#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a9s s LYS 3 N 0.00 4.56 -0.05 0.00 2.47 -1.26 -0.61 119.74 124.85 3a9s s LYS 3 Ca 0.00 1.88 -0.30 0.00 -1.56 0.00 0.00 55.97 55.99 3a9s s LYS 3 Cb 0.00 -3.19 -0.04 0.00 -1.46 0.00 0.00 37.83 33.15 3a9s s LYS 3 CO 0.00 0.08 1.25 0.34 0.16 0.00 0.00 175.35 177.18 3a9s s ASP 4 N -0.56 7.00 0.34 1.43 -1.08 -0.81 -4.68 116.67 118.31 3a9s s ASP 4 Ca 0.47 1.87 0.26 0.00 -0.52 0.00 0.00 52.55 54.64 3a9s s ASP 4 Cb -0.33 -2.56 1.14 0.00 -1.46 0.00 0.00 42.92 39.71 3a9s s ASP 4 CO 0.42 -0.63 1.79 1.55 0.52 0.00 0.00 175.17 178.82 3a9s h PRO 5 N 7.61 0.00 0.00 4.34 0.13 -1.93 -3.33 132.00 138.81 3a9s h PRO 5 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3a9s h PRO 5 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3a9s h PRO 5 CO 0.89 0.00 -0.98 0.54 -0.23 0.00 0.00 178.00 178.23 3a9s n ARG 6 N -2.45 3.67 -4.25 0.86 1.74 -1.26 -5.09 116.66 109.89 3a9s n ARG 6 Ca 0.01 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.86 3a9s n ARG 6 Cb 0.22 -0.99 -0.07 0.00 -1.02 0.00 0.00 32.46 30.60 3a9s n ARG 6 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3a9s s TYR 7 N -1.98 2.70 0.41 -1.55 1.51 -1.25 -4.90 117.35 112.29 3a9s s TYR 7 Ca 0.00 -0.27 -0.27 0.00 -1.01 0.00 0.00 57.07 55.52 3a9s s TYR 7 Cb 0.00 -1.32 -0.10 0.00 -0.11 0.00 0.00 41.96 40.43 3a9s s TYR 7 CO 0.00 0.54 1.46 0.28 -1.11 0.00 0.00 175.55 176.72 3a9s n VAL 8 N -0.97 2.36 -2.68 0.71 0.31 -1.26 -4.46 118.33 112.34 3a9s n VAL 8 Ca -0.06 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 3a9s n VAL 8 Cb 0.60 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 3a9s n VAL 8 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a9s n GLY 9 N 0.52 -1.95 3.77 2.92 0.00 -1.26 -4.91 105.19 104.27 3a9s n GLY 9 Ca 0.03 -1.63 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 3a9s n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a9s s ASN 10 N -4.00 5.24 0.40 1.61 0.01 -1.26 -1.92 114.94 115.02 3a9s s ASN 10 Ca 0.00 -0.36 -0.25 0.00 -0.71 0.00 0.00 52.86 51.53 3a9s s ASN 10 Cb 0.00 -1.24 -0.08 0.00 0.41 0.00 0.00 41.25 40.33 3a9s s ASN 10 CO 0.00 -0.02 1.20 -0.76 -1.51 0.00 0.00 177.10 176.00 3a9s s LEU 11 N -3.76 4.21 0.43 0.60 1.43 0.22 -4.71 118.68 117.10 3a9s s LEU 11 Ca 0.32 2.41 -0.25 0.00 -1.03 0.00 0.00 54.13 55.58 3a9s s LEU 11 Cb -0.08 -3.99 -0.09 0.00 0.03 0.00 0.00 46.19 42.07 3a9s s LEU 11 CO 0.23 -0.70 1.36 -2.65 0.23 0.00 0.00 176.35 174.82 3a9s n PRO 12 N 0.11 2.11 -4.11 1.29 -0.02 -1.26 -4.60 135.00 128.53 3a9s n PRO 12 Ca 0.04 0.75 -0.23 0.00 -2.02 0.00 0.00 63.50 62.05 3a9s n PRO 12 Cb 0.46 -2.51 -0.06 0.00 -0.02 0.00 0.00 33.50 31.37 3a9s n PRO 12 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3a9s s LYS 13 N -2.31 2.51 -0.20 -0.52 1.02 -0.88 -4.64 119.74 114.72 3a9s s LYS 13 Ca 0.61 -1.38 -0.05 0.00 0.02 0.00 0.00 55.97 55.17 3a9s s LYS 13 Cb -0.48 -2.29 -0.02 0.00 -0.52 0.00 0.00 37.83 34.52 3a9s s LYS 13 CO 0.58 0.23 -0.01 0.42 -0.92 0.00 0.00 175.35 175.65 3a9s s ILE 14 N -2.33 3.89 -0.14 2.17 1.01 -0.45 -0.47 121.20 124.88 3a9s s ILE 14 Ca 0.36 -0.34 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 3a9s s ILE 14 Cb -0.05 -2.75 -0.05 0.00 0.01 0.00 0.00 42.46 39.62 3a9s s ILE 14 CO 0.23 0.43 0.25 -0.83 0.00 0.00 0.00 174.94 175.02 3a9s s GLY 15 N 0.98 2.21 -0.21 6.18 0.00 0.85 -0.32 107.32 117.01 3a9s s GLY 15 Ca 0.01 -0.50 -0.05 0.00 0.00 0.00 0.00 44.72 44.19 3a9s s GLY 15 CO 0.02 0.19 -0.01 -0.42 0.00 0.00 0.00 173.10 172.87 3a9s s ILE 16 N -0.04 3.77 -0.43 0.90 -1.09 0.88 -0.64 121.20 124.55 3a9s s ILE 16 Ca 0.16 -0.37 -0.09 0.00 -2.23 0.00 0.00 60.65 58.12 3a9s s ILE 16 Cb -0.13 -2.71 0.09 0.00 -1.58 0.00 0.00 42.46 38.14 3a9s s ILE 16 CO 0.04 0.42 0.28 -0.13 -1.23 0.00 0.00 174.94 174.32 3a9s s ARG 17 N 1.16 2.53 -0.62 2.79 0.52 0.78 -2.23 118.95 123.88 3a9s s ARG 17 Ca 0.03 -1.57 -0.25 0.00 -0.52 0.00 0.00 55.73 53.41 3a9s s ARG 17 Cb -0.14 -3.81 0.04 0.00 0.52 0.00 0.00 34.95 31.56 3a9s s ARG 17 CO 0.01 -1.03 1.06 -2.14 0.02 0.00 0.00 175.30 173.21 3a9s s PRO 18 N 1.39 3.28 0.22 3.54 0.02 -1.26 -0.87 135.00 141.31 3a9s s PRO 18 Ca 0.04 -0.31 -0.09 0.00 0.02 0.00 0.00 61.00 60.66 3a9s s PRO 18 Cb -0.24 -4.11 -0.07 0.00 0.02 0.00 0.00 34.50 30.10 3a9s s PRO 18 CO 0.01 -1.73 0.53 0.95 -0.33 0.00 0.00 177.00 176.42 3a9s s THR 19 N 4.51 4.96 0.15 0.99 -4.23 -0.42 0.54 115.64 122.14 3a9s s THR 19 Ca 0.31 0.43 -0.07 0.00 -1.18 0.00 0.00 61.69 61.18 3a9s s THR 19 Cb -0.12 -3.62 -0.01 0.00 1.34 0.00 0.00 72.50 70.09 3a9s s THR 19 CO 0.17 -0.05 0.23 -0.51 -0.54 0.00 0.00 174.62 173.92 3a9s s ILE 20 N -1.79 0.08 0.11 2.99 2.07 0.40 -4.56 121.20 120.50 3a9s s ILE 20 