -0.38 0.11 114.38 125.94 5req h ARG 445 Ca 0.17 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 59.01 5req h ARG 445 Cb 0.58 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.09 5req h ARG 445 CO 0.03 0.11 0.33 0.82 2.80 0.00 0.00 179.97 184.06 5req h ILE 446 N 0.18 1.23 -0.37 1.20 2.04 -1.22 -2.92 117.51 117.65 5req h ILE 446 Ca 0.15 -0.66 -0.09 0.00 1.00 0.00 0.00 64.86 65.27 5req h ILE 446 Cb 0.17 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 5req h ILE 446 CO -0.20 0.27 -0.13 -0.33 0.00 0.00 0.00 178.15 177.76 5req h GLU 447 N 0.96 0.66 -0.14 2.37 5.08 -0.27 -1.99 114.58 121.25 5req h GLU 447 Ca 0.24 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 5req h GLU 447 Cb 0.13 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 5req h GLU 447 CO -0.03 0.76 -0.04 0.93 -1.00 0.00 0.00 179.01 179.63 5req h GLU 448 N 0.60 -0.01 -0.93 2.33 5.08 -0.64 -0.51 114.58 120.50 5req h GLU 448 Ca 0.10 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 5req h GLU 448 Cb 0.56 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 5req h GLU 448 CO 0.04 -0.01 0.59 0.00 -1.00 0.00 0.00 179.01 178.63 5req h ALA 449 N 1.13 1.26 -0.63 3.43 0.00 -1.42 0.03 119.26 123.05 5req h ALA 449 Ca 0.07 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 5req h ALA 449 Cb 0.12 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 5req h ALA 449 CO -0.15 0.39 0.14 0.00 0.00 0.00 0.00 179.25 179.62 5req h ALA 450 N 1.41 1.05 -0.18 0.00 0.00 -1.01 -0.92 119.26 119.61 5req h ALA 450 Ca 0.39 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 5req h ALA 450 Cb 0.12 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 5req h ALA 450 CO -0.16 0.62 -0.11 0.00 0.00 0.00 0.00 179.25 179.61 5req h ALA 451 N 1.19 0.26 -0.30 0.00 0.00 -0.52 -2.01 119.26 117.88 5req h ALA 451 Ca 0.20 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.88 5req h ALA 451 Cb 0.36 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 5req h ALA 451 CO 0.00 0.10 -0.09 0.00 0.00 0.00 0.00 179.25 179.26 5req h ARG 452 N 0.07 -0.02 -0.52 0.00 3.08 -0.91 -1.67 114.38 114.41 5req h ARG 452 Ca 0.04 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.11 5req h ARG 452 Cb 0.60 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 5req h ARG 452 CO 0.03 -0.01 0.32 1.15 -1.07 0.00 0.00 179.97 180.39 5req h THR 453 N -0.02 1.09 -0.47 2.04 2.02 -1.20 -2.28 112.91 114.08 5req h THR 453 Ca 0.15 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 67.12 5req h THR 453 Cb 0.25 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 5req h THR 453 CO -0.33 0.12 0.29 -0.61 0.37 0.00 0.00 175.52 175.36 5req h GLN 454 N 0.65 0.56 -0.19 6.66 5.75 -0.76 -1.72 115.11 126.07 5req h GLN 454 Ca 0.20 -0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.71 5req h GLN 454 Cb -0.02 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.36 5req h GLN 454 CO -0.07 0.37 -0.10 0.00 -2.65 0.00 0.00 178.83 176.38 5req h ALA 455 N 1.20 0.06 -0.50 3.38 0.00 -1.12 0.32 119.26 122.60 5req h ALA 455 Ca 0.18 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.24 5req h ALA 455 Cb -0.01 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 5req h ALA 455 CO -0.07 -0.53 0.18 0.00 0.00 0.00 0.00 179.25 178.83 5req h ARG 456 N -0.08 0.34 -0.16 0.00 3.08 -1.22 -1.08 114.38 115.26 5req h ARG 456 Ca 0.11 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.98 5req h ARG 456 Cb 0.24 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.22 5req h ARG 456 CO -0.24 0.22 -0.52 0.82 -1.07 0.00 0.00 179.97 179.18 5req h ILE 457 N 0.35 1.33 -0.52 2.04 2.04 -0.97 -0.81 117.51 120.98 5req h ILE 457 Ca 0.24 -1.78 -0.03 0.00 1.00 0.00 0.00 64.86 64.30 5req h ILE 457 Cb 0.26 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 5req h ILE 457 CO -0.25 0.55 0.22 0.44 0.00 0.00 0.00 178.15 179.11 5req h ASP 458 N 0.30 0.71 0.68 1.72 3.32 -0.23 -2.88 116.42 120.04 5req h ASP 458 Ca -0.02 -0.16 -0.10 0.00 0.02 0.00 0.00 57.03 56.77 5req h ASP 458 Cb 1.15 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 5req h ASP 458 CO 0.11 0.67 -0.50 0.77 -1.72 0.00 0.00 179.24 178.57 5req h SER 459 N 0.70 0.00 0.00 6.45 4.64 -1.31 -3.48 113.55 120.55 5req h SER 459 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 5req h SER 459 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 5req h SER 459 CO -0.02 0.50 0.00 0.61 -0.87 0.00 0.00 176.83 177.05 5req n GLY 460 N 0.16 0.62 0.06 -0.77 0.00 -0.84 -5.00 105.19 99.42 5req n GLY 460 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 5req n GLY 460 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 5req h ARG 461 N 3.61 -0.04 -5.20 1.61 3.08 -1.47 -3.36 114.38 112.62 5req h ARG 461 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 5req h ARG 461 Cb 0.00 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 29.90 5req h ARG 461 CO 0.00 0.14 -0.04 -1.14 -1.07 0.00 0.00 179.97 177.86 5req s GLN 462 N -5.50 3.40 0.53 0.04 0.74 -0.71 -5.00 119.66 113.15 5req s GLN 462 Ca -0.14 -0.36 -0.22 0.00 0.05 0.00 0.00 55.36 54.69 5req s GLN 462 Cb 0.04 -3.89 -0.05 0.00 1.10 0.00 0.00 33.01 30.21 5req s GLN 462 CO 0.66 -0.79 1.31 -2.14 -0.55 0.00 0.00 175.29 173.78 5req s PRO 463 N 2.45 3.28 -0.36 1.67 0.02 -1.26 -4.25 135.00 136.55 5req s PRO 463 Ca 0.18 2.12 0.02 0.00 0.02 0.00 0.00 61.00 63.34 5req s PRO 463 Cb -0.15 -2.29 0.15 0.00 0.02 0.00 0.00 34.50 32.23 5req s PRO 463 CO 0.15 -1.04 0.33 -1.17 -0.33 0.00 0.00 177.00 174.94 5req s LEU 464 N -3.42 0.16 0.02 -5.54 2.96 -1.26 -5.05 118.68 106.55 5req s LEU 464 Ca 0.70 -1.66 -0.34 0.00 -0.22 0.00 0.00 54.13 52.60 5req s LEU 464 Cb -0.37 0.34 -0.13 0.00 0.50 0.00 0.00 46.19 46.52 5req s LEU 464 CO 0.44 -0.28 1.72 -0.38 -1.32 0.00 0.00 176.35 176.53 5req n ILE 465 N 4.28 0.29 -0.07 6.68 2.08 -1.26 -1.50 119.36 129.85 5req n ILE 465 Ca 0.10 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.36 5req n ILE 465 Cb 0.43 -1.65 0.00 0.00 -0.75 0.00 0.00 39.64 37.67 5req n ILE 465 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 5req n GLY 466 N 3.88 1.05 0.63 7.39 0.00 0.42 -4.87 105.19 113.70 5req n GLY 466 Ca 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 5req n GLY 466 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 5req n VAL 467 N -2.00 0.70 0.45 1.61 0.31 -0.57 -4.53 118.33 114.30 5req n VAL 467 Ca 0.00 0.25 0.07 0.00 -0.01 0.00 0.00 64.34 64.66 5req n VAL 467 Cb 0.00 -1.56 0.09 0.00 -0.91 0.00 0.00 33.84 31.46 5req n VAL 467 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 5req n ASN 468 N -3.22 2.39 -3.69 4.52 0.23 -0.98 -4.79 115.26 109.72 5req n ASN 468 Ca -0.03 -1.67 -0.11 0.00 -0.53 0.00 0.00 54.58 52.24 5req n ASN 468 Cb 0.11 -0.06 -0.09 0.00 -2.08 0.00 0.00 39.78 37.66 5req n ASN 468 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 5req s LYS 469 N -1.17 0.53 -1.24 -3.83 2.20 -1.25 -4.93 119.74 110.06 5req s LYS 469 Ca 0.19 0.83 -0.12 0.00 -0.36 0.00 0.00 55.97 56.51 5req s LYS 469 Cb 0.13 0.14 -0.00 0.00 -1.51 0.00 0.00 37.83 36.58 5req s LYS 469 CO 0.18 -0.12 0.66 0.66 -0.36 0.00 0.00 175.35 176.38 5req n TYR 470 N 3.66 -1.82 -1.92 4.03 4.01 -1.26 -0.44 117.16 123.43 5req n TYR 470 Ca -0.19 0.58 -0.34 0.00 -0.16 0.00 0.00 57.90 57.80 5req n TYR 470 Cb 0.56 -3.63 0.03 0.00 -0.31 0.00 0.00 39.34 36.00 5req n TYR 470 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 5req s ARG 471 N -6.17 2.95 0.44 -0.72 0.52 -1.26 -4.05 118.95 110.65 5req s ARG 471 Ca 0.27 1.52 -0.05 0.00 -0.52 0.00 0.00 55.73 56.95 5req s ARG 471 Cb -0.10 -1.96 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 5req s ARG 471 CO 0.87 -1.16 0.74 -0.51 0.02 0.00 0.00 175.30 175.25 5req s LEU 472 N -4.48 3.74 0.00 2.53 1.43 -1.26 -5.02 118.68 115.61 5req s LEU 472 Ca 0.70 0.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.68 5req s LEU 472 Cb -0.23 -3.80 0.00 0.00 0.03 0.00 0.00 46.19 42.19 5req s LEU 472 CO 0.36 -0.49 0.81 -1.84 0.23 0.00 0.00 176.35 175.43 5req n GLU 473 N -1.96 0.00 -5.14 1.70 0.28 -1.26 -4.73 120.64 109.54 5req n GLU 473 Ca -0.00 0.35 -0.32 0.00 -0.16 0.00 0.00 57.16 57.03 5req n GLU 473 Cb 0.55 -1.32 -0.16 0.00 1.43 0.00 0.00 31.44 31.94 5req n GLU 473 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 5req s HIS 474 N -2.31 2.54 -0.00 -1.84 3.76 -1.26 -5.10 115.29 111.07 5req s HIS 474 Ca 0.00 -0.62 -0.30 0.00 -0.15 0.00 0.00 55.06 53.99 5req s HIS 474 Cb 0.00 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 32.01 5req s HIS 474 CO 0.00 -0.15 1.08 -1.21 -0.85 0.00 0.00 174.74 173.60 5req s GLU 475 N -0.18 4.48 0.75 1.40 0.41 -1.26 -5.01 118.70 119.28 5req s GLU 475 Ca -0.02 1.55 -0.14 0.00 -0.41 0.00 0.00 54.97 55.95 5req s GLU 475 Cb -0.14 -3.45 0.05 0.00 -1.78 0.00 0.00 34.13 28.81 5req s GLU 475 CO 0.03 -0.20 1.19 -1.25 -0.49 0.00 0.00 175.26 174.54 5req s PRO 476 N 1.32 2.06 0.39 0.39 0.04 -1.26 -4.97 135.00 132.97 5req s PRO 476 Ca 0.54 1.67 -0.27 0.00 0.04 0.00 0.00 61.00 62.98 5req s PRO 476 Cb -0.24 -1.83 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 5req s PRO 476 CO 0.26 -1.88 1.39 -1.25 0.04 0.00 0.00 177.00 175.57 5req s PRO 477 N -4.06 4.03 -0.13 0.56 0.04 -1.26 -5.03 135.00 129.15 5req s PRO 477 Ca 0.72 2.37 -0.01 0.00 0.04 0.00 0.00 61.00 64.12 5req s PRO 477 Cb -0.27 -2.87 0.04 0.00 0.04 0.00 0.00 34.50 31.43 5req s PRO 477 CO 0.47 -0.52 -0.03 -1.17 0.04 0.00 0.00 177.00 175.80 5req s LEU 478 N -2.25 1.14 0.02 -3.56 2.96 -1.26 -5.11 118.68 110.62 5req s LEU 478 Ca 0.55 -0.43 -0.30 0.00 -0.22 0.00 0.00 54.13 53.72 5req s LEU 478 Cb -0.43 -0.71 -0.06 0.00 0.50 0.00 0.00 46.19 45.49 5req s LEU 478 CO 0.56 -0.19 1.47 -1.81 -1.32 0.00 0.00 176.35 175.06 5req s ASP 479 N 1.79 6.78 0.17 3.68 1.01 -1.26 -5.01 116.67 123.83 5req s ASP 479 Ca 0.03 2.21 0.08 0.00 0.71 0.00 0.00 52.55 55.59 5req s ASP 479 Cb -0.14 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 5req s ASP 479 CO -0.07 -0.76 -0.18 0.68 0.21 0.00 0.00 175.17 175.05 5req s VAL 480 N 2.43 1.82 0.06 -1.27 -7.23 -1.26 -4.95 120.40 110.00 5req s VAL 480 Ca 