Ca 0.46 -1.47 -0.31 0.00 -1.41 0.00 0.00 60.65 57.93 3a9s s ILE 20 Cb -0.11 -1.83 -0.07 0.00 0.13 0.00 0.00 42.46 40.57 3a9s s ILE 20 CO 0.21 -0.36 1.33 -0.62 -1.91 0.00 0.00 174.94 173.60 3a9s s ASP 21 N -2.97 6.90 0.31 4.50 -1.08 -1.09 -4.02 116.67 119.21 3a9s s ASP 21 Ca 0.17 2.25 0.26 0.00 -0.52 0.00 0.00 52.55 54.71 3a9s s ASP 21 Cb 0.04 -2.59 0.96 0.00 -1.46 0.00 0.00 42.92 39.87 3a9s s ASP 21 CO -0.01 -0.60 1.77 1.23 0.52 0.00 0.00 175.17 178.09 3a9s h GLY 22 N 6.72 0.00 -4.94 2.66 0.00 -1.86 -3.38 103.07 102.27 3a9s h GLY 22 Ca -0.42 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.38 3a9s h GLY 22 CO 0.84 0.00 1.02 0.50 0.00 0.00 0.00 176.54 178.91 3a9s s ARG 23 N -3.32 4.18 0.00 4.80 0.52 -1.26 -4.87 118.95 119.00 3a9s s ARG 23 Ca 0.06 2.40 0.00 0.00 -0.52 0.00 0.00 55.73 57.67 3a9s s ARG 23 Cb 0.10 -3.57 0.00 0.00 0.52 0.00 0.00 34.95 31.99 3a9s s ARG 23 CO 0.49 -0.76 0.00 0.54 0.02 0.00 0.00 175.30 175.60 3a9s n ARG 24 N 5.54 3.49 -1.76 3.54 1.74 -1.26 -0.35 116.66 127.60 3a9s n ARG 24 Ca 0.16 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 57.04 3a9s n ARG 24 Cb 0.40 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.77 3a9s n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3a9s n LYS 25 N 0.00 -1.43 0.00 5.56 4.76 -1.26 -3.28 118.16 122.51 3a9s n LYS 25 Ca 0.00 1.14 0.00 0.00 -2.87 0.00 0.00 58.31 56.58 3a9s n LYS 25 Cb 0.00 -5.55 0.00 0.00 -1.84 0.00 0.00 35.03 27.64 3a9s n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a9s n GLY 26 N -0.65 3.66 0.16 0.72 0.00 -1.26 -5.01 105.19 102.80 3a9s n GLY 26 Ca -0.21 -0.94 -0.06 0.00 0.00 0.00 0.00 46.02 44.81 3a9s n GLY 26 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3a9s h VAL 27 N 0.00 0.00 -0.71 1.61 2.07 -1.67 -2.63 116.25 114.92 3a9s h VAL 27 Ca 0.00 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.54 3a9s h VAL 27 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 3a9s h VAL 27 CO 0.00 0.00 0.42 -0.09 0.02 0.00 0.00 177.57 177.92 3a9s h ARG 28 N -0.43 0.75 -0.98 1.57 2.43 -0.88 -2.15 114.38 114.69 3a9s h ARG 28 Ca -0.04 -0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.23 3a9s h ARG 28 Cb 0.30 -0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 29.60 3a9s h ARG 28 CO 0.07 0.50 0.62 0.93 -1.51 0.00 0.00 179.97 180.57 3a9s h GLU 29 N 0.78 0.84 -0.00 0.20 3.07 -1.81 -0.56 114.58 117.09 3a9s h GLU 29 Ca 0.31 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 3a9s h GLU 29 Cb 0.15 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 3a9s h GLU 29 CO -0.17 0.55 -0.02 -1.13 -1.40 0.00 0.00 179.01 176.85 3a9s n SER 30 N -4.64 0.04 -0.00 1.42 3.41 -0.82 -4.03 113.62 108.99 3a9s n SER 30 Ca 0.20 0.08 0.03 0.00 -0.26 0.00 0.00 58.87 58.92 3a9s n SER 30 Cb 0.44 -0.34 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 3a9s n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3a9s n LEU 31 N -1.36 0.18 -0.23 1.04 4.77 -0.27 -4.74 117.00 116.39 3a9s n LEU 31 Ca 0.11 -0.31 -0.01 0.00 -0.03 0.00 0.00 56.01 55.78 3a9s n LEU 31 Cb 0.28 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.48 3a9s n LEU 31 CO 0.25 0.05 1.08 -0.33 -1.33 0.00 0.00 177.39 177.11 3a9s h GLU 32 N 0.00 0.64 0.12 3.23 5.08 -1.55 -0.97 114.58 121.13 3a9s h GLU 32 Ca 0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3a9s h GLU 32 Cb 0.20 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3a9s h GLU 32 CO 0.00 0.43 -0.06 1.49 -1.00 0.00 0.00 179.01 179.87 3a9s h GLU 33 N 0.66 -0.15 -0.81 2.33 4.81 -1.85 -1.24 114.58 118.33 3a9s h GLU 33 Ca 0.31 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 3a9s h GLU 33 Cb 0.22 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3a9s h GLU 33 CO -0.20 0.01 0.43 1.15 -0.73 0.00 0.00 179.01 179.67 3a9s h THR 34 N -0.29 1.24 -0.31 0.32 2.02 -1.82 -0.48 112.91 113.58 3a9s h THR 34 Ca -0.02 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.49 3a9s h THR 34 Cb 0.24 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 3a9s h THR 34 CO 0.03 0.27 -0.02 0.74 0.37 0.00 0.00 175.52 176.91 3a9s h THR 35 N 1.14 1.27 -0.29 3.16 2.02 -1.06 -1.88 112.91 117.26 3a9s h THR 35 Ca 0.28 -1.01 -0.08 0.00 0.77 0.00 0.00 66.41 66.37 3a9s h THR 35 Cb 0.05 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 3a9s h THR 35 CO -0.04 0.33 -0.17 0.24 0.37 0.00 0.00 175.52 176.24 3a9s h MET 36 N 0.36 0.52 -0.48 6.66 2.07 -1.04 -2.42 114.93 120.61 3a9s h MET 36 Ca 0.09 -0.17 -0.02 0.00 -2.07 0.00 0.00 59.70 57.52 3a9s h MET 36 Cb 0.48 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 30.14 3a9s h MET 36 CO 0.02 0.68 0.19 -0.91 1.07 0.00 0.00 176.91 177.96 3a9s h ASN 37 N 0.48 0.61 -0.29 1.22 -0.26 -0.81 -0.22 115.58 116.31 3a9s h ASN 37 Ca 0.08 -0.07 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 3a9s h ASN 37 Cb 0.57 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.67 3a9s h ASN 37 CO 0.04 0.56 0.04 0.24 -1.06 0.00 0.00 177.43 177.24 3a9s h MET 38 N 0.68 0.49 -0.60 0.81 2.86 -0.88 -0.68 114.93 117.61 3a9s h MET 38 Ca 0.17 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3a9s h MET 38 Cb 0.13 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 3a9s h MET 38 CO -0.02 0.61 0.38 0.00 1.06 0.00 0.00 176.91 178.94 3a9s h ALA 39 N 0.86 0.77 -0.44 6.32 0.00 -0.98 -1.63 119.26 124.17 3a9s h ALA 39 Ca 0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3a9s h ALA 39 Cb 0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3a9s h ALA 39 CO 0.01 0.13 -0.11 0.87 0.00 0.00 0.00 179.25 180.15 3a9s h LYS 40 N 0.75 0.79 -0.58 0.00 1.57 -0.91 -1.71 116.57 116.47 3a9s h LYS 40 Ca 0.23 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 3a9s h LYS 40 Cb -0.02 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 3a9s h LYS 40 CO -0.08 0.86 0.16 0.00 -0.57 0.00 0.00 179.45 179.83 3a9s h ALA 41 N 1.16 0.77 -0.42 3.86 0.00 -0.65 -0.84 119.26 123.14 3a9s h ALA 41 Ca 0.12 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3a9s h ALA 41 Cb 0.59 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3a9s h ALA 41 CO 0.04 0.45 -0.02 0.28 0.00 0.00 0.00 179.25 180.00 3a9s h VAL 42 N 0.83 1.26 -0.50 0.00 2.07 -1.15 -1.15 116.25 117.62 3a9s h VAL 42 Ca 0.19 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.66 3a9s h VAL 42 Cb 0.31 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3a9s h VAL 42 CO -0.00 0.36 0.30 0.00 0.02 0.00 0.00 177.57 178.25 3a9s h ALA 43 N 0.89 0.64 -0.27 1.67 0.00 -1.07 -0.66 119.26 120.46 3a9s h ALA 43 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3a9s h ALA 43 Cb 0.52 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3a9s h ALA 43 CO 0.03 -0.00 0.16 -0.22 0.00 0.00 0.00 179.25 179.21 3a9s h LYS 44 N 0.59 0.37 -0.37 0.00 3.64 -0.99 -0.87 116.57 118.94 3a9s h LYS 44 Ca 0.20 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 3a9s h LYS 44 Cb 0.03 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3a9s h LYS 44 CO -0.09 0.30 0.18 1.25 -2.27 0.00 0.00 179.45 178.82 3a9s h LEU 45 N 0.33 0.26 -0.61 5.20 5.85 -0.79 -2.19 115.31 123.36 3a9s h LEU 45 Ca 0.10 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.71 3a9s h LEU 45 Cb 0.03 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3a9s h LEU 45 CO -0.02 0.19 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.99 3a9s h LEU 46 N 0.37 0.89 -1.94 2.25 3.38 -0.96 -2.32 115.31 116.98 3a9s h LEU 46 Ca 0.16 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3a9s h LEU 46 Cb 0.07 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3a9s h LEU 46 CO -0.12 1.07 -0.09 -0.33 0.09 0.00 0.00 178.44 179.06 3a9s h GLU 47 N 0.76 0.00 -0.00 1.13 5.08 -0.91 0.25 114.58 120.88 3a9s h GLU 47 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3a9s h GLU 47 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3a9s h GLU 47 CO 0.06 0.09 -0.76 0.39 -1.00 0.00 0.00 179.01 177.80 3a9s n GLU 48 N -3.48 0.04 0.00 2.33 1.02 -0.85 -4.53 120.64 115.18 3a9s n GLU 48 Ca -0.01 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 3a9s n GLU 48 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 3a9s n GLU 48 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3a9s n ASN 49 N -1.45 2.35 -4.20 1.62 3.02 -0.87 -5.03 115.26 110.70 3a9s n ASN 49 Ca 0.05 -0.14 -0.33 0.00 -0.03 0.00 0.00 54.58 54.13 3a9s n ASN 49 Cb 0.34 0.75 -0.16 0.00 -0.61 0.00 0.00 39.78 40.09 3a9s n ASN 49 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3a9s s VAL 50 N -1.22 2.27 0.08 2.41 1.01 0.83 -5.06 120.40 120.72 3a9s s VAL 50 Ca 0.00 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.14 3a9s s VAL 50 Cb 0.00 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 3a9s s VAL 50 CO 0.00 0.54 -0.18 -0.36 0.00 0.00 0.00 175.10 175.09 3a9s s PHE 51 N 0.83 1.59 0.97 5.22 0.40 -1.26 -0.91 117.98 124.81 3a9s s PHE 51 Ca -0.06 -0.42 -0.12 0.00 -0.60 0.00 0.00 56.93 55.73 3a9s s PHE 51 Cb -0.15 -0.89 0.17 0.00 0.51 0.00 0.00 43.02 42.65 3a9s s PHE 51 CO -0.02 0.14 1.10 0.71 0.70 0.00 0.00 175.22 177.85 3a9s s TYR 52 N -1.12 2.20 0.30 0.36 4.12 0.76 -4.85 117.35 119.13 3a9s s TYR 52 Ca 0.04 1.03 0.35 0.00 0.02 0.00 0.00 57.07 58.52 3a9s s TYR 52 Cb -0.10 -3.25 1.90 0.00 -1.52 0.00 0.00 41.96 39.00 3a9s s TYR 52 CO 0.03 -2.72 2.09 0.10 0.02 0.00 0.00 175.55 175.07 3a9s h TYR 53 N -1.77 0.00 -0.63 2.71 -0.00 -1.95 -0.96 116.97 114.36 3a9s h TYR 53 Ca -0.53 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.20 