0.66 -1.95 -0.31 0.00 -1.81 0.00 0.00 61.98 58.58 5req s VAL 480 Cb -0.34 -1.87 -0.07 0.00 0.56 0.00 0.00 36.38 34.67 5req s VAL 480 CO 0.28 -0.34 1.44 -0.22 -0.31 0.00 0.00 175.10 175.95 5req s LEU 481 N -2.73 4.35 -0.16 1.32 2.96 -1.25 -5.00 118.68 118.17 5req s LEU 481 Ca 0.16 2.27 0.02 0.00 -0.22 0.00 0.00 54.13 56.36 5req s LEU 481 Cb -0.05 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 43.08 5req s LEU 481 CO 0.07 -0.72 -0.21 -0.75 -1.32 0.00 0.00 176.35 173.42 5req s LYS 482 N 1.88 3.01 0.01 1.98 2.20 -1.26 -4.55 119.74 123.01 5req s LYS 482 Ca 0.66 -0.84 -0.20 0.00 -0.36 0.00 0.00 55.97 55.23 5req s LYS 482 Cb -0.35 -2.51 -0.06 0.00 -1.51 0.00 0.00 37.83 33.40 5req s LYS 482 CO 0.29 -0.11 0.60 0.08 -0.36 0.00 0.00 175.35 175.84 5req s VAL 483 N 1.06 4.88 -0.63 4.02 1.01 -1.26 -5.03 120.40 124.45 5req s VAL 483 Ca -0.01 1.25 -0.20 0.00 0.00 0.00 0.00 61.98 63.02 5req s VAL 483 Cb -0.14 -3.93 0.10 0.00 0.00 0.00 0.00 36.38 32.40 5req s VAL 483 CO -0.07 0.43 0.80 -0.62 0.00 0.00 0.00 175.10 175.64 5req s ASP 484 N -0.31 6.21 0.26 3.32 -1.08 -1.26 -4.95 116.67 118.86 5req s ASP 484 Ca 0.31 -1.37 -0.05 0.00 -0.52 0.00 0.00 52.55 50.92 5req s ASP 484 Cb -0.18 -2.34 0.29 0.00 -1.46 0.00 0.00 42.92 39.23 5req s ASP 484 CO 0.18 -1.20 1.93 -1.13 0.52 0.00 0.00 175.17 175.46 5req h ASN 485 N 9.25 1.13 0.16 -0.34 -0.73 -1.95 -3.00 115.58 120.10 5req h ASN 485 Ca -0.26 -0.02 -0.04 0.00 1.87 0.00 0.00 56.30 57.85 5req h ASN 485 Cb 1.08 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 39.39 5req h ASN 485 CO 1.12 0.81 -0.17 0.77 -0.37 0.00 0.00 177.43 179.58 5req h SER 486 N 1.33 0.03 0.78 1.15 4.64 -1.93 -2.47 113.55 117.08 5req h SER 486 Ca 0.37 -0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.45 5req h SER 486 Cb -0.11 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 61.93 5req h SER 486 CO -0.09 0.20 -1.31 0.00 -0.87 0.00 0.00 176.83 174.76 5req h THR 487 N 0.03 1.20 0.31 2.95 1.03 -1.96 -2.85 112.91 113.60 5req h THR 487 Ca 0.00 -2.94 -0.02 0.00 -0.01 0.00 0.00 66.41 63.45 5req h THR 487 Cb 0.32 2.58 0.00 0.00 -1.07 0.00 0.00 68.15 69.98 5req h THR 487 CO 0.02 0.68 -0.15 0.58 -0.01 0.00 0.00 175.52 176.65 5req h VAL 488 N 0.00 0.71 -0.28 0.00 2.07 -1.42 -1.32 116.25 116.01 5req h VAL 488 Ca -0.14 -0.52 0.05 0.00 0.82 0.00 0.00 66.70 66.91 5req h VAL 488 Cb 1.84 0.98 -0.08 0.00 -1.52 0.00 0.00 31.29 32.51 5req h VAL 488 CO 0.10 0.10 -0.46 0.25 0.02 0.00 0.00 177.57 177.58 5req h LEU 489 N -0.70 -1.48 -0.27 2.57 5.85 -1.58 0.08 115.31 119.78 5req h LEU 489 Ca -0.04 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.93 5req h LEU 489 Cb 0.48 0.62 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 5req h LEU 489 CO 0.07 -0.41 -0.01 0.00 -0.34 0.00 0.00 178.44 177.75 5req h ALA 490 N 0.18 0.23 -0.21 1.25 0.00 -1.51 -0.38 119.26 118.82 5req h ALA 490 Ca 0.10 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.11 5req h ALA 490 Cb 0.61 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 5req h ALA 490 CO -0.50 -0.43 0.09 0.93 0.00 0.00 0.00 179.25 179.34 5req h GLU 491 N 0.06 0.19 -0.58 0.00 5.08 -0.84 -0.96 114.58 117.53 5req h GLU 491 Ca 0.13 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 5req h GLU 491 Cb 0.18 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 5req h GLU 491 CO -0.23 0.12 0.13 1.96 -1.00 0.00 0.00 179.01 180.00 5req h GLN 492 N 0.19 0.94 -0.29 2.33 1.08 -0.76 -1.92 115.11 116.68 5req h GLN 492 Ca 0.09 -0.23 0.05 0.00 -1.45 0.00 0.00 58.65 57.11 5req h GLN 492 Cb 0.04 -0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 27.30 5req h GLN 492 CO -0.08 0.87 -0.04 0.87 -0.95 0.00 0.00 178.83 179.51 5req h LYS 493 N 0.84 0.04 -0.71 1.46 1.57 -0.96 -2.06 116.57 116.76 5req h LYS 493 Ca 0.18 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 5req h LYS 493 Cb 0.36 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 5req h LYS 493 CO 0.00 0.02 0.42 0.00 -0.57 0.00 0.00 179.45 179.33 5req h ALA 494 N 1.27 0.94 -0.77 3.86 0.00 -0.96 -2.68 119.26 120.92 5req h ALA 494 Ca 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 5req h ALA 494 Cb 0.20 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 5req h ALA 494 CO -0.27 0.15 0.39 0.87 0.00 0.00 0.00 179.25 180.39 5req h LYS 495 N 0.80 1.09 0.00 0.00 1.57 -0.87 -2.73 116.57 116.43 5req h LYS 495 Ca 0.30 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 5req h LYS 495 Cb 0.12 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 5req h LYS 495 CO -0.15 0.83 -0.58 -0.07 -0.57 0.00 0.00 179.45 178.91 5req h LEU 496 N 1.09 0.00 -0.08 2.94 3.38 -1.18 -0.09 115.31 121.37 5req h LEU 496 Ca 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 5req h LEU 496 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 5req h LEU 496 CO -0.04 0.58 -0.05 0.58 0.09 0.00 0.00 178.44 179.61 5req h VAL 497 N 0.00 1.33 0.01 1.22 2.07 -1.43 -2.06 116.25 117.39 5req h VAL 497 Ca -0.01 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.44 5req h VAL 497 Cb 1.04 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 5req h VAL 497 CO 0.08 0.31 -0.09 0.50 0.02 0.00 0.00 177.57 178.38 5req h LYS 498 N -0.20 -0.16 -0.51 1.57 3.64 -1.41 -2.09 116.57 117.41 5req h LYS 498 Ca 0.02 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 5req h LYS 498 Cb 0.51 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.28 5req h LYS 498 CO 0.01 -0.11 0.02 1.25 -2.27 0.00 0.00 179.45 178.36 5req h LEU 499 N -0.16 -0.18 -0.75 5.20 5.85 -1.01 -0.22 115.31 124.04 5req h LEU 499 Ca 0.03 0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 5req h LEU 499 Cb 0.21 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 5req h LEU 499 CO -0.09 -0.06 -0.26 0.03 -0.34 0.00 0.00 178.44 177.72 5req h ARG 500 N 0.14 0.66 -0.37 1.25 3.08 -1.24 -0.81 114.38 117.09 5req h ARG 500 Ca 0.26 -0.27 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 5req h ARG 500 Cb 0.38 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 5req h ARG 500 CO -0.41 0.86 -0.13 0.00 -1.07 0.00 0.00 179.97 179.22 5req h ALA 501 N 1.14 0.51 0.00 0.04 0.00 -1.19 -3.26 119.26 116.50 5req h ALA 501 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.66 5req h ALA 501 Cb 0.75 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.41 5req h ALA 501 CO 0.06 0.41 -0.13 1.05 0.00 0.00 0.00 179.25 180.64 5req h GLU 502 N 0.53 0.00 -7.44 0.00 9.09 -0.98 -3.47 114.58 112.32 5req h GLU 502 Ca 0.09 0.00 -0.46 0.00 0.05 0.00 0.00 59.36 59.04 5req h GLU 502 Cb 0.66 0.00 0.12 0.00 -1.65 0.00 0.00 28.75 27.87 5req h GLU 502 CO 0.04 0.00 0.26 -0.98 0.05 0.00 0.00 179.01 178.38 5req s ARG 503 N -3.20 1.31 -0.33 1.06 1.70 -0.32 -5.06 118.95 114.10 5req s ARG 503 Ca 0.07 -0.70 -0.09 0.00 -0.47 0.00 0.00 55.73 54.54 5req s ARG 503 Cb 0.07 -2.10 0.01 0.00 -0.57 0.00 0.00 34.95 32.36 5req s ARG 503 CO 0.67 -1.83 0.16 0.34 -1.08 0.00 0.00 175.30 173.55 5req s ASP 504 N -4.77 5.53 0.28 -2.89 -1.08 -1.26 -4.98 116.67 107.49 5req s ASP 504 Ca 0.69 -0.77 -0.03 0.00 -0.52 0.00 0.00 52.55 51.92 5req s ASP 504 Cb -0.05 -1.98 0.38 0.00 -1.46 0.00 0.00 42.92 39.81 5req s ASP 504 CO 0.48 -0.27 1.94 -0.65 0.52 0.00 0.00 175.17 177.18 5req h PRO 505 N 8.35 1.18 0.00 4.34 0.11 -1.95 -2.36 132.00 141.67 5req h PRO 505 Ca -0.29 -0.07 -0.18 0.00 0.11 0.00 0.00 66.00 65.57 5req h PRO 505 Cb 1.12 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 31.94 5req h PRO 505 CO 0.63 0.78 -0.93 0.93 -0.21 0.00 0.00 178.00 179.20 5req h GLU 506 N 1.21 0.00 -0.26 1.05 3.07 -1.99 -2.75 114.58 114.91 5req h GLU 506 Ca 0.36 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 59.10 5req h GLU 506 Cb -0.06 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.84 5req h GLU 506 CO -0.09 0.70 -0.29 0.87 -1.40 0.00 0.00 179.01 178.80 5req h LYS 507 N 0.00 0.66 0.30 2.33 1.57 -1.93 -2.49 116.57 117.01 5req h LYS 507 Ca -0.05 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 5req h LYS 507 Cb 1.64 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.94 5req h LYS 507 CO 0.09 0.97 -0.31 0.28 -0.57 0.00 0.00 179.45 179.91 5req h VAL 508 N 0.38 0.35 -0.63 0.50 2.07 -1.51 -2.04 116.25 115.37 5req h VAL 508 Ca 0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 5req h VAL 508 Cb 0.86 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 5req h VAL 508 CO 0.07 0.00 0.30 0.50 0.02 0.00 0.00 177.57 178.46 5req h LYS 509 N -0.64 0.53 -0.30 1.57 3.64 -1.52 0.14 116.57 119.98 5req h LYS 509 Ca -0.01 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 5req h LYS 509 Cb 0.59 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 5req h LYS 509 CO -0.07 0.35 0.15 0.00 -2.27 0.00 0.00 179.45 177.62 5req h ALA 510 N 1.38 0.39 -0.58 5.00 0.00 -1.41 -0.66 119.26 123.38 5req h ALA 510 Ca 0.30 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.13 5req h ALA 510 Cb 0.28 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 5req h ALA 510 CO -0.24 -0.06 0.37 0.00 0.00 0.00 0.00 179.25 179.32 5req h ALA 511 N 1.02 0.74 -0.43 0.00 0.00 -0.90 0.25 119.26 119.93 5req h ALA 511 Ca 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 5req h ALA 511 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 5req h ALA 511 CO -0.01 0.19 0.20 -0.07 0.00 0.00 0.00 179.25 179.55 5req h LEU 512 N 0.78 0.57 -1.03 0.00 3.38 -0.94 -2.46 115.31 115.60 5req h LEU 512 Ca 0.21 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 5req h LEU 512 Cb -0.06 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 5req h LEU 512 CO -0.04 0.55 -0.11 0.44 0.09 0.00 0.00 178.44 179.36 5req h ASP 513 N 0.55 0.55 -0.99 -0.43 3.32 -0.83 -2.26 116.42 116.33 5req h ASP 513 Ca 0.15 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.06 5req h ASP 513 Cb 0.14 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.49 5req h ASP 513 CO -0.02 0.69 0.64 0.50 -1.72 0.00 0.00 179.24 179.34 5req h LYS 514 N 0.52 1.31 0.21 3.56 3.64 -0.34 0.59 116.57 126.05 5req h LYS 514 Ca 0.10 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 5req h LYS 514 Cb 0.50 