3a9s h TYR 53 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.05 3a9s h TYR 53 CO 0.32 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 178.75 3a9s n ASN 54 N -2.76 3.52 0.00 0.10 6.94 -1.26 -4.87 115.26 116.93 3a9s n ASN 54 Ca -0.02 -2.05 0.00 0.00 -0.02 0.00 0.00 54.58 52.49 3a9s n ASN 54 Cb 0.07 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.05 3a9s n ASN 54 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a9s n GLY 55 N 1.46 1.81 3.76 4.83 0.00 -0.37 -4.98 105.19 111.70 3a9s n GLY 55 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3a9s n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a9s s GLN 56 N -0.43 4.55 0.48 1.61 -0.21 -1.26 -4.74 119.66 119.67 3a9s s GLN 56 Ca 0.00 1.93 -0.23 0.00 0.02 0.00 0.00 55.36 57.08 3a9s s GLN 56 Cb 0.00 -3.15 -0.07 0.00 1.00 0.00 0.00 33.01 30.79 3a9s s GLN 56 CO 0.00 0.09 1.24 -1.25 -2.12 0.00 0.00 175.29 173.25 3a9s s PRO 57 N -1.54 3.57 0.62 2.91 0.04 -1.26 -0.17 135.00 139.17 3a9s s PRO 57 Ca 0.46 1.95 -0.19 0.00 0.04 0.00 0.00 61.00 63.26 3a9s s PRO 57 Cb -0.34 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 3a9s s PRO 57 CO 0.45 -0.75 1.27 1.55 0.04 0.00 0.00 177.00 179.55 3a9s n VAL 58 N -0.61 4.53 -4.31 -0.36 3.14 -0.09 -4.71 118.33 115.92 3a9s n VAL 58 Ca 0.08 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.61 3a9s n VAL 58 Cb 0.47 -1.49 -0.10 0.00 -1.06 0.00 0.00 33.84 31.66 3a9s n VAL 58 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3a9s s GLU 59 N -3.17 3.32 0.16 1.45 2.02 -1.26 -4.58 118.70 116.64 3a9s s GLU 59 Ca 0.79 -0.42 0.08 0.00 0.02 0.00 0.00 54.97 55.44 3a9s s GLU 59 Cb -0.39 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 3a9s s GLU 59 CO 0.43 0.52 -0.06 0.00 0.02 0.00 0.00 175.26 176.18 3a9s s VAL 61 N -1.63 1.23 -0.05 0.00 1.01 0.56 -4.90 120.40 116.62 3a9s s VAL 61 Ca 0.25 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 3a9s s VAL 61 Cb -0.09 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 3a9s s VAL 61 CO 0.16 0.39 0.06 -0.63 0.00 0.00 0.00 175.10 175.09 3a9s s ILE 62 N 1.20 4.71 0.66 2.22 1.01 -1.26 -0.08 121.20 129.66 3a9s s ILE 62 Ca -0.04 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.20 3a9s s ILE 62 Cb -0.14 -3.07 -0.01 0.00 0.01 0.00 0.00 42.46 39.25 3a9s s ILE 62 CO -0.03 0.49 1.08 0.00 0.00 0.00 0.00 174.94 176.48 3a9s n ALA 63 N 1.68 0.37 0.26 9.38 0.00 -0.95 -4.89 120.51 126.36 3a9s n ALA 63 Ca -0.16 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.34 3a9s n ALA 63 Cb 0.53 -2.19 0.65 0.00 0.00 0.00 0.00 19.45 18.44 3a9s n ALA 63 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3a9s h ASP 64 N 0.20 0.00 -5.45 0.00 3.32 -1.94 -3.45 116.42 109.11 3a9s h ASP 64 Ca -0.49 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.38 3a9s h ASP 64 Cb 1.35 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.75 3a9s h ASP 64 CO 0.50 0.13 -0.55 0.42 -1.72 0.00 0.00 179.24 178.02 3a9s s THR 65 N -3.86 0.05 0.64 0.35 -4.23 -1.26 -5.14 115.64 102.19 3a9s s THR 65 Ca -0.01 -1.83 -0.15 0.00 -1.18 0.00 0.00 61.69 58.52 3a9s s THR 65 Cb 0.11 -2.20 -0.01 0.00 1.34 0.00 0.00 72.50 71.74 3a9s s THR 65 CO 0.58 -0.23 1.09 0.00 -0.54 0.00 0.00 174.62 175.52 3a9s s ILE 67 N -2.41 4.22 -0.91 0.00 1.01 0.19 -4.90 121.20 118.40 3a9s s ILE 67 Ca 0.65 -1.30 0.08 0.00 0.00 0.00 0.00 60.65 60.08 3a9s s ILE 67 Cb -0.19 -3.53 0.05 0.00 0.01 0.00 0.00 42.46 38.81 3a9s s ILE 67 CO 0.40 -0.43 0.71 0.61 0.00 0.00 0.00 174.94 176.23 3a9s n GLY 68 N 4.91 -0.65 2.37 6.18 0.00 -1.26 -0.45 105.19 116.30 3a9s n GLY 68 Ca -0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 45.66 3a9s n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9s n GLY 69 N 0.47 1.15 0.27 -0.02 0.00 -1.26 -4.00 105.19 101.79 3a9s n GLY 69 Ca 0.04 -1.12 -0.03 0.00 0.00 0.00 0.00 46.02 44.91 3a9s n GLY 69 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3a9s h VAL 70 N 1.62 1.23 -0.13 1.61 3.04 -1.80 -1.68 116.25 120.15 3a9s h VAL 70 Ca -0.19 -1.02 -0.00 0.00 -1.01 0.00 0.00 66.70 64.48 3a9s h VAL 70 Cb 0.76 1.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.09 3a9s h VAL 70 CO 0.25 0.34 0.08 0.50 -1.01 0.00 0.00 177.57 177.73 3a9s h LYS 71 N 0.56 0.18 0.00 4.17 1.63 -1.97 0.12 116.57 121.26 3a9s h LYS 71 Ca 0.11 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.79 3a9s h LYS 71 Cb 0.48 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.06 3a9s h LYS 71 CO 0.03 0.17 -0.47 0.93 -3.45 0.00 0.00 179.45 176.66 3a9s h GLU 72 N 0.14 0.00 -0.45 1.90 5.08 -1.90 -1.06 114.58 118.29 3a9s h GLU 72 Ca 0.05 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 3a9s h GLU 72 Cb 0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3a9s h GLU 72 CO -0.01 0.47 -0.15 0.00 -1.00 0.00 0.00 179.01 178.33 3a9s h ALA 73 N 1.53 0.62 -0.58 3.43 0.00 -0.81 -1.30 119.26 122.15 3a9s h ALA 73 Ca -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3a9s h ALA 73 Cb 0.85 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3a9s h ALA 73 CO 0.06 0.55 0.04 0.00 0.00 0.00 0.00 179.25 179.89 3a9s h ALA 74 N 0.86 0.96 -0.80 0.00 0.00 -0.40 -1.34 119.26 118.54 3a9s h ALA 74 Ca 0.11 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3a9s h ALA 74 Cb 0.70 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3a9s h ALA 74 CO 0.05 0.64 0.38 0.93 0.00 0.00 0.00 179.25 181.25 3a9s h GLU 75 N 0.91 1.15 -0.32 0.00 4.39 -0.94 -0.72 114.58 119.05 3a9s h GLU 75 Ca 0.17 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3a9s h GLU 75 Cb 0.48 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3a9s h GLU 75 CO 0.02 0.89 0.06 0.00 -1.16 0.00 0.00 179.01 178.83 3a9s h ALA 76 N 1.20 0.43 -0.73 3.43 0.00 -0.88 -1.10 119.26 121.60 3a9s h ALA 76 Ca 0.27 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3a9s h ALA 76 Cb 0.12 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3a9s h ALA 76 CO -0.03 0.11 0.43 0.00 0.00 0.00 0.00 179.25 179.75 3a9s h ALA 77 N 0.90 0.98 -0.28 0.00 0.00 -0.88 0.21 119.26 120.19 3a9s h ALA 77 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3a9s h ALA 77 Cb 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3a9s h ALA 77 CO 0.00 0.14 0.10 1.49 0.00 0.00 0.00 179.25 180.99 3a9s h GLU 78 N 0.80 0.42 -0.55 0.00 4.57 -0.88 -1.08 114.58 117.85 3a9s h GLU 78 Ca 0.32 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.38 3a9s h GLU 78 Cb 0.15 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 3a9s h GLU 78 CO -0.17 0.45 0.18 -0.22 -1.18 0.00 0.00 179.01 178.08 3a9s h LYS 79 N 0.29 0.86 -0.64 1.92 3.64 -0.79 -2.04 116.57 119.81 3a9s h LYS 79 Ca 0.09 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 3a9s h LYS 79 Cb 0.20 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 3a9s h LYS 79 CO -0.01 0.77 0.16 0.74 -2.27 0.00 0.00 179.45 178.85 3a9s h PHE 80 N 0.77 1.05 -0.63 1.91 0.05 -0.86 -0.34 116.94 118.90 3a9s h PHE 80 Ca 0.18 -0.11 -0.08 0.00 3.82 0.00 0.00 57.97 61.78 3a9s h PHE 80 Cb 0.27 -0.30 -0.02 0.00 2.00 0.00 0.00 35.95 37.89 3a9s h PHE 80 CO 0.02 0.86 0.09 0.00 -0.18 0.00 0.00 178.31 179.10 3a9s h ALA 81 N 1.20 0.84 0.00 2.45 0.00 -0.98 -0.51 119.26 122.26 3a9s h ALA 81 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3a9s h ALA 81 Cb 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3a9s h ALA 81 CO -0.00 0.61 -0.38 0.00 0.00 0.00 0.00 179.25 179.48 3a9s h ARG 82 N 0.96 0.00 -0.01 0.00 2.47 -1.07 -3.16 114.38 113.57 3a9s h ARG 82 Ca 0.19 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.91 3a9s h ARG 82 Cb 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 3a9s h ARG 82 CO 0.01 0.38 -0.21 0.39 0.56 0.00 0.00 179.97 181.10 3a9s n GLU 83 N -3.34 1.03 -2.60 0.04 -0.58 -0.16 -4.96 120.64 110.07 3a9s n GLU 83 Ca 0.01 -0.62 -0.02 0.00 -0.42 0.00 0.00 57.16 56.11 3a9s n GLU 83 Cb 0.59 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.98 3a9s n GLU 83 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3a9s n GLY 84 N 1.31 0.81 3.73 0.62 0.00 -0.78 -4.83 105.19 106.05 3a9s n GLY 84 Ca 0.13 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 3a9s n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a9s s VAL 85 N -3.02 4.46 0.00 1.61 1.01 -0.27 -2.06 120.40 122.12 3a9s s VAL 85 Ca 0.06 2.00 0.00 0.00 0.00 0.00 0.00 61.98 64.04 3a9s s VAL 85 Cb -0.03 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 32.08 3a9s s VAL 85 CO 0.07 0.29 0.50 0.61 0.00 0.00 0.00 175.10 176.57 3a9s n GLY 86 N 2.34 -0.35 3.19 4.51 0.00 0.38 -4.83 105.19 110.44 3a9s n GLY 86 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 3a9s n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a9s s VAL 87 N -0.18 -0.00 0.03 1.61 1.01 -1.15 -4.09 120.40 117.63 3a9s s VAL 87 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.03 3a9s s VAL 87 Cb 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 3a9s s VAL 87 CO 0.00 0.00 -0.14 -0.94 0.00 0.00 0.00 175.10 174.02 3a9s s SER 88 N 0.20 1.68 -0.07 3.32 1.04 -0.45 -0.10 113.70 119.32 3a9s s SER 88 Ca -0.00 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.02 3a9s s SER 88 Cb -0.02 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.99 3a9s s SER 88 CO 0.00 0.07 -0.04 -0.63 0.98 0.00 0.00 173.24 173.62 3a9s s ILE 89 N -0.71 0.65 -0.11 -1.02 1.01 0.18 -1.52 121.20 119.68 3a9s s ILE 89 Ca 0.03 -0.11 -0.09 0.00 0.00 0.00 0.00 60.65 60.47 3a9s s ILE 89 Cb -0.07 -0.71 