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 5req h LYS 514 CO 0.03 0.88 -0.10 0.82 -2.27 0.00 0.00 179.45 178.81 5req h ILE 515 N 1.35 0.81 -0.58 2.00 2.04 -1.10 -1.44 117.51 120.59 5req h ILE 515 Ca 0.36 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 66.22 5req h ILE 515 Cb -0.13 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 5req h ILE 515 CO -0.08 0.01 0.33 0.74 0.00 0.00 0.00 178.15 179.15 5req h THR 516 N -0.30 1.01 0.03 -0.27 2.02 -1.07 0.14 112.91 114.47 5req h THR 516 Ca -0.03 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 66.96 5req h THR 516 Cb 0.23 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 66.91 5req h THR 516 CO 0.05 0.12 -0.33 -0.25 0.37 0.00 0.00 175.52 175.47 5req h TRP 517 N 0.63 -0.91 -0.72 3.16 7.01 -0.80 -1.73 115.95 122.60 5req h TRP 517 Ca 0.25 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 5req h TRP 517 Cb 0.10 0.40 -0.03 0.00 -2.10 0.00 0.00 29.16 27.52 5req h TRP 517 CO -0.08 -0.43 0.41 0.00 -2.79 0.00 0.00 178.44 175.56 5req h ALA 518 N 0.18 1.37 -0.27 2.65 0.00 -0.90 0.75 119.26 123.05 5req h ALA 518 Ca 0.05 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.90 5req h ALA 518 Cb 0.58 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 5req h ALA 518 CO -0.25 0.53 0.08 0.00 0.00 0.00 0.00 179.25 179.60 5req h ALA 519 N 1.46 0.29 0.00 0.00 0.00 -0.45 -2.33 119.26 118.23 5req h ALA 519 Ca 0.26 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 5req h ALA 519 Cb -0.01 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 5req h ALA 519 CO -0.05 -0.34 -0.04 0.78 0.00 0.00 0.00 179.25 179.61 5req h GLY 520 N 0.19 0.00 -6.58 0.00 0.00 -1.04 -3.40 103.07 92.24 5req h GLY 520 Ca 0.12 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.85 5req h GLY 520 CO -0.14 0.00 -0.71 0.70 0.00 0.00 0.00 176.54 176.40 5req n ASN 521 N -3.15 2.34 -4.71 0.19 4.13 0.23 -5.08 115.26 109.22 5req n ASN 521 Ca 0.01 -3.09 -0.42 0.00 1.68 0.00 0.00 54.58 52.76 5req n ASN 521 Cb 0.35 -0.69 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 5req n ASN 521 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 5req s PRO 522 N -1.49 4.31 -0.17 3.52 0.04 -1.23 -4.72 135.00 135.26 5req s PRO 522 Ca 0.32 2.03 -0.04 0.00 0.04 0.00 0.00 61.00 63.35 5req s PRO 522 Cb 0.05 -3.36 0.06 0.00 0.04 0.00 0.00 34.50 31.29 5req s PRO 522 CO -0.12 -0.48 0.07 0.34 0.04 0.00 0.00 177.00 176.85 5req s ASP 523 N 1.38 2.51 0.24 6.66 2.15 -1.26 -5.04 116.67 123.31 5req s ASP 523 Ca 0.64 -0.66 -0.05 0.00 0.43 0.00 0.00 52.55 52.91 5req s ASP 523 Cb -0.35 -0.37 0.34 0.00 -0.30 0.00 0.00 42.92 42.24 5req s ASP 523 CO 0.29 -0.33 1.85 0.44 -0.17 0.00 0.00 175.17 177.25 5req h ASP 524 N 8.36 0.84 -0.01 -0.34 3.32 -1.95 -2.95 116.42 123.69 5req h ASP 524 Ca -0.15 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.91 5req h ASP 524 Cb 1.14 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.53 5req h ASP 524 CO 0.30 0.54 0.00 0.29 -1.72 0.00 0.00 179.24 178.65 5req n LYS 525 N -4.62 1.10 -4.01 3.56 4.01 -1.26 -4.66 118.16 112.27 5req n LYS 525 Ca 0.13 -0.14 -0.33 0.00 -0.51 0.00 0.00 58.31 57.46 5req n LYS 525 Cb 0.18 -1.45 -0.15 0.00 -0.51 0.00 0.00 35.03 33.10 5req n LYS 525 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 5req s ASP 526 N -1.90 4.65 0.45 4.39 2.15 -1.12 -5.00 116.67 120.29 5req s ASP 526 Ca 0.42 -1.55 0.14 0.00 0.43 0.00 0.00 52.55 51.99 5req s ASP 526 Cb 0.20 -1.61 1.02 0.00 -0.30 0.00 0.00 42.92 42.22 5req s ASP 526 CO 0.33 -0.26 2.01 -0.65 -0.17 0.00 0.00 175.17 176.43 5req h PRO 527 N 7.80 0.02 0.00 4.34 0.11 -1.84 -3.14 132.00 139.30 5req h PRO 527 Ca -0.16 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 5req h PRO 527 Cb 1.04 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 5req h PRO 527 CO 0.50 0.18 0.00 -0.44 -0.21 0.00 0.00 178.00 178.02 5req h ASP 528 N 0.02 0.00 0.24 -2.05 3.32 -1.96 -2.22 116.42 113.77 5req h ASP 528 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 5req h ASP 528 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 5req h ASP 528 CO 0.02 0.00 -0.52 -1.14 -1.72 0.00 0.00 179.24 175.88 5req n ARG 529 N -3.08 0.44 -1.60 3.56 0.63 -1.18 -4.76 116.66 110.67 5req n ARG 529 Ca -0.01 -0.30 -0.47 0.00 -0.92 0.00 0.00 57.85 56.15 5req n ARG 529 Cb 0.21 -1.49 -0.03 0.00 0.45 0.00 0.00 32.46 31.60 5req n ARG 529 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 5req n ASN 530 N -1.02 1.55 0.21 6.15 2.85 -0.84 -4.82 115.26 119.34 5req n ASN 530 Ca 0.08 1.16 0.06 0.00 -0.11 0.00 0.00 54.58 55.76 5req n ASN 530 Cb 0.36 -1.28 0.46 0.00 1.24 0.00 0.00 39.78 40.56 5req n ASN 530 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 5req h LEU 531 N 3.01 0.00 -0.06 1.20 3.38 -1.91 -1.57 115.31 119.35 5req h LEU 531 Ca -0.42 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 5req h LEU 531 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 5req h LEU 531 CO 0.68 0.29 -0.16 0.25 0.09 0.00 0.00 178.44 179.59 5req h LEU 532 N 0.00 0.25 -0.45 1.67 5.85 -1.90 -2.29 115.31 118.44 5req h LEU 532 Ca -0.00 -0.59 0.09 0.00 0.84 0.00 0.00 57.88 58.22 5req h LEU 532 Cb 0.61 -0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.48 5req h LEU 532 CO 0.04 0.80 -0.13 0.50 -0.34 0.00 0.00 178.44 179.31 5req h LYS 533 N -0.28 -0.02 0.00 1.25 3.11 -1.84 -0.65 116.57 118.14 5req h LYS 533 Ca -0.00 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.75 5req h LYS 533 Cb 0.77 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.99 5req h LYS 533 CO 0.04 -0.01 -0.43 -0.07 -2.81 0.00 0.00 179.45 176.16 5req h LEU 534 N -0.02 0.00 -0.36 5.20 3.38 -1.35 -2.51 115.31 119.64 5req h LEU 534 Ca 0.22 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 5req h LEU 534 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 5req h LEU 534 CO -0.47 0.43 -0.29 0.00 0.09 0.00 0.00 178.44 178.20 5req h ILE 536 N 0.63 0.32 -0.50 0.00 2.04 -0.82 0.29 117.51 119.47 5req h ILE 536 Ca 0.07 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.99 5req h ILE 536 Cb 0.86 0.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 5req h ILE 536 CO 0.07 0.00 0.19 0.44 0.00 0.00 0.00 178.15 178.85 5req h ASP 537 N -0.35 0.20 -0.79 1.72 3.32 -1.39 -1.47 116.42 117.67 5req h ASP 537 Ca 0.11 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 5req h ASP 537 Cb 0.52 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.06 5req h ASP 537 CO -0.36 0.14 0.34 0.00 -1.72 0.00 0.00 179.24 177.64 5req h ALA 538 N 1.33 1.10 0.00 3.45 0.00 -0.85 -2.53 119.26 121.75 5req h ALA 538 Ca 0.24 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 5req h ALA 538 Cb 0.24 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 5req h ALA 538 CO -0.23 0.65 -0.45 0.78 0.00 0.00 0.00 179.25 180.00 5req h GLY 539 N 1.16 0.00 1.84 0.00 0.00 -0.73 -1.81 103.07 103.52 5req h GLY 539 Ca 0.27 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.45 5req h GLY 539 CO -0.03 0.00 -0.64 -0.09 0.00 0.00 0.00 176.54 175.78 5req h ARG 540 N 0.00 0.16 0.00 4.80 2.43 -1.11 -2.83 114.38 117.83 5req h ARG 540 Ca -0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 5req h ARG 540 Cb 0.95 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 5req h ARG 540 CO 0.06 0.75 0.00 0.00 -1.51 0.00 0.00 179.97 179.27 5req n ALA 541 N -2.45 2.48 -1.68 2.80 0.00 -0.97 -4.89 120.51 115.79 5req n ALA 541 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 5req n ALA 541 Cb 0.64 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.64 5req n ALA 541 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 5req n MET 542 N -1.07 0.00 -2.67 0.00 2.81 -1.07 -4.58 117.12 110.54 5req n MET 542 Ca 0.19 0.02 -0.37 0.00 -1.81 0.00 0.00 57.70 55.73 5req n MET 542 Cb 0.12 -3.05 -0.05 0.00 -0.71 0.00 0.00 33.22 29.52 5req n MET 542 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 5req s ALA 543 N -2.00 3.18 0.84 3.04 0.00 -0.70 -4.94 121.76 121.18 5req s ALA 543 Ca 0.00 0.62 -0.11 0.00 0.00 0.00 0.00 51.96 52.47 5req s ALA 543 Cb 0.00 -3.23 0.13 0.00 0.00 0.00 0.00 23.12 20.02 5req s ALA 543 CO 0.00 0.00 1.18 0.95 0.00 0.00 0.00 175.76 177.89 5req s THR 544 N -1.60 2.08 0.09 0.00 -4.23 -1.26 -4.55 115.64 106.16 5req s THR 544 Ca 0.53 -0.13 -0.18 0.00 -1.18 0.00 0.00 61.69 60.74 5req s THR 544 Cb -0.21 -2.95 -0.08 0.00 1.34 0.00 0.00 72.50 70.60 5req s THR 544 CO 0.26 0.00 1.48 0.58 -0.54 0.00 0.00 174.62 176.41 5req h VAL 545 N -1.13 1.28 0.05 2.29 2.07 -1.09 -1.31 116.25 118.41 5req h VAL 545 Ca -0.44 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.01 5req h VAL 545 Cb 1.28 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 5req h VAL 545 CO 0.51 0.34 -0.05 1.23 0.02 0.00 0.00 177.57 179.61 5req h GLY 546 N 0.26 -0.11 0.59 2.17 0.00 -1.82 -1.56 103.07 102.61 5req h GLY 546 Ca 0.07 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.49 5req h GLY 546 CO 0.03 -0.06 -0.17 0.83 0.00 0.00 0.00 176.54 177.17 5req h GLU 547 N -0.12 -0.26 -0.64 4.80 5.08 -1.87 0.37 114.58 121.93 5req h GLU 547 Ca 0.00 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 5req h GLU 547 Cb 0.12 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 5req h GLU 547 CO -0.02 -0.18 0.38 0.52 -1.00 0.00 0.00 179.01 178.72 5req h MET 548 N -0.27 0.71 -0.29 2.33 2.86 -1.25 -0.89 114.93 118.13 5req h MET 548 Ca 0.05 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 5req h MET 548 Cb 0.34 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 5req h MET 548 CO -0.16 0.47 -0.22 0.77 1.06 0.00 0.00 176.91 178.83 5req h SER 549 N 0.73 0.56 -0.56 1.22 0.02 -0.89 -2.86 113.55 111.76 5req h SER 549 Ca 0.27 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 5req h SER 549 Cb 0.07 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 5req h SER 549 CO -0.13 0.78 0.10 0.44 -1.14 0.00 0.00 176.83 176.88 5req h ASP 550 N 0.49 0.89 -1.00 3.07 3.32 0.07 -2.04 116.42 121.23 5req h ASP 550 Ca 0.07 -0.26 0.07 0.00 0.02 0.00 0.00 57.03 56.94 5req h ASP 550 Cb 0.66 -0.24 -0.07 0.00 0.22 0.00 0.00 39.33 39.90 5req h ASP 550 CO 