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 3a9s s ILE 89 CO 0.01 0.28 0.20 -0.89 0.00 0.00 0.00 174.94 174.54 3a9s s THR 90 N 1.41 5.40 0.01 2.92 2.01 0.05 -0.15 115.64 127.29 3a9s s THR 90 Ca -0.03 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.35 3a9s s THR 90 Cb -0.13 -3.48 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 3a9s s THR 90 CO -0.03 0.58 -0.09 0.68 -0.69 0.00 0.00 174.62 175.06 3a9s s VAL 91 N -0.78 0.73 -0.12 3.82 -7.23 -0.05 -0.08 120.40 116.69 3a9s s VAL 91 Ca 0.16 -0.64 -0.30 0.00 -1.81 0.00 0.00 61.98 59.39 3a9s s VAL 91 Cb -0.13 -0.66 0.10 0.00 0.56 0.00 0.00 36.38 36.25 3a9s s VAL 91 CO 0.05 0.03 0.84 0.28 -0.31 0.00 0.00 175.10 175.99 3a9s s THR 92 N -0.58 0.00 -1.15 5.32 -1.32 -1.02 -1.30 115.64 115.59 3a9s s THR 92 Ca 0.00 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.60 3a9s s THR 92 Cb -0.06 -1.00 0.24 0.00 -1.51 0.00 0.00 72.50 70.17 3a9s s THR 92 CO 0.00 0.00 1.13 -0.81 -2.21 0.00 0.00 174.62 172.73 3a9s n PRO 93 N 1.00 2.06 -3.12 7.08 -0.04 -1.26 -1.29 135.00 139.44 3a9s n PRO 93 Ca -0.14 -1.76 -0.10 0.00 -0.04 0.00 0.00 63.50 61.45 3a9s n PRO 93 Cb 0.57 -1.26 -0.03 0.00 -0.04 0.00 0.00 33.50 32.74 3a9s n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3a9s s TRP 95 N -3.15 3.77 0.09 0.00 -0.11 -1.22 -3.98 118.94 114.34 3a9s s TRP 95 Ca 0.20 1.78 0.01 0.00 1.22 0.00 0.00 56.10 59.31 3a9s s TRP 95 Cb 0.00 -3.14 -0.04 0.00 -1.50 0.00 0.00 33.47 28.79 3a9s s TRP 95 CO 0.14 -0.08 -0.04 0.00 -4.62 0.00 0.00 176.95 172.35 3a9s n TYR 97 N -0.02 2.72 0.00 0.00 4.01 -1.26 -4.88 117.16 117.74 3a9s n TYR 97 Ca -0.12 -3.00 0.00 0.00 -0.16 0.00 0.00 57.90 54.62 3a9s n TYR 97 Cb 0.61 -2.35 0.00 0.00 -0.31 0.00 0.00 39.34 37.29 3a9s n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a9s n GLY 98 N 3.29 0.12 0.35 2.72 0.00 -1.26 -0.55 105.19 109.86 3a9s n GLY 98 Ca 0.67 0.07 0.18 0.00 0.00 0.00 0.00 46.02 46.94 3a9s n GLY 98 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3a9s h THR 99 N 0.00 0.57 0.00 2.61 1.35 -1.93 -0.87 112.91 114.65 3a9s h THR 99 Ca 0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.81 3a9s h THR 99 Cb 0.00 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 67.21 3a9s h THR 99 CO 0.00 0.00 -0.26 -0.33 -0.25 0.00 0.00 175.52 174.68 3a9s h GLU 100 N 0.00 0.00 -0.02 4.72 5.08 -1.21 -3.22 114.58 119.92 3a9s h GLU 100 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3a9s h GLU 100 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3a9s h GLU 100 CO -0.00 0.26 0.00 0.25 -1.00 0.00 0.00 179.01 178.51 3a9s n THR 101 N -3.55 0.03 -1.71 1.13 -2.24 -0.38 -2.06 114.28 105.49 3a9s n THR 101 Ca -0.01 -0.51 -0.35 0.00 -2.27 0.00 0.00 64.05 60.91 3a9s n THR 101 Cb 0.40 1.21 0.06 0.00 -2.10 0.00 0.00 70.33 69.91 3a9s n THR 101 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3a9s s MET 102 N -0.93 2.57 -0.39 -0.78 -1.94 -0.93 -4.94 119.30 111.96 3a9s s MET 102 Ca 0.13 1.74 -0.22 0.00 -1.71 0.00 0.00 55.69 55.63 3a9s s MET 102 Cb 0.09 -1.89 0.01 0.00 2.01 0.00 0.00 34.83 35.06 3a9s s MET 102 CO 0.14 -1.50 0.71 0.34 -0.01 0.00 0.00 175.02 174.70 3a9s s ASP 103 N -1.93 6.43 0.00 3.03 -1.08 -1.26 -4.93 116.67 116.94 3a9s s ASP 103 Ca 0.75 0.06 0.19 0.00 -0.52 0.00 0.00 52.55 53.02 3a9s s ASP 103 Cb -0.29 -2.35 0.52 0.00 -1.46 0.00 0.00 42.92 39.34 3a9s s ASP 103 CO 0.40 -0.73 1.42 0.23 0.52 0.00 0.00 175.17 177.01 3a9s n MET 104 N 6.32 2.17 -2.39 4.34 2.81 -1.26 -4.88 117.12 124.23 3a9s n MET 104 Ca 0.00 -1.79 -0.43 0.00 -1.81 0.00 0.00 57.70 53.68 3a9s n MET 104 Cb 0.48 -1.42 -0.02 0.00 -0.71 0.00 0.00 33.22 31.55 3a9s n MET 104 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3a9s s ASP 105 N -1.22 6.45 0.36 7.83 -1.08 -1.26 -4.88 116.67 122.87 3a9s s ASP 105 Ca 0.35 0.90 0.27 0.00 -0.52 0.00 0.00 52.55 53.55 3a9s s ASP 105 Cb 0.19 -2.54 1.06 0.00 -1.46 0.00 0.00 42.92 40.16 3a9s s ASP 105 CO 0.26 -1.32 1.80 -0.65 0.52 0.00 0.00 175.17 175.78 3a9s h PRO 106 N 10.18 0.00 -0.64 4.34 0.11 -2.00 -3.23 132.00 140.76 3a9s h PRO 106 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3a9s h PRO 106 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3a9s h PRO 106 CO 1.08 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.59 3a9s n HIS 107 N -2.57 1.47 -4.36 0.65 8.25 -1.26 -4.89 115.22 112.51 3a9s n HIS 107 Ca 0.02 -0.55 -0.24 0.00 -0.26 0.00 0.00 57.72 56.69 3a9s n HIS 107 Cb 0.29 -0.30 -0.17 0.00 1.12 0.00 0.00 29.99 30.93 3a9s n HIS 107 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 3a9s s ILE 108 N -2.06 1.00 0.36 1.59 2.07 -1.22 -5.03 121.20 117.90 3a9s s ILE 108 Ca 0.45 -0.37 -0.29 0.00 -1.41 0.00 0.00 60.65 59.03 3a9s s ILE 108 Cb 0.31 -0.95 -0.11 0.00 0.13 0.00 0.00 42.46 41.84 3a9s s ILE 108 CO 0.18 0.33 1.50 -2.84 -1.91 0.00 0.00 174.94 172.21 3a9s s PRO 109 N 0.93 4.13 0.01 3.50 0.02 -1.26 -4.81 135.00 137.52 3a9s s PRO 109 Ca -0.10 2.55 -0.01 0.00 0.02 0.00 0.00 61.00 63.46 3a9s s PRO 109 Cb -0.15 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 3a9s s PRO 109 CO 0.01 -0.54 0.01 -1.59 -0.33 0.00 0.00 177.00 174.56 3a9s s LYS 110 N -1.73 0.26 0.10 5.54 -2.85 -1.26 -1.34 119.74 118.46 3a9s s LYS 110 Ca 0.55 -0.40 0.02 0.00 -1.00 0.00 0.00 55.97 55.14 3a9s s LYS 110 Cb -0.46 0.10 -0.04 0.00 -2.06 0.00 0.00 37.83 35.36 3a9s s LYS 110 CO 0.59 -0.05 -0.06 0.00 0.10 0.00 0.00 175.35 175.94 3a9s s ALA 111 N -1.04 0.99 -0.05 0.59 0.00 -0.58 -1.03 121.76 120.64 3a9s s ALA 111 Ca -0.11 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.48 3a9s s ALA 111 Cb -0.07 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.29 3a9s s ALA 111 CO -0.00 -0.25 -0.04 0.08 0.00 0.00 0.00 175.76 175.54 3a9s s VAL 112 N -3.65 0.56 -0.26 0.00 1.01 0.32 -0.77 120.40 117.61 3a9s s VAL 112 Ca 0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 61.98 61.99 3a9s s VAL 112 Cb 0.05 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.86 3a9s s VAL 112 CO -0.04 0.24 -0.04 0.86 0.00 0.00 0.00 175.10 176.12 3a9s s TRP 113 N 1.13 3.09 -0.24 5.22 -0.00 0.88 -0.76 118.94 128.26 3a9s s TRP 113 Ca -0.08 -1.52 -0.07 0.00 -0.00 0.00 0.00 56.10 54.43 3a9s s TRP 113 Cb -0.14 -2.08 -0.03 0.00 -0.00 0.00 0.00 33.47 31.22 3a9s s TRP 113 CO -0.01 -0.72 0.07 0.20 -0.00 0.00 0.00 176.95 176.49 3a9s s GLY 114 N 1.34 1.79 0.22 5.86 0.00 -1.04 -2.43 107.32 113.05 3a9s s GLY 114 Ca -0.00 -1.07 -0.32 0.00 0.00 0.00 0.00 44.72 43.33 3a9s s GLY 114 CO -0.03 0.47 1.57 0.33 0.00 0.00 0.00 173.10 175.43 3a9s n PHE 115 N 4.73 2.45 -2.74 1.90 7.35 -0.41 -4.51 117.46 126.23 3a9s n PHE 115 Ca -0.16 0.26 -0.43 0.00 -0.76 0.00 0.00 57.45 56.36 3a9s n PHE 115 Cb 0.52 -2.56 0.00 0.00 0.35 0.00 0.00 39.48 37.79 3a9s n PHE 115 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3a9s n ASN 116 N 2.97 5.12 -4.53 -2.13 2.85 -1.26 -4.00 115.26 114.28 3a9s n ASN 116 Ca 0.14 -2.99 -0.26 0.00 -0.11 0.00 0.00 54.58 51.36 3a9s n ASN 116 Cb 0.32 -1.58 -0.10 0.00 1.24 0.00 0.00 39.78 39.66 3a9s n ASN 116 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 3a9s s GLY 117 N 2.60 2.14 -0.22 8.20 0.00 -1.26 -0.62 107.32 118.16 3a9s s GLY 117 Ca 0.44 -2.05 0.07 0.00 0.00 0.00 0.00 44.72 43.18 3a9s s GLY 117 CO 0.01 -2.02 -0.05 -1.30 0.00 0.00 0.00 173.10 169.74 3a9s n THR 118 N -0.76 1.48 -0.33 0.90 -2.24 -1.26 -4.53 114.28 107.54 3a9s n THR 118 Ca -0.05 -0.68 0.13 0.00 -2.27 0.00 0.00 64.05 61.17 3a9s n THR 118 Cb 0.63 -1.10 0.35 0.00 -2.10 0.00 0.00 70.33 68.10 3a9s n THR 118 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3a9s h GLU 119 N 0.01 0.72 -5.42 -0.78 3.07 -1.94 -3.42 114.58 106.82 3a9s h GLU 119 Ca -0.55 -0.04 -0.46 0.00 -0.50 0.00 0.00 59.36 57.81 3a9s h GLU 119 Cb 2.03 -0.16 -0.25 0.00 -0.84 0.00 0.00 28.75 29.53 3a9s h GLU 119 CO -0.03 0.48 -0.80 1.03 -1.40 0.00 0.00 179.01 178.29 3a9s s ARG 120 N -5.78 0.98 -0.44 2.33 1.81 -1.26 -5.05 118.95 111.55 3a9s s ARG 120 Ca -0.11 -0.79 -0.03 0.00 -1.72 0.00 0.00 55.73 53.08 3a9s s ARG 120 Cb 0.24 -1.01 -0.05 0.00 -0.45 0.00 0.00 34.95 33.67 3a9s s ARG 120 CO 0.80 0.25 1.72 -2.30 -0.68 0.00 0.00 175.30 175.09 3a9s n PRO 121 N 1.86 1.21 -0.07 3.54 -0.02 -1.26 -4.61 135.00 135.65 3a9s n PRO 121 Ca -0.18 -0.92 -0.05 0.00 -2.02 0.00 0.00 63.50 60.33 3a9s n PRO 121 Cb 0.54 -2.12 0.14 0.00 -0.02 0.00 0.00 33.50 32.05 3a9s n PRO 121 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3a9s h GLY 122 N 7.93 0.77 2.00 -1.23 0.00 -1.71 -1.62 103.07 109.21 3a9s h GLY 122 Ca 0.26 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 3a9s h GLY 122 CO 1.04 0.54 -0.59 0.00 0.00 0.00 0.00 176.54 177.53 3a9s h ALA 123 N 1.20 0.79 -0.47 3.60 0.00 -1.82 -2.00 119.26 120.57 3a9s h ALA 123 Ca 0.11 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 3a9s h ALA 123 Cb 0.60 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3a9s h ALA 123 CO 0.04 0.74 -0.14 0.28 0.00 0.00 0.00 179.25 180.17 3a9s h VAL 124 N 0.00 1.27 -0.07 0.00 2.07 -1.81 -0.96 116.25 116.74 3a9s h VAL 124 Ca -0.01 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.24 3a9s h VAL 124 Cb 1.23 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 3a9s h VAL 124 CO 0.08 0.43 -0.02 0.22 0.02 0.00 0.00 177.57 178.30 3a9s h TYR 125 N 0.78 0.15 -0.28 1.57 3.20 -0.99 0.09 116.97 121.49 3a9s h TYR 125 Ca 0.12 -0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.03 3a9s h TYR 125 Cb 0.66 