0.05 0.92 0.64 0.00 -1.72 0.00 0.00 179.24 179.13 5req h ALA 551 N 1.00 1.39 -0.17 3.45 0.00 -0.95 -1.64 119.26 122.36 5req h ALA 551 Ca 0.17 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 5req h ALA 551 Cb 0.40 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 5req h ALA 551 CO 0.01 0.41 -0.60 -0.07 0.00 0.00 0.00 179.25 179.00 5req h LEU 552 N 1.15 0.63 -1.62 0.00 3.38 -1.54 -3.31 115.31 114.00 5req h LEU 552 Ca 0.44 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 5req h LEU 552 Cb 0.20 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 5req h LEU 552 CO -0.18 1.09 0.06 -0.08 0.09 0.00 0.00 178.44 179.42 5req h GLU 553 N 0.42 0.30 -0.60 1.13 4.81 -0.55 -1.31 114.58 118.78 5req h GLU 553 Ca -0.00 -0.04 0.10 0.00 -0.13 0.00 0.00 59.36 59.29 5req h GLU 553 Cb 1.16 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.41 5req h GLU 553 CO 0.11 0.28 0.19 0.87 -0.73 0.00 0.00 179.01 179.74 5req h LYS 554 N 0.31 0.35 0.11 1.92 1.57 -1.53 0.53 116.57 119.82 5req h LYS 554 Ca 0.08 -0.02 -0.25 0.00 -1.87 0.00 0.00 60.65 58.58 5req h LYS 554 Cb 0.11 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 5req h LYS 554 CO -0.00 0.23 -1.28 0.28 -0.57 0.00 0.00 179.45 178.10 5req h VAL 555 N 0.36 1.11 0.00 0.50 2.07 -1.74 -3.42 116.25 115.13 5req h VAL 555 Ca 0.31 -2.41 -0.20 0.00 0.82 0.00 0.00 66.70 65.22 5req h VAL 555 Cb 0.41 2.78 -0.03 0.00 -1.52 0.00 0.00 31.29 32.93 5req h VAL 555 CO -0.34 0.68 -1.09 -0.26 0.02 0.00 0.00 177.57 176.59 5req h PHE 556 N -0.37 0.00 -1.31 1.57 0.04 -1.06 -3.50 116.94 112.32 5req h PHE 556 Ca -0.27 0.00 0.15 0.00 2.80 0.00 0.00 57.97 60.65 5req h PHE 556 Cb 1.70 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.80 5req h PHE 556 CO 0.14 0.84 -0.29 0.41 -0.60 0.00 0.00 178.31 178.82 5req n GLY 557 N 1.37 -1.88 3.69 -1.45 0.00 0.18 -4.57 105.19 102.53 5req n GLY 557 Ca -0.04 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.27 5req n GLY 557 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 5req s ARG 558 N -2.01 2.96 0.15 1.61 0.52 -1.26 -4.30 118.95 116.62 5req s ARG 558 Ca 0.00 -0.44 -0.14 0.00 -0.52 0.00 0.00 55.73 54.64 5req s ARG 558 Cb 0.00 -2.78 -0.07 0.00 0.52 0.00 0.00 34.95 32.62 5req s ARG 558 CO 0.00 0.69 0.54 -0.47 0.02 0.00 0.00 175.30 176.08 5req s TYR 559 N -0.92 3.59 -0.09 -0.53 5.04 -0.57 -4.81 117.35 119.06 5req s TYR 559 Ca 0.14 1.04 0.03 0.00 -2.44 0.00 0.00 57.07 55.84 5req s TYR 559 Cb -0.11 -2.35 0.01 0.00 0.35 0.00 0.00 41.96 39.85 5req s TYR 559 CO 0.04 0.42 -0.17 0.99 -1.34 0.00 0.00 175.55 175.50 5req s THR 560 N -1.48 1.50 0.62 4.34 2.01 -1.26 -4.97 115.64 116.40 5req s THR 560 Ca 0.38 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 61.64 5req s THR 560 Cb -0.15 -1.34 0.02 0.00 0.01 0.00 0.00 72.50 71.04 5req s THR 560 CO 0.19 0.44 0.93 0.00 -0.69 0.00 0.00 174.62 175.49 5req s ALA 561 N 0.63 3.27 -0.16 7.40 0.00 -1.26 -5.09 121.76 126.55 5req s ALA 561 Ca -0.14 -0.75 -0.08 0.00 0.00 0.00 0.00 51.96 50.98 5req s ALA 561 Cb -0.16 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 5req s ALA 561 CO 0.04 -0.93 0.12 -1.14 0.00 0.00 0.00 175.76 173.85 5req s GLN 562 N -5.06 3.78 -0.12 0.00 0.74 -1.26 -5.05 119.66 112.69 5req s GLN 562 Ca 0.56 -0.20 -0.23 0.00 0.05 0.00 0.00 55.36 55.53 5req s GLN 562 Cb -0.11 -3.27 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 5req s GLN 562 CO 0.45 0.53 0.71 0.42 -0.55 0.00 0.00 175.29 176.85 5req s ILE 563 N -0.32 5.01 -0.09 -2.34 -1.09 -1.26 -5.04 121.20 116.06 5req s ILE 563 Ca 0.11 1.42 -0.01 0.00 -2.23 0.00 0.00 60.65 59.94 5req s ILE 563 Cb -0.12 -4.04 0.03 0.00 -1.58 0.00 0.00 42.46 36.75 5req s ILE 563 CO 0.01 0.18 -0.04 -0.13 -1.23 0.00 0.00 174.94 173.73 5req s ARG 564 N 1.31 1.10 -0.13 2.79 0.52 -1.26 -5.13 118.95 118.15 5req s ARG 564 Ca 0.36 -0.09 -0.00 0.00 -0.52 0.00 0.00 55.73 55.47 5req s ARG 564 Cb -0.17 -1.29 -0.02 0.00 0.52 0.00 0.00 34.95 33.99 5req s ARG 564 CO 0.15 -0.27 -0.12 0.99 0.02 0.00 0.00 175.30 176.06 5req s THR 565 N 1.79 3.11 0.77 0.02 2.01 -1.26 -4.96 115.64 117.12 5req s THR 565 Ca 0.04 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.29 5req s THR 565 Cb -0.12 -2.31 0.05 0.00 0.01 0.00 0.00 72.50 70.13 5req s THR 565 CO -0.06 0.53 1.08 0.27 -0.69 0.00 0.00 174.62 175.74 5req s ILE 566 N 0.30 3.42 -0.00 1.82 -4.36 -1.26 -5.08 121.20 116.04 5req s ILE 566 Ca -0.10 0.46 -0.02 0.00 -0.26 0.00 0.00 60.65 60.74 5req s ILE 566 Cb -0.16 -3.15 -0.00 0.00 1.25 0.00 0.00 42.46 40.40 5req s ILE 566 CO 0.05 -0.60 0.03 -0.94 0.24 0.00 0.00 174.94 173.72 5req s SER 567 N -3.75 0.06 -0.26 4.36 1.04 -1.26 -4.66 113.70 109.23 5req s SER 567 Ca 0.60 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.89 5req s SER 567 Cb -0.15 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.08 5req s SER 567 CO 0.55 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.23 5req n GLY 568 N 2.39 0.58 0.12 7.32 0.00 -1.26 -4.94 105.19 109.40 5req n GLY 568 Ca -0.17 -0.60 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 5req n GLY 568 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 5req n VAL 569 N -2.87 1.61 0.33 1.61 0.31 -1.26 -3.87 118.33 114.18 5req n VAL 569 Ca -0.02 -0.27 -0.17 0.00 -0.01 0.00 0.00 64.34 63.86 5req n VAL 569 Cb 0.11 -1.91 -0.09 0.00 -0.91 0.00 0.00 33.84 31.04 5req n VAL 569 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 5req h TYR 570 N -0.64 -0.74 -0.02 3.52 5.03 -1.89 -2.26 116.97 119.96 5req h TYR 570 Ca -0.42 -0.02 0.03 0.00 2.58 0.00 0.00 58.73 60.90 5req h TYR 570 Cb 1.58 0.25 -0.03 0.00 1.55 0.00 0.00 36.73 40.07 5req h TYR 570 CO 0.07 -0.45 -0.15 0.66 -1.32 0.00 0.00 178.16 176.96 5req h SER 571 N -0.82 -0.45 -0.57 -2.11 4.64 -1.92 -3.11 113.55 109.21 5req h SER 571 Ca -0.08 0.07 0.09 0.00 -0.47 0.00 0.00 61.79 61.40 5req h SER 571 Cb 0.62 0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 62.83 5req h SER 571 CO 0.13 -0.21 0.18 0.50 -0.87 0.00 0.00 176.83 176.56 5req h LYS 572 N -0.25 0.32 0.00 4.77 3.64 -1.66 -3.31 116.57 120.09 5req h LYS 572 Ca 0.06 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 5req h LYS 572 Cb 0.32 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 5req h LYS 572 CO -0.16 0.21 0.00 -1.91 -2.27 0.00 0.00 179.45 175.33 5req n GLU 573 N -5.05 0.00 -3.61 1.90 4.07 -0.85 -3.70 120.64 113.39 5req n GLU 573 Ca 0.08 0.77 -0.39 0.00 -0.06 0.00 0.00 57.16 57.55 5req n GLU 573 Cb 0.27 -1.42 -0.08 0.00 -0.06 0.00 0.00 31.44 30.15 5req n GLU 573 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 5req s VAL 574 N -2.69 4.20 1.18 6.31 1.01 -1.25 -5.03 120.40 124.13 5req s VAL 574 Ca 0.00 -2.73 -0.15 0.00 0.00 0.00 0.00 61.98 59.11 5req s VAL 574 Cb 0.00 -3.70 0.28 0.00 0.00 0.00 0.00 36.38 32.96 5req s VAL 574 CO 0.00 -0.90 1.03 -0.54 0.00 0.00 0.00 175.10 174.69 5req s LYS 575 N 0.13 -1.00 -0.24 2.72 1.02 -1.24 -4.48 119.74 116.65 5req s LYS 575 Ca 0.16 0.56 -0.04 0.00 0.02 0.00 0.00 55.97 56.67 5req s LYS 575 Cb -0.18 -1.57 0.01 0.00 -0.52 0.00 0.00 37.83 35.57 5req s LYS 575 CO -0.05 -3.71 0.21 0.27 -0.92 0.00 0.00 175.35 171.15 5req n ASN 576 N -4.86 -1.65 -4.57 2.83 6.94 -1.26 -4.98 115.26 107.71 5req n ASN 576 Ca 0.05 -0.25 -0.33 0.00 -0.02 0.00 0.00 54.58 54.03 5req n ASN 576 Cb 0.56 -0.53 -0.11 0.00 -2.36 0.00 0.00 39.78 37.35 5req n ASN 576 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 5req s THR 577 N -1.78 3.61 0.18 5.53 2.01 -1.26 -5.05 115.64 118.88 5req s THR 577 Ca 0.04 -0.61 -0.14 0.00 0.31 0.00 0.00 61.69 61.28 5req s THR 577 Cb -0.00 -2.50 0.11 0.00 0.01 0.00 0.00 72.50 70.12 5req s THR 577 CO 0.30 0.53 1.69 -0.65 -0.69 0.00 0.00 174.62 175.79 5req h PRO 578 N 5.01 0.11 -0.42 4.92 0.11 -1.99 -1.63 132.00 138.11 5req h PRO 578 Ca -0.48 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.48 5req h PRO 578 Cb 1.17 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 5req h PRO 578 CO 0.52 0.07 -0.30 0.93 -0.21 0.00 0.00 178.00 179.02 5req h GLU 579 N 0.11 0.92 -0.20 1.05 3.07 -1.97 -2.02 114.58 115.55 5req h GLU 579 Ca 0.23 -0.43 0.01 0.00 -0.50 0.00 0.00 59.36 58.67 5req h GLU 579 Cb 0.35 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.23 5req h GLU 579 CO -0.39 1.09 0.09 0.28 -1.40 0.00 0.00 179.01 178.68 5req h VAL 580 N 0.78 0.98 -0.42 3.13 2.07 -1.82 0.27 116.25 121.24 5req h VAL 580 Ca 0.08 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 5req h VAL 580 Cb 0.88 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 5req h VAL 580 CO 0.08 0.04 0.04 -0.33 0.02 0.00 0.00 177.57 177.41 5req h GLU 581 N 0.20 0.71 -0.39 1.57 3.07 -1.30 -0.45 114.58 117.99 5req h GLU 581 Ca 0.08 -0.21 0.03 0.00 -0.50 0.00 0.00 59.36 58.77 5req h GLU 581 Cb 0.03 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.83 5req h GLU 581 CO -0.07 0.77 0.19 1.49 -1.40 0.00 0.00 179.01 179.99 5req h GLU 582 N 0.56 0.38 0.21 2.33 4.81 -1.24 -0.97 114.58 120.66 5req h GLU 582 Ca 0.12 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 5req h GLU 582 Cb 0.43 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 5req h GLU 582 CO 0.01 0.25 -0.14 0.00 -0.73 0.00 0.00 179.01 178.41 5req h ALA 583 N 1.21 -0.32 -0.35 2.92 0.00 -0.80 -1.49 119.26 120.43 5req h ALA 583 Ca 0.17 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.09 5req h ALA 583 Cb 0.08 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 17.96 5req h ALA 583 CO -0.12 -0.69 -0.31 0.00 0.00 0.00 0.00 179.25 178.12 5req h ARG 584 N -0.34 -0.26 -0.99 0.00 3.08 -0.81 -1.45 114.38 113.61 5req h ARG 584 Ca -0.02 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.10 5req h ARG 584 Cb 0.29 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 5req h ARG 584 CO 0.01 -0.17 0.65 0.93 -1.07 0.00 0.00 179.97 180.31 5req h GLU 585 N -0.27 1.18 -0.46 0.04 5.08 -1.07 -0.98 114.58 118.11 5req h GLU 585 Ca 0.16 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 5req h GLU 585 Cb 0.53 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 5req h GLU 585 CO -0.50 0.78 0.15 -0.07 -1.00 0.00 0.00 179.01 