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.82 3a9s h TYR 125 CO 0.04 0.46 -0.22 1.25 -1.64 0.00 0.00 178.16 178.05 3a9s h LEU 126 N -0.19 -0.71 -0.76 2.82 5.85 -1.19 0.36 115.31 121.49 3a9s h LEU 126 Ca 0.02 0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 3a9s h LEU 126 Cb 0.41 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 3a9s h LEU 126 CO 0.01 -0.25 -0.01 0.00 -0.34 0.00 0.00 178.44 177.85 3a9s h ALA 127 N 0.92 0.96 -0.17 1.25 0.00 -1.16 -1.14 119.26 119.93 3a9s h ALA 127 Ca 0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3a9s h ALA 127 Cb 0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3a9s h ALA 127 CO -0.40 0.63 0.03 0.00 0.00 0.00 0.00 179.25 179.51 3a9s h ALA 128 N 1.12 0.22 -0.14 0.00 0.00 -0.16 -1.78 119.26 118.51 3a9s h ALA 128 Ca 0.16 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3a9s h ALA 128 Cb 0.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3a9s h ALA 128 CO 0.03 -0.11 -0.51 -0.24 0.00 0.00 0.00 179.25 178.42 3a9s h VAL 129 N 0.06 1.33 -0.44 0.00 3.04 -0.26 -2.37 116.25 117.60 3a9s h VAL 129 Ca 0.05 -1.75 -0.06 0.00 -1.01 0.00 0.00 66.70 63.93 3a9s h VAL 129 Cb 0.31 1.78 -0.02 0.00 -2.01 0.00 0.00 31.29 31.35 3a9s h VAL 129 CO 0.00 0.53 0.01 -0.07 -1.01 0.00 0.00 177.57 177.04 3a9s h LEU 130 N 0.30 0.68 -1.36 3.16 3.38 -1.15 0.13 115.31 120.45 3a9s h LEU 130 Ca 0.01 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 3a9s h LEU 130 Cb 1.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3a9s h LEU 130 CO 0.09 0.74 0.14 0.00 0.09 0.00 0.00 178.44 179.49 3a9s h ALA 131 N 1.34 1.50 -0.21 1.53 0.00 -0.97 0.74 119.26 123.18 3a9s h ALA 131 Ca 0.14 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3a9s h ALA 131 Cb 0.40 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3a9s h ALA 131 CO 0.01 0.38 -0.18 0.78 0.00 0.00 0.00 179.25 180.25 3a9s h GLY 132 N 0.75 0.54 1.04 0.00 0.00 -0.58 0.26 103.07 105.07 3a9s h GLY 132 Ca 0.14 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 3a9s h GLY 132 CO -0.01 0.48 0.38 -0.97 0.00 0.00 0.00 176.54 176.42 3a9s h TYR 133 N 0.18 1.19 -0.50 5.60 -1.99 -0.34 -0.39 116.97 120.72 3a9s h TYR 133 Ca 0.04 -0.06 -0.12 0.00 2.00 0.00 0.00 58.73 60.59 3a9s h TYR 133 Cb 0.71 -0.37 -0.02 0.00 2.00 0.00 0.00 36.73 39.06 3a9s h TYR 133 CO 0.08 0.87 -0.14 -0.91 -0.00 0.00 0.00 178.16 178.06 3a9s h ASN 134 N 1.17 0.99 0.14 3.88 2.35 -0.78 -0.10 115.58 123.23 3a9s h ASN 134 Ca 0.28 -0.37 -0.11 0.00 -0.55 0.00 0.00 56.30 55.55 3a9s h ASN 134 Cb 0.14 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3a9s h ASN 134 CO -0.03 1.13 -0.40 -0.61 -1.65 0.00 0.00 177.43 175.87 3a9s h GLN 135 N 0.85 0.34 -0.01 0.81 4.15 -0.61 -3.05 115.11 117.59 3a9s h GLN 135 Ca 0.13 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.39 3a9s h GLN 135 Cb 0.71 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3a9s h GLN 135 CO 0.05 0.68 -0.24 1.63 -1.93 0.00 0.00 178.83 179.02 3a9s n LYS 136 N -4.03 0.93 -1.91 1.69 5.02 -0.18 -4.96 118.16 114.71 3a9s n LYS 136 Ca -0.01 -0.56 -0.03 0.00 -2.02 0.00 0.00 58.31 55.69 3a9s n LYS 136 Cb 0.48 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 34.00 3a9s n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9s n GLY 137 N 1.33 0.30 3.04 0.72 0.00 -0.60 -5.01 105.19 104.98 3a9s n GLY 137 Ca 0.13 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 3a9s n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a9s s LEU 138 N -0.80 4.91 0.15 0.99 1.43 -0.15 -5.04 118.68 120.17 3a9s s LEU 138 Ca 0.00 -2.89 -0.34 0.00 -1.03 0.00 0.00 54.13 49.87 3a9s s LEU 138 Cb 0.00 -1.77 -0.16 0.00 0.03 0.00 0.00 46.19 44.29 3a9s s LEU 138 CO 0.00 -0.32 1.27 -2.65 0.23 0.00 0.00 176.35 174.88 3a9s n PRO 139 N 3.38 1.32 -3.81 1.29 -0.02 -1.26 -4.51 135.00 131.39 3a9s n PRO 139 Ca 0.07 0.47 -0.12 0.00 -2.02 0.00 0.00 63.50 61.90 3a9s n PRO 139 Cb 0.36 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 3a9s n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9s s ALA 140 N 0.10 -0.52 0.15 3.55 0.00 -1.26 -4.49 121.76 119.29 3a9s s ALA 140 Ca 0.76 0.44 -0.22 0.00 0.00 0.00 0.00 51.96 52.94 3a9s s ALA 140 Cb -0.85 -0.23 -0.08 0.00 0.00 0.00 0.00 23.12 21.97 3a9s s ALA 140 CO 0.49 -0.14 0.69 -0.06 0.00 0.00 0.00 175.76 176.75 3a9s s PHE 141 N -0.31 3.82 -0.14 0.00 0.40 -0.20 -1.10 117.98 120.44 3a9s s PHE 141 Ca -0.04 1.46 -0.03 0.00 -0.60 0.00 0.00 56.93 57.71 3a9s s PHE 141 Cb -0.03 -2.64 -0.03 0.00 0.51 0.00 0.00 43.02 40.83 3a9s s PHE 141 CO 0.01 0.50 -0.04 0.20 0.70 0.00 0.00 175.22 176.59 3a9s s GLY 142 N -1.25 1.73 -0.23 4.36 0.00 -1.26 -0.52 107.32 110.13 3a9s s GLY 142 Ca 0.35 -0.82 0.01 0.00 0.00 0.00 0.00 44.72 44.26 3a9s s GLY 142 CO