178.38 5req h LEU 586 N 1.22 0.61 -0.40 1.33 3.38 -0.75 -1.46 115.31 119.25 5req h LEU 586 Ca 0.41 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.19 5req h LEU 586 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 5req h LEU 586 CO -0.15 0.59 -0.18 0.58 0.09 0.00 0.00 178.44 179.37 5req h VAL 587 N 0.66 1.28 -0.28 1.22 2.07 -0.40 -1.70 116.25 119.09 5req h VAL 587 Ca 0.16 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.37 5req h VAL 587 Cb 0.19 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 5req h VAL 587 CO -0.01 0.44 0.18 -0.33 0.02 0.00 0.00 177.57 177.87 5req h GLU 588 N 0.63 0.37 -0.39 1.57 5.08 -1.05 -2.52 114.58 118.28 5req h GLU 588 Ca 0.09 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 5req h GLU 588 Cb 0.73 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 5req h GLU 588 CO 0.06 0.26 0.26 0.93 -1.00 0.00 0.00 179.01 179.51 5req h GLU 589 N 0.38 0.45 -0.33 2.33 5.08 -1.22 -2.53 114.58 118.74 5req h GLU 589 Ca 0.10 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 5req h GLU 589 Cb -0.03 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 5req h GLU 589 CO -0.02 0.30 -0.26 0.35 -1.00 0.00 0.00 179.01 178.38 5req h PHE 590 N 0.46 0.89 -0.21 4.33 3.04 -1.17 -2.47 116.94 121.82 5req h PHE 590 Ca 0.15 -0.25 0.00 0.00 3.98 0.00 0.00 57.97 61.85 5req h PHE 590 Cb 0.04 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.35 5req h PHE 590 CO -0.00 1.00 0.14 1.49 -2.02 0.00 0.00 178.31 178.92 5req h GLU 591 N 0.53 0.29 -0.07 1.11 4.81 -1.03 0.17 114.58 120.38 5req h GLU 591 Ca 0.06 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.30 5req h GLU 591 Cb 0.82 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 5req h GLU 591 CO 0.07 0.21 -0.12 1.96 -0.73 0.00 0.00 179.01 180.40 5req h GLN 592 N 0.28 -0.16 -0.64 1.92 1.08 -1.55 0.39 115.11 116.43 5req h GLN 592 Ca 0.08 0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.25 5req h GLN 592 Cb -0.01 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 5req h GLN 592 CO -0.02 -0.10 0.26 0.00 -0.95 0.00 0.00 178.83 178.02 5req h ALA 593 N 0.87 0.83 0.00 3.87 0.00 -1.35 -3.37 119.26 120.11 5req h ALA 593 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.81 5req h ALA 593 Cb 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.80 5req h ALA 593 CO -0.17 0.44 -1.13 0.39 0.00 0.00 0.00 179.25 178.78 5req n GLU 594 N -4.44 1.46 -0.10 0.00 -0.58 0.59 -5.03 120.64 112.55 5req n GLU 594 Ca 0.04 -0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 5req n GLU 594 Cb 0.16 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 5req n GLU 594 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 5req n GLY 595 N 1.49 0.52 3.75 0.62 0.00 0.14 -5.03 105.19 106.68 5req n GLY 595 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 5req n GLY 595 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 5req s ARG 596 N -0.86 1.67 0.64 1.61 1.70 -1.22 -5.01 118.95 117.47 5req s ARG 596 Ca 0.00 -0.89 -0.14 0.00 -0.47 0.00 0.00 55.73 54.23 5req s ARG 596 Cb 0.00 0.60 -0.02 0.00 -0.57 0.00 0.00 34.95 34.96 5req s ARG 596 CO 0.00 -0.75 1.06 1.03 -1.08 0.00 0.00 175.30 175.55 5req s ARG 597 N -3.89 3.16 0.15 3.89 0.52 -1.26 -3.73 118.95 117.79 5req s ARG 597 Ca 0.09 1.10 -0.31 0.00 -0.52 0.00 0.00 55.73 56.09 5req s ARG 597 Cb -0.05 -2.01 -0.11 0.00 0.52 0.00 0.00 34.95 33.30 5req s ARG 597 CO 0.03 -0.93 1.73 -1.25 0.02 0.00 0.00 175.30 174.89 5req s PRO 598 N -4.47 4.15 -0.09 3.54 0.04 -1.26 -4.73 135.00 132.17 5req s PRO 598 Ca 0.61 2.52 0.02 0.00 0.04 0.00 0.00 61.00 64.19 5req s PRO 598 Cb -0.15 -3.34 -0.02 0.00 0.04 0.00 0.00 34.50 31.03 5req s PRO 598 CO 0.44 -0.76 -0.15 0.50 0.04 0.00 0.00 177.00 177.08 5req s ARG 599 N 1.93 2.98 -0.01 4.56 3.52 -1.26 -0.27 118.95 130.41 5req s ARG 599 Ca 0.76 -0.71 0.02 0.00 -0.13 0.00 0.00 55.73 55.68 5req s ARG 599 Cb -0.46 -2.50 -0.00 0.00 -1.56 0.00 0.00 34.95 30.43 5req s ARG 599 CO 0.33 0.38 -0.07 -1.50 -0.81 0.00 0.00 175.30 173.64 5req s ILE 600 N -0.11 0.57 -0.27 4.11 2.07 -0.44 -1.38 121.20 125.76 5req s ILE 600 Ca -0.02 -0.30 -0.09 0.00 -1.41 0.00 0.00 60.65 58.83 5req s ILE 600 Cb -0.14 -0.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.93 5req s ILE 600 CO 0.04 0.17 0.14 -0.22 -1.91 0.00 0.00 174.94 173.15 5req s LEU 601 N -0.08 3.79 -0.41 8.50 2.96 -0.78 -1.48 118.68 131.17 5req s LEU 601 Ca 0.02 -0.15 -0.20 0.00 -0.22 0.00 0.00 54.13 53.57 5req s LEU 601 Cb -0.04 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.64 5req s LEU 601 CO -0.00 -0.06 0.61 -0.76 -1.32 0.00 0.00 176.35 174.81 5req s LEU 602 N 1.68 4.48 -0.03 -0.68 1.43 -0.70 0.06 118.68 124.93 5req s LEU 602 Ca 0.06 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 5req s LEU 602 Cb -0.16 -2.69 -0.03 0.00 0.03 0.00 0.00 46.19 43.34 5req s LEU 602 CO 0.07 -0.70 -0.04 0.00 0.23 0.00 0.00 176.35 175.92 5req s ALA 603 N 2.70 3.13 -0.37 4.21 0.00 -0.20 -1.34 121.76 129.87 5req s ALA 603 Ca 0.21 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 5req s ALA 603 Cb -0.15 -1.28 0.10 0.00 0.00 0.00 0.00 23.12 21.80 5req s ALA 603 CO 0.17 0.61 0.13 0.15 0.00 0.00 0.00 175.76 176.82 5req s LYS 604 N -1.21 1.91 0.15 0.00 -0.14 -1.26 -1.00 119.74 118.19 5req s LYS 604 Ca 0.16 -1.77 0.07 0.00 -1.36 0.00 0.00 55.97 53.07 5req s LYS 604 Cb -0.11 -3.42 -0.04 0.00 -1.68 0.00 0.00 37.83 32.58 5req s LYS 604 CO 0.06 -0.97 0.00 -1.64 -0.76 0.00 0.00 175.35 172.03 5req s MET 605 N 1.08 2.44 1.67 1.68 -1.94 -1.26 -2.38 119.30 120.59 5req s MET 605 Ca 0.07 -1.03 0.00 0.00 -1.71 0.00 0.00 55.69 53.02 5req s MET 605 Cb -0.21 -2.41 0.00 0.00 2.01 0.00 0.00 34.83 34.22 5req s MET 605 CO -0.05 0.48 0.00 0.41 -0.01 0.00 0.00 175.02 175.85 5req n GLY 606 N 0.07 -0.47 0.32 -0.03 0.00 -0.78 -4.11 105.19 100.19 5req n GLY 606 Ca -0.10 -1.44 0.12 0.00 0.00 0.00 0.00 46.02 44.60 5req n GLY 606 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 5req n GLN 607 N 0.00 0.89 -1.68 1.61 1.13 -1.26 -3.89 117.38 114.17 5req n GLN 607 Ca 0.00 -0.64 -0.63 0.00 -1.94 0.00 0.00 57.00 53.79 5req n GLN 607 Cb 0.00 -1.49 -0.09 0.00 0.11 0.00 0.00 30.24 28.78 5req n GLN 607 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 5req n ASP 608 N -0.50 1.23 -0.68 1.08 -0.08 -1.26 -4.87 116.55 111.47 5req n ASP 608 Ca 0.10 1.16 0.08 0.00 -1.51 0.00 0.00 54.79 54.62 5req n ASP 608 Cb 0.39 -0.96 0.08 0.00 2.34 0.00 0.00 41.12 42.98 5req n ASP 608 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 5req n GLY 609 N 3.43 0.42 3.69 0.27 0.00 -1.26 -4.63 105.19 107.11 5req n GLY 609 Ca 0.27 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 5req n GLY 609 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 5req s HIS 610 N -1.33 2.78 0.00 1.61 3.76 -1.26 -4.68 115.29 116.17 5req s HIS 610 Ca 0.20 0.66 0.00 0.00 -0.15 0.00 0.00 55.06 55.78 5req s HIS 610 Cb 0.14 -3.78 0.00 0.00 1.11 0.00 0.00 32.58 30.05 5req s HIS 610 CO 0.21 -2.96 0.48 -0.40 -0.85 0.00 0.00 174.74 171.22 5req n ASP 611 N 5.15 0.79 0.12 1.40 5.68 -1.26 -4.81 116.55 123.62 5req n ASP 611 Ca 0.14 -1.23 -0.13 0.00 -0.50 0.00 0.00 54.79 53.07 5req n ASP 611 Cb 0.42 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.34 5req n ASP 611 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 5req h ARG 612 N 0.00 -0.31 -0.06 0.11 2.43 -1.93 0.03 114.38 114.64 5req h ARG 612 Ca 0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 5req h ARG 612 Cb 0.42 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 5req h ARG 612 CO 0.00 -0.21 0.04 0.78 -1.51 0.00 0.00 179.97 179.07 5req h GLY 613 N -0.33 0.09 0.58 2.80 0.00 -1.99 -1.46 103.07 102.76 5req h GLY 613 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.33 5req h GLY 613 CO -0.04 0.03 -0.12 -1.61 0.00 0.00 0.00 176.54 174.80 5req h GLN 614 N 0.08 -0.16 -0.17 4.80 4.15 -1.84 -0.92 115.11 121.05 5req h GLN 614 Ca 0.02 0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.33 5req h GLN 614 Cb -0.00 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 5req h GLN 614 CO -0.00 -0.11 -0.43 0.87 -1.93 0.00 0.00 178.83 177.23 5req h LYS 615 N -0.16 0.40 -0.01 1.69 1.79 -0.97 -0.65 116.57 118.65 5req h LYS 615 Ca 0.07 -0.20 -0.21 0.00 -2.18 0.00 0.00 60.65 58.13 5req h LYS 615 Cb 0.27 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.92 5req h LYS 615 CO -0.19 0.76 -0.89 -0.24 -1.08 0.00 0.00 179.45 177.81 5req h VAL 616 N 0.32 1.43 -0.23 0.50 3.04 -1.12 -1.94 116.25 118.25 5req h VAL 616 Ca 0.03 -2.46 -0.00 0.00 -1.01 0.00 0.00 66.70 63.25 5req h VAL 616 Cb 0.90 2.39 -0.01 0.00 -2.01 0.00 0.00 31.29 32.55 5req h VAL 616 CO 0.07 0.73 0.12 0.40 -1.01 0.00 0.00 177.57 177.89 5req h ILE 617 N 0.19 1.11 0.31 3.17 1.08 -1.20 -1.66 117.51 120.51 5req h ILE 617 Ca -0.06 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 5req h ILE 617 Cb 1.51 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 36.13 5req h ILE 617 CO 0.15 0.11 -0.46 0.00 -0.69 0.00 0.00 178.15 177.26 5req h ALA 618 N 1.01 -0.93 -0.58 1.87 0.00 -0.92 -0.24 119.26 119.47 5req h ALA 618 Ca 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 5req h ALA 618 Cb 0.07 0.70 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 5req h ALA 618 CO -0.01 -1.08 0.27 0.00 0.00 0.00 0.00 179.25 178.43 5req h THR 619 N -0.82 1.21 -0.21 0.00 1.03 -1.41 -1.32 112.91 111.39 5req h THR 619 Ca -0.02 -0.60 -0.12 0.00 -0.01 0.00 0.00 66.41 65.66 5req h THR 619 Cb 0.77 0.54 -0.01 0.00 -1.07 0.00 0.00 68.15 68.37 5req h THR 619 CO -0.15 0.24 -0.37 0.00 -0.01 0.00 0.00 175.52 175.23 5req h ALA 620 N 1.11 0.97 -0.01 0.00 0.00 -1.26 -2.15 119.26 117.92 5req h ALA 620 Ca 0.20 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 5req h ALA 620 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 5req h ALA 620 CO -0.02 0.61 -0.79 1.88 0.00 0.00 0.00 179.25 180.93 5req h TYR 621 N 0.38 0.16 -0.57 0.00 -1.99 -0.92 -2.33 116.97 111.71 5req h TYR 621 Ca 0.04 -0.08 -0.10 0.00 2.00 0.00 0.00 58.73 60.59 5req h TYR 621 Cb 0.83 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.52 5req h TYR 621 CO 0.03 0.85 -0.03 0.00 -0.00 0.00 0.00 178.16 179.00 5req h ALA 622 N 1.12 0.86 0.00 3.88 0.00 -1.09 -1.50 119.26 122.53 5req h ALA 622 Ca -0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 5req h ALA 622 Cb 1.38 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 5req h ALA 622 CO 0.11 0.66 -0.11 -0.44 0.00 0.00 0.00 179.25 179.47 5req h ASP 623 N 0.92 0.00 0.32 0.00 3.32 -1.31 -2.62 116.42 117.05 5req h ASP 623 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 5req h ASP 623 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 5req h ASP 623 CO 0.03 0.11 -0.26 0.18 -1.72 0.00 0.00 179.24 177.58 5req n LEU 624 N -3.57 0.80 0.00 1.55 4.77 -0.88 -4.96 117.00 114.71 5req n LEU 624 Ca -0.02 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 5req n LEU 624 Cb 0.24 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 5req n LEU 624 CO 0.29 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 5req n GLY 625 N 1.36 0.94 3.80 -0.72 0.00 -0.99 -4.38 105.19 105.19 5req n GLY 625 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 5req n GLY 625 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 5req s PHE 626 N -2.00 2.95 -0.31 1.61 0.40 -0.60 -4.63 117.98 115.40 5req s PHE 626 Ca 0.00 1.55 -0.19 0.00 -0.60 0.00 0.00 56.93 57.68 5req s PHE 626 Cb 0.00 -3.07 -0.01 0.00 0.51 0.00 0.00 43.02 40.45 5req s PHE 626 CO 0.00 -1.06 0.58 -0.51 0.70 0.00 0.00 175.22 174.94 5req s ASP 627 N -2.30 6.44 -0.17 1.36 1.01 0.63 -4.36 116.67 119.27 5req s ASP 627 Ca 0.66 0.31 -0.02 0.00 0.71 0.00 0.00 52.55 54.22 5req s ASP 627 Cb -0.17 -2.31 -0.01 0.00 1.01 0.00 0.00 42.92 41.44 5req s ASP 627 CO 0.28 -0.46 -0.10 -0.69 0.21 0.00 0.00 175.17 174.42 5req s VAL 628 N 2.52 3.09 -0.19 -1.27 1.01 -1.26 -1.33 120.40 122.97 5req s VAL 628 Ca 0.23 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 5req s VAL 628 Cb -0.15 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 5req s VAL 628 CO 0.12 0.48 0.08 -1.81 0.00 0.00 0.00 175.10 173.97 5req s ASP 629 N 0.91 5.67 -0.43 3.32 1.01 -0.55 -5.00 116.67 121.60 5req s ASP 629 Ca -0.02 0.07 -0.16 0.00 0.71 0.00 0.00 52.55 53.15 5req s ASP 629 Cb -0.15 -1.98 0.03 0.00 1.01 0.00 0.00 42.92 41.83 5req s ASP 629 CO -0.00 0.15 0.38 -0.69 0.21 0.00 0.00 175.17 175.21 5req s VAL 630 N 0.55 5.17 0.67 -1.27 1.01 -1.26 -1.72 120.40 123.54 5req s VAL 630 Ca 0.04 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 5req s VAL 630 Cb -0.13 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.24 5req s VAL 630 CO 0.01 -0.41 1.12 -0.83 0.00 0.00 0.00 175.10 174.99 5req s GLY 631 N 1.89 2.17 0.74 4.51 0.00 -0.45 -4.97 107.32 111.22 5req s GLY 631 Ca 0.08 0.58 -0.11 0.00 0.00 0.00 0.00 44.72 45.27 5req s GLY 631 CO 0.11 0.94 1.09 2.56 0.00 0.00 0.00 173.10 177.80 5req s PRO 632 N -4.07 2.42 1.06 2.90 0.04 -1.26 -4.73 135.00 131.35 5req s PRO 632 Ca 0.68 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 62.76 5req s PRO 632 Cb -0.21 -1.92 0.22 0.00 0.04 0.00 0.00 34.50 32.63 5req s PRO 632 CO 0.42 -1.52 1.10 -0.51 0.04 0.00 0.00 177.00 176.52 5req s LEU 633 N -5.70 1.32 -1.59 -3.56 1.43 -1.26 -4.31 118.68 105.02 5req s LEU 633 Ca 0.62 1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 54.72 5req s LEU 633 Cb -0.17 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 42.98 5req s LEU 633 CO 0.53 -3.43 0.15 0.49 0.23 0.00 0.00 176.35 174.33 5req n PHE 634 N -4.35 -1.32 -2.73 0.29 3.72 -1.25 -4.99 117.46 106.83 5req n PHE 634 Ca 0.07 0.13 -0.40 0.00 -0.05 0.00 0.00 57.45 57.21 5req n PHE 634 Cb 0.58 -3.84 -0.06 0.00 -0.94 0.00 0.00 39.48 35.22 5req n PHE 634 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 5req s GLN 635 N -5.23 4.83 0.88 -1.08 -0.21 -1.00 -4.64 119.66 113.21 5req s GLN 635 Ca 0.08 1.51 -0.13 0.00 0.02 0.00 0.00 55.36 56.84 5req s GLN 635 Cb -0.04 -3.25 0.12 0.00 1.00 0.00 0.00 33.01 30.84 5req s GLN 635 CO 0.10 0.49 1.18 0.95 -2.12 0.00 0.00 175.29 175.89 5req s THR 636 N -1.20 1.99 0.40 -0.19 -4.23 -1.26 -1.87 115.64 109.27 5req s THR 636 Ca 0.42 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.22 5req s THR 636 Cb -0.26 -2.90 0.31 0.00 1.34 0.00 0.00 72.50 70.99 5req s THR 636 CO 0.32 0.00 2.08 -0.65 -0.54 0.00 0.00 174.62 175.83 5req h PRO 637 N -1.34 0.00 0.15 3.99 0.11 -1.94 -2.15 132.00 130.81 5req h PRO 637 Ca -0.47 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.35 5req h PRO 637 Cb 1.32 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.44 5req h PRO 637 CO 0.60 0.10 -1.28 1.49 -0.21 0.00 0.00 178.00 178.70 5req h GLU 638 N 0.00 0.34 -0.49 1.05 4.81 -1.93 -2.66 114.58 115.70 5req h GLU 638 Ca -0.00 -0.56 -0.08 0.00 -0.13 0.00 0.00 59.36 58.59 5req h GLU 638 Cb 0.34 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 5req h GLU 638 CO 0.01 1.26 0.01 0.93 -0.73 0.00 0.00 179.01 180.49 5req h GLU 639 N 0.10 0.86 -0.58 1.92 5.08 -1.79 -2.14 114.58 118.04 5req h GLU 639 Ca -0.16 -0.27 -0.11 0.00 -1.00 0.00 0.00 59.36 57.83 5req h GLU 639 Cb 1.99 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 31.14 5req h GLU 639 CO 0.22 0.90 -0.05 1.15 -1.00 0.00 0.00 179.01 180.22 5req h THR 640 N 0.72 1.27 0.08 1.13 2.02 -1.50 -0.37 112.91 116.26 5req h THR 640 Ca 0.14 -1.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.11 5req h THR 640 Cb 0.50 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 5req h THR 640 CO 0.02 0.43 -0.04 0.00 0.37 0.00 0.00 175.52 176.31 5req h ALA 641 N 0.98 -0.11 -0.02 6.16 0.00 -1.40 0.13 119.26 125.00 5req h ALA 641 Ca 0.16 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.04 5req h ALA 641 Cb 0.62 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 5req h ALA 641 CO 0.04 -0.53 -0.10 -0.09 0.00 0.00 0.00 179.25 178.57 5req h ARG 642 N -0.17 -0.15 -0.75 0.00 2.43 -1.33 0.24 114.38 114.66 5req h ARG 642 Ca -0.01 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 5req h ARG 642 Cb 0.14 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 5req h ARG 642 CO 0.02 -0.10 0.49 0.37 -1.51 0.00 0.00 179.97 179.24 5req h GLN 643 N -0.16 0.99 0.76 0.20 4.15 -1.09 0.15 115.11 120.12 5req h GLN 643 Ca 0.04 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 5req h GLN 643 Cb 0.21 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.68 5req h GLN 643 CO -0.11 0.66 -0.46 0.00 -1.93 0.00 0.00 178.83 176.99 5req h ALA 644 N 1.27 -1.18 -0.23 3.38 0.00 -0.22 -2.88 119.26 119.40 5req h ALA 644 Ca 0.27 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.99 5req h ALA 644 Cb -0.11 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 5req h ALA 644 CO -0.06 -1.18 -0.04 0.28 0.00 0.00 0.00 179.25 178.25 5req h VAL 645 N -1.14 0.79 0.00 0.00 2.07 -0.29 -0.65 116.25 117.03 5req h VAL 645 Ca -0.10 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.41 5req h VAL 645 Cb 0.91 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 5req h VAL 645 CO 0.11 0.00 0.00 -0.33 0.02 0.00 0.00 177.57 177.37 5req h GLU 646 N 0.02 0.00 -0.00 1.57 5.08 -0.75 -0.78 114.58 119.71 5req h GLU 646 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 5req h GLU 646 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 5req h GLU 646 CO -0.22 0.00 -0.51 0.00 -1.00 0.00 0.00 179.01 177.28 5req n ALA 647 N -1.83 3.52 -3.50 3.43 0.00 -1.00 -5.04 120.51 116.10 5req n ALA 647 Ca -0.01 -0.45 -0.22 0.00 0.00 0.00 0.00 53.44 52.76 5req n ALA 647 Cb 0.07 -0.52 0.06 0.00 0.00 0.00 0.00 19.45 19.06 5req n ALA 647 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 5req n ASP 648 N -0.81 -4.80 -4.86 0.00 2.03 -0.28 -4.98 116.55 102.85 5req n ASP 648 Ca 0.04 -0.83 -0.30 0.00 0.52 0.00 0.00 54.79 54.22 5req n ASP 648 Cb 0.26 -4.36 0.06 0.00 -0.72 0.00 0.00 41.12 36.36 5req n ASP 648 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 5req s VAL 649 N -3.47 3.29 -0.02 5.18 -7.23 -1.11 -4.95 120.40 112.09 5req s VAL 649 Ca 0.34 0.42 0.12 0.00 -1.81 0.00 0.00 61.98 61.05 5req s VAL 649 Cb -0.08 -3.32 -0.23 0.00 0.56 0.00 0.00 36.38 33.31 5req s VAL 649 CO 0.79 -0.55 0.76 0.45 -0.31 0.00 0.00 175.10 176.25 5req h HIS 650 N -0.82 0.00 -3.06 2.82 -0.00 -1.60 -3.45 115.15 109.03 5req h HIS 650 Ca -0.46 -0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 59.78 5req h HIS 650 Cb 1.26 -0.00 -0.22 0.00 -0.00 0.00 0.00 27.41 28.45 5req h HIS 650 CO 0.48 1.00 -0.32 0.54 -0.00 0.00 0.00 177.93 179.63 5req s VAL 651 N -2.62 0.04 -0.32 2.45 0.11 -1.15 -1.31 120.40 117.61 5req s VAL 651 Ca -0.04 -0.31 -0.09 0.00 -2.93 0.00 0.00 61.98 58.61 5req s VAL 651 Cb 0.08 -0.53 0.01 0.00 -1.53 0.00 0.00 36.38 34.41 5req s VAL 651 CO 0.82 -0.17 0.14 -0.69 -3.33 0.00 0.00 175.10 171.87 5req s VAL 652 N -0.76 4.37 -0.71 2.04 1.01 -0.08 -1.86 120.40 124.40 5req s VAL 652 Ca -0.08 -0.62 -0.19 0.00 0.00 0.00 0.00 61.98 61.09 5req s VAL 652 Cb -0.04 -3.28 0.12 0.00 0.00 0.00 0.00 36.38 33.17 5req s VAL 652 CO 0.03 0.00 0.85 -0.83 0.00 0.00 0.00 175.10 175.15 5req s GLY 653 N 1.56 1.84 0.07 4.51 0.00 0.11 -1.08 107.32 114.33 5req s GLY 653 Ca 0.03 -2.41 -0.30 0.00 0.00 0.00 0.00 44.72 42.04 5req s GLY 653 CO 0.05 1.73 1.13 0.14 0.00 0.00 0.00 173.10 176.15 5req s VAL 654 N 2.65 4.19 -0.37 1.40 1.01 -0.22 -1.04 120.40 128.03 5req s VAL 654 Ca 0.19 1.63 -0.03 0.00 0.00 0.00 0.00 61.98 63.77 5req s VAL 654 Cb -0.17 -4.05 0.09 0.00 0.00 0.00 0.00 36.38 32.25 5req s VAL 654 CO 0.02 0.16 0.13 -0.55 0.00 0.00 0.00 175.10 174.86 5req s SER 655 N 0.79 5.15 -0.15 3.32 0.15 -0.17 -0.77 113.70 122.02 5req s SER 655 Ca 0.55 -1.73 0.00 0.00 0.70 0.00 0.00 55.95 55.47 5req s SER 655 Cb -0.27 -1.80 0.03 0.00 -1.71 0.00 0.00 66.02 62.27 5req s SER 655 CO 0.30 -0.44 -0.12 -0.55 1.20 0.00 0.00 173.24 173.63 5req s SER 656 N 1.61 2.69 0.00 5.45 0.15 0.95 -4.65 113.70 119.90 5req s SER 656 Ca 0.04 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.17 5req s SER 656 Cb -0.22 -1.11 0.00 0.00 -1.71 0.00 0.00 66.02 62.98 5req s SER 656 CO -0.03 -0.08 0.32 0.18 1.20 0.00 0.00 173.24 174.82 5req n LEU 657 N 4.80 0.63 -1.02 3.45 4.32 -1.26 -2.42 117.00 125.49 5req n LEU 657 Ca -0.16 -0.70 0.10 0.00 -0.02 0.00 0.00 56.01 55.23 5req n LEU 657 Cb 0.49 0.00 0.26 0.00 -1.62 0.00 0.00 43.42 42.56 5req n LEU 657 CO 0.20 0.16 0.72 0.00 -1.22 0.00 0.00 177.39 177.25 5req n ALA 658 N -0.13 2.42 -0.63 -1.18 0.00 -1.26 -4.78 120.51 114.95 5req n ALA 658 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.49 5req n ALA 658 Cb 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.54 5req n ALA 658 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5req n GLY 659 N 1.40 0.74 1.76 0.00 0.00 -1.26 -4.39 105.19 103.45 5req n GLY 659 Ca 0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.29 5req n GLY 659 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5req n GLY 660 N -2.35 2.98 0.21 -0.02 0.00 -1.26 -4.69 105.19 100.06 5req n GLY 660 Ca 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 5req n GLY 660 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 5req h HIS 661 N 3.94 -0.42 -0.53 1.61 2.07 -1.93 -2.67 115.15 117.23 5req h HIS 661 Ca 0.00 0.02 0.15 0.00 -2.85 0.00 0.00 60.37 57.69 5req h HIS 661 Cb 1.81 0.20 -0.02 0.00 2.57 0.00 0.00 27.41 31.97 5req h HIS 661 CO 0.98 -0.24 0.47 -0.07 -3.07 0.00 0.00 177.93 176.00 5req h LEU 662 N -0.22 0.00 0.02 6.12 3.38 -1.96 0.48 115.31 123.13 5req h LEU 662 Ca 0.09 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.70 5req h LEU 662 Cb 0.34 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 5req h LEU 662 CO -0.23 0.00 -2.16 0.35 0.09 0.00 0.00 178.44 176.49 5req n THR 663 N -3.97 1.55 -0.02 0.22 -2.24 -1.20 -4.60 114.28 104.02 5req n THR 663 Ca 0.10 -0.74 -0.17 0.00 -2.27 0.00 0.00 64.05 60.97 5req n THR 663 Cb 0.68 -1.08 -0.08 0.00 -2.10 0.00 0.00 70.33 67.75 5req n THR 663 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 5req h LEU 664 N 0.01 0.80 -0.66 3.22 3.38 -0.93 -3.23 115.31 117.90 5req h LEU 664 Ca -0.46 -0.65 -0.12 0.00 0.09 0.00 0.00 57.88 56.75 5req h LEU 664 Cb 2.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.56 5req h LEU 664 CO 0.03 1.32 -0.20 0.58 0.09 0.00 0.00 178.44 180.25 5req h VAL 665 N 0.34 1.27 -0.09 1.22 2.07 -1.20 -2.33 116.25 117.52 5req h VAL 665 Ca -0.05 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 5req h VAL 665 Cb 1.31 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 32.24 5req h VAL 665 CO 0.14 0.45 0.02 1.55 0.02 0.00 0.00 177.57 179.74 5req h PRO 666 N 0.73 0.15 -0.39 1.57 0.13 -1.75 -2.53 132.00 129.92 5req h PRO 666 Ca 0.10 -0.04 0.07 0.00 -0.87 0.00 0.00 66.00 65.27 5req h PRO 666 Cb 0.72 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.77 5req h PRO 666 CO 0.06 0.35 -0.00 0.00 -0.23 0.00 0.00 178.00 178.17 5req h ALA 667 N 0.80 0.35 -0.35 -0.56 0.00 -1.57 -1.69 119.26 116.24 5req h ALA 667 Ca 0.03 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.11 5req h ALA 667 Cb 0.27 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 5req h ALA 667 CO 0.00 -0.40 0.06 1.25 0.00 0.00 0.00 179.25 180.16 5req h LEU 668 N 0.10 -0.01 -0.27 0.00 6.46 -1.34 -0.74 115.31 119.51 5req h LEU 668 Ca 0.19 0.06 0.06 0.00 -0.12 0.00 0.00 57.88 58.07 5req h LEU 668 Cb 0.27 0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 40.23 5req h LEU 668 CO -0.32 0.03 -0.08 -0.09 -0.62 0.00 0.00 178.44 177.36 5req h ARG 669 N 0.18 -0.01 -0.64 1.25 9.65 -1.05 -1.78 114.38 121.97 5req h ARG 669 Ca 0.17 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.98 5req h ARG 669 Cb 0.20 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.76 5req h ARG 669 CO -0.23 -0.01 0.13 0.87 2.80 0.00 0.00 179.97 183.53 5req h LYS 670 N -0.01 1.02 -0.48 0.20 1.57 -1.07 -2.14 116.57 115.66 5req h LYS 670 Ca 0.13 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 5req h LYS 670 Cb 0.21 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 5req h LYS 670 CO -0.29 0.93 0.17 0.93 -0.57 0.00 0.00 179.45 180.62 5req h GLU 671 N 0.97 0.72 -0.07 3.15 4.39 -0.94 0.13 114.58 122.93 5req h GLU 671 Ca 0.20 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 5req h GLU 671 Cb 0.38 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.92 5req h GLU 671 CO 0.01 0.67 0.04 -0.07 -1.16 0.00 0.00 179.01 178.49 5req h LEU 672 N 0.63 0.10 -0.40 1.33 3.38 -1.21 -2.50 115.31 116.63 5req h LEU 672 Ca 0.16 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.11 5req h LEU 672 Cb 0.23 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.88 5req h LEU 672 CO -0.01 0.16 -0.09 0.44 0.09 0.00 0.00 178.44 179.03 5req h ASP 673 N 0.02 -0.36 -0.71 -0.43 5.19 -1.33 -1.47 116.42 117.33 5req h ASP 673 Ca 0.03 0.12 0.13 0.00 -0.62 0.00 0.00 57.03 56.69 5req h ASP 673 Cb 0.09 0.25 -0.05 0.00 0.18 0.00 0.00 39.33 39.80 5req h ASP 673 CO -0.00 -0.13 0.47 0.50 -3.12 0.00 0.00 179.24 176.96 5req h LYS 674 N 0.01 0.41 -0.06 3.56 3.64 -0.78 -1.09 116.57 122.25 5req h LYS 674 Ca 0.19 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 5req h LYS 674 Cb 0.30 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 5req h LYS 674 CO -0.41 0.27 0.00 1.28 -2.27 0.00 0.00 179.45 178.32 5req n LEU 675 N -4.47 0.59 0.00 5.20 4.77 -0.96 -4.94 117.00 117.20 5req n LEU 675 Ca 0.13 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 5req n LEU 675 Cb 0.48 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 5req n LEU 675 CO 0.33 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 5req n GLY 676 N 0.92 0.81 2.76 -0.72 0.00 -0.41 -5.05 105.19 103.49 5req n GLY 676 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 5req n GLY 676 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 5req s ARG 677 N -0.64 1.29 0.00 1.61 1.81 -0.58 -4.91 118.95 117.53 5req s ARG 677 Ca 0.00 -1.93 0.26 0.00 -1.72 0.00 0.00 55.73 52.34 5req s ARG 677 Cb 0.00 -2.45 0.70 0.00 -0.45 0.00 0.00 34.95 32.75 5req s ARG 677 CO 0.00 -1.12 1.54 -0.35 -0.68 0.00 0.00 175.30 174.69 5req n PRO 678 N 3.73 1.61 0.05 3.54 -0.04 -1.26 -3.55 135.00 139.08 5req n PRO 678 Ca 0.06 -1.10 -0.12 0.00 -0.04 0.00 0.00 63.50 62.31 5req n PRO 678 Cb 0.36 -1.48 -0.13 0.00 -0.04 0.00 0.00 33.50 32.20 5req n PRO 678 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 5req h ASP 679 N 2.68 0.19 -2.76 3.54 2.03 -1.96 -3.45 116.42 116.69 5req h ASP 679 Ca 0.00 -0.26 -0.57 0.00 -0.73 0.00 0.00 57.03 55.48 5req h ASP 679 Cb 0.64 -0.06 -0.03 0.00 -0.83 0.00 0.00 39.33 39.05 5req h ASP 679 CO 0.00 1.21 1.15 -0.63 -1.03 0.00 0.00 179.24 179.94 5req s ILE 680 N -2.65 3.66 0.80 4.15 1.01 -1.23 -4.91 121.20 122.04 5req s ILE 680 Ca -0.05 0.73 -0.12 0.00 0.00 0.00 0.00 60.65 61.22 5req s ILE 680 Cb 0.08 -3.70 0.07 0.00 0.01 0.00 0.00 42.46 38.92 5req s ILE 680 CO 0.84 -0.32 1.14 -0.76 0.00 0.00 0.00 174.94 175.84 5req s LEU 681 N 5.45 2.51 -0.07 2.97 1.43 -0.43 -4.85 118.68 125.69 5req s LEU 681 Ca 0.73 0.96 0.03 0.00 -1.03 0.00 0.00 54.13 54.81 5req s LEU 681 Cb -0.24 -3.50 0.01 0.00 0.03 0.00 0.00 46.19 42.48 5req s LEU 681 CO 0.30 -1.91 -0.14 -0.63 0.23 0.00 0.00 176.35 174.20 5req s ILE 682 N -3.42 1.29 0.12 -0.59 1.01 -1.26 -0.91 121.20 117.44 5req s ILE 682 Ca 0.61 -0.57 0.09 0.00 0.00 0.00 0.00 60.65 60.78 5req s ILE 682 Cb -0.12 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 5req s ILE 682 CO 0.51 0.39 -0.17 0.42 0.00 0.00 0.00 174.94 176.09 5req s THR 683 N 0.60 2.89 -0.08 2.92 -4.23 -0.24 -0.15 115.64 117.35 5req s THR 683 Ca -0.15 -1.49 0.04 0.00 -1.18 0.00 0.00 61.69 58.90 5req s THR 683 Cb -0.16 -2.33 -0.00 0.00 1.34 0.00 0.00 72.50 71.34 5req s THR 683 CO 0.05 0.09 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.32 5req s VAL 684 N -1.17 1.81 0.15 2.29 1.01 -0.25 -1.05 120.40 123.19 5req s VAL 684 Ca 0.18 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.31 5req s VAL 684 Cb -0.11 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 5req s VAL 684 CO 0.11 0.51 -0.08 -0.83 0.00 0.00 0.00 175.10 174.80 5req s GLY 685 N 0.25 1.11 0.00 4.51 0.00 0.05 -0.87 107.32 112.36 5req s GLY 685 Ca -0.13 -1.52 0.00 0.00 0.00 0.00 0.00 44.72 43.07 5req s GLY 685 CO 0.06 -1.59 0.00 0.61 0.00 0.00 0.00 173.10 172.19 5req n GLY 686 N -0.21 0.54 3.44 0.20 0.00 -0.71 -0.04 105.19 108.42 5req n GLY 686 Ca -0.10 -1.96 -0.44 0.00 0.00 0.00 0.00 46.02 43.53 5req n GLY 686 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5req s VAL 687 N -1.46 4.63 -0.22 1.61 1.01 -1.02 -3.92 120.40 121.04 5req s VAL 687 Ca 0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 61.98 60.76 5req s VAL 687 Cb 0.00 -4.73 0.06 0.00 0.00 0.00 0.00 36.38 31.71 5req s VAL 687 CO 0.00 -1.46 -0.00 -0.63 0.00 0.00 0.00 175.10 173.01 5req s ILE 688 N 3.04 1.03 0.57 2.22 1.01 -1.26 -4.71 121.20 123.10 5req s ILE 688 Ca 0.28 -0.94 -0.20 0.00 0.00 0.00 0.00 60.65 59.79 5req s ILE 688 Cb -0.10 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.88 5req s ILE 688 CO -0.03 -0.20 1.10 -2.65 0.00 0.00 0.00 174.94 173.16 5req n PRO 689 N 4.85 1.16 0.24 2.79 -0.02 -1.26 -4.91 135.00 137.86 5req n PRO 689 Ca -0.10 0.44 0.07 0.00 -2.02 0.00 0.00 63.50 61.90 5req n PRO 689 Cb 0.45 -2.29 0.60 0.00 -0.02 0.00 0.00 33.50 32.24 5req n PRO 689 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 5req h GLU 690 N 0.84 0.00 0.00 -0.52 4.57 -1.96 -2.84 114.58 114.66 5req h GLU 690 Ca -0.49 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.69 5req h GLU 690 Cb 1.34 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.93 5req h GLU 690 CO 0.53 0.10 -0.00 1.96 -1.18 0.00 0.00 179.01 180.42 5req h GLN 691 N 0.00 0.00 -0.26 1.92 7.50 -1.97 -2.92 115.11 119.38 5req h GLN 691 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 5req h GLN 691 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.71 5req h GLN 691 CO 0.01 0.00 0.00 -0.25 -1.50 0.00 0.00 178.83 177.09 5req n ASP 692 N -3.66 2.77 0.09 1.46 8.00 -1.07 -4.59 116.55 119.54 5req n ASP 692 Ca -0.03 -1.89 -0.07 0.00 0.71 0.00 0.00 54.79 53.51 5req n ASP 692 Cb 0.08 -0.16 0.04 0.00 -0.02 0.00 0.00 41.12 41.06 5req n ASP 692 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 5req h PHE 693 N 3.73 0.24 -0.19 1.24 -1.00 -1.65 -2.80 116.94 116.51 5req h PHE 693 Ca 0.00 -0.12 -0.09 0.00 2.81 0.00 0.00 57.97 60.57 5req h PHE 693 Cb 0.82 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 40.34 5req h PHE 693 CO 0.16 0.88 -0.23 -0.44 -1.61 0.00 0.00 178.31 177.07 5req h ASP 694 N 0.10 0.53 -0.51 2.17 5.19 -1.81 -2.67 116.42 119.43 5req h ASP 694 Ca -0.03 -0.50 -0.05 0.00 -0.62 0.00 0.00 57.03 55.83 5req h ASP 694 Cb 1.37 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.71 5req h ASP 694 CO 0.12 0.92 0.11 -0.08 -3.12 0.00 0.00 179.24 177.19 5req h GLU 695 N 0.14 0.82 -0.80 3.56 4.81 -1.88 -2.99 114.58 118.24 5req h GLU 695 Ca 0.02 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.02 5req h GLU 695 Cb 0.79 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.03 5req h GLU 695 CO 0.06 0.79 0.36 -0.07 -0.73 0.00 0.00 179.01 179.42 5req h LEU 696 N 0.70 1.06 -1.24 1.64 3.38 -1.53 -1.66 115.31 117.67 5req h LEU 696 Ca 0.16 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 5req h LEU 696 Cb 0.35 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 5req h LEU 696 CO 0.00 0.91 -0.28 0.03 0.09 0.00 0.00 178.44 179.20 5req h ARG 697 N 1.15 0.16 0.00 1.13 3.08 -1.39 -1.62 114.38 116.89 5req h ARG 697 Ca 0.27 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.27 5req h ARG 697 Cb 0.15 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.18 5req h ARG 697 CO -0.03 0.43 -0.16 0.87 -1.07 0.00 0.00 179.97 180.02 5req h LYS 698 N 0.15 0.00 0.00 0.04 1.79 -1.38 -3.23 116.57 113.94 5req h LYS 698 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 5req h LYS 698 Cb 0.57 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.22 5req h LYS 698 CO 0.04 0.00 -0.25 -0.25 -1.08 0.00 0.00 179.45 177.92 5req n ASP 699 N -2.51 0.77 0.00 0.86 8.00 -0.64 -4.95 116.55 118.08 5req n ASP 699 Ca 0.04 0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.94 5req n ASP 699 Cb 0.47 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 5req n ASP 699 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 5req n GLY 700 N 1.32 1.61 3.65 0.44 0.00 -0.96 -4.29 105.19 106.97 5req n GLY 700 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 5req n GLY 700 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5req n ALA 701 N 0.00 1.62 0.02 4.61 0.00 -0.66 -4.19 120.51 121.91 5req n ALA 701 Ca 0.00 0.14 -0.07 0.00 0.00 0.00 0.00 53.44 53.51 5req n ALA 701 Cb 0.00 -2.73 -0.12 0.00 0.00 0.00 0.00 19.45 16.60 5req n ALA 701 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 5req h VAL 702 N 5.88 1.13 -3.89 0.00 -1.51 -0.88 -3.38 116.25 113.60 5req h VAL 702 Ca -0.49 -2.88 -0.29 0.00 -1.23 0.00 0.00 66.70 61.82 5req h VAL 702 Cb 1.24 2.54 -0.26 0.00 -2.13 0.00 0.00 31.29 32.68 5req h VAL 702 CO 0.94 0.64 -0.74 -1.61 -1.23 0.00 0.00 177.57 175.58 5req s GLU 703 N -2.68 0.36 -0.18 5.19 0.41 -1.26 -5.06 118.70 115.47 5req s GLU 703 Ca -0.02 -0.30 0.01 0.00 -0.41 0.00 0.00 54.97 54.25 5req s GLU 703 Cb 0.09 -0.27 0.02 0.00 -1.78 0.00 0.00 34.13 32.19 5req s GLU 703 CO 0.82 0.07 -0.19 0.42 -0.49 0.00 0.00 175.26 175.88 5req s ILE 704 N -0.45 2.03 -0.26 -1.63 1.01 -1.26 -1.09 121.20 119.55 5req s ILE 704 Ca -0.02 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 5req s ILE 704 Cb -0.04 -1.85 0.04 0.00 0.01 0.00 0.00 42.46 40.61 5req s ILE 704 CO -0.00 0.50 -0.06 -0.31 0.00 0.00 0.00 174.94 175.07 5req s TYR 705 N 1.30 3.12 0.52 3.97 2.02 -0.05 -5.00 117.35 123.22 5req s TYR 705 Ca 0.04 -1.72 0.09 0.00 -0.37 0.00 0.00 57.07 55.11 5req s TYR 705 Cb -0.13 -2.05 0.05 0.00 -0.40 0.00 0.00 41.96 39.43 5req s TYR 705 CO -0.12 -0.77 0.65 0.95 -1.57 0.00 0.00 175.55 174.69 5req s THR 706 N 1.28 2.34 0.27 -0.71 -4.23 -1.26 -1.74 115.64 111.60 5req s THR 706 Ca -0.02 -1.09 -0.29 0.00 -1.18 0.00 0.00 61.69 59.11 5req s THR 706 Cb -0.18 -2.43 -0.14 0.00 1.34 0.00 0.00 72.50 71.09 5req s THR 706 CO -0.04 0.00 1.15 -2.65 -0.54 0.00 0.00 174.62 172.54 5req n PRO 707 N -2.03 1.58 -0.01 3.99 -0.02 -1.25 -2.10 135.00 135.17 5req n PRO 707 Ca 0.11 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 5req n PRO 707 Cb 0.61 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 5req n PRO 707 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 5req n GLY 708 N 1.40 0.33 3.66 -1.23 0.00 -1.26 -4.78 105.19 103.32 5req n GLY 708 Ca 0.10 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.65 5req n GLY 708 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 5req n THR 709 N -2.00 0.06 -2.76 2.61 -1.04 -0.89 -4.95 114.28 105.31 5req n THR 709 Ca 0.00 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 5req n THR 709 Cb 0.00 -1.49 -0.03 0.00 -1.82 0.00 0.00 70.33 66.99 5req n THR 709 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 5req s VAL 710 N 1.17 4.86 0.13 12.58 1.01 -1.26 -4.97 120.40 133.93 5req s VAL 710 Ca 0.81 1.94 -0.26 0.00 0.00 0.00 0.00 61.98 64.47 5req s VAL 710 Cb -0.71 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 31.37 5req s VAL 710 CO 0.40 0.10 1.61 0.40 0.00 0.00 0.00 175.10 177.62 5req h ILE 711 N 4.93 0.30 -0.43 2.22 2.04 -1.94 -2.52 117.51 122.12 5req h ILE 711 Ca -0.36 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.51 5req h ILE 711 Cb 1.18 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 5req h ILE 711 CO 0.79 0.00 0.29 1.55 0.00 0.00 0.00 178.15 180.78 5req h PRO 712 N -0.40 0.53 -0.55 2.37 0.13 -1.93 -1.86 132.00 130.29 5req h PRO 712 Ca 0.09 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 65.16 5req h PRO 712 Cb 0.54 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 5req h PRO 712 CO -0.33 0.35 0.22 0.93 -0.23 0.00 0.00 178.00 178.94 5req h GLU 713 N 0.55 0.82 -0.57 0.86 5.08 -1.78 -2.40 114.58 117.13 5req h GLU 713 Ca 0.16 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 5req h GLU 713 Cb -0.01 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 5req h GLU 713 CO -0.04 0.71 -0.08 0.66 -1.00 0.00 0.00 179.01 179.26 5req h SER 714 N 0.74 1.05 -0.03 1.42 4.64 -0.97 -2.35 113.55 118.05 5req h SER 714 Ca 0.18 -0.34 0.04 0.00 -0.47 0.00 0.00 61.79 61.20 5req h SER 714 Cb 0.20 -0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 61.95 5req h SER 714 CO -0.02 1.14 -0.27 0.00 -0.87 0.00 0.00 176.83 176.81 5req h ALA 715 N 0.95 -0.34 -0.45 5.18 0.00 -1.24 0.68 119.26 124.04 5req h ALA 715 Ca 0.15 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.16 5req h ALA 715 Cb 0.65 0.49 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 5req h ALA 715 CO 0.04 -0.76 -0.19 0.82 0.00 0.00 0.00 179.25 179.16 5req h ILE 716 N -0.39 0.41 0.00 0.00 2.04 -1.36 0.16 117.51 118.37 5req h ILE 716 Ca 0.07 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.80 5req h ILE 716 Cb 0.49 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 5req h ILE 716 CO -0.26 0.00 -0.62 0.77 0.00 0.00 0.00 178.15 178.04 5req h SER 717 N -0.10 0.00 -0.21 1.72 4.64 -1.27 -2.56 113.55 115.78 5req h SER 717 Ca 0.22 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.33 5req h SER 717 Cb 0.43 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.52 5req h SER 717 CO -0.51 0.62 -0.67 0.25 -0.87 0.00 0.00 176.83 175.64 5req h LEU 718 N 0.00 0.96 -0.19 5.97 5.85 -0.26 -2.21 115.31 125.43 5req h LEU 718 Ca -0.01 -0.57 -0.02 0.00 0.84 0.00 0.00 57.88 58.12 5req h LEU 718 Cb 1.20 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 5req h LEU 718 CO 0.08 1.38 0.03 0.58 -0.34 0.00 0.00 178.44 180.17 5req h VAL 719 N 0.60 1.22 -0.63 1.05 2.07 -0.73 -0.28 116.25 119.56 5req h VAL 719 Ca -0.02 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 66.87 5req h VAL 719 Cb 1.29 1.33 -0.07 0.00 -1.52 0.00 0.00 31.29 32.32 5req h VAL 719 CO 0.14 0.22 0.25 0.11 0.02 0.00 0.00 177.57 178.31 5req h LYS 720 N 0.11 0.43 -0.71 1.57 1.57 -1.51 0.13 116.57 118.16 5req h LYS 720 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 5req h LYS 720 Cb 0.30 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 5req h LYS 720 CO 0.00 0.28 0.41 -0.22 -0.57 0.00 0.00 179.45 179.36 5req h LYS 721 N 0.44 0.97 -0.10 3.15 1.63 -1.31 -2.07 116.57 119.29 5req h LYS 721 Ca 0.31 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 60.01 5req h LYS 721 Cb 0.38 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.81 5req h LYS 721 CO -0.30 0.71 0.05 -0.07 -3.45 0.00 0.00 179.45 176.39 5req h LEU 722 N 0.97 0.13 0.05 5.20 3.38 -0.22 -2.41 115.31 122.40 5req h LEU 722 Ca 0.25 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.13 5req h LEU 722 Cb -0.00 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 5req h LEU 722 CO -0.04 0.20 -0.40 0.03 0.09 0.00 0.00 178.44 178.32 5req h ARG 723 N 0.04 -0.57 -1.00 1.13 2.47 -0.61 -2.23 114.38 113.61 5req h ARG 723 Ca 0.03 0.04 0.07 0.00 -1.26 0.00 0.00 59.98 58.86 5req h ARG 723 Cb 0.11 0.13 -0.07 0.00 -1.65 0.00 0.00 29.97 28.49 5req h ARG 723 CO -0.00 -0.38 0.64 0.00 0.56 0.00 0.00 179.97 180.79 5req h ALA 724 N -0.04 1.39 0.00 0.04 0.00 -1.41 -1.04 119.26 118.21 5req h ALA 724 Ca 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 5req h ALA 724 Cb 0.65 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.14 5req h ALA 724 CO -0.28 0.43 -0.00 1.03 0.00 0.00 0.00 179.25 180.43 5req h SER 725 N 1.16 -0.00 0.26 0.00 0.87 -1.21 -3.17 113.55 111.46 5req h SER 725 Ca 0.43 -0.29 -0.14 0.00 -1.23 0.00 0.00 61.79 60.57 5req h SER 725 Cb 0.18 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 5req h SER 725 CO -0.18 0.29 -0.53 -0.07 -0.53 0.00 0.00 176.83 175.81 5req h LEU 726 N -0.29 0.32 -3.69 2.23 3.38 -1.25 -3.28 115.31 112.72 5req h LEU 726 Ca -0.00 -0.17 -0.20 0.00 0.09 0.00 0.00 57.88 57.60 5req h LEU 726 Cb 0.29 -0.09 -0.12 0.00 0.09 0.00 0.00 40.66 40.83 5req h LEU 726 CO 0.00 0.80 0.24 0.47 0.09 0.00 0.00 178.44 180.03 5req n ASP 727 N -3.94 4.66 -0.70 -0.43 8.00 -0.41 -5.10 116.55 118.63 5req n ASP 727 Ca -0.02 -3.25 0.09 0.00 0.71 0.00 0.00 54.79 52.32 5req n ASP 727 Cb 0.57 -0.73 0.07 0.00 -0.02 0.00 0.00 41.12 41.01 5req n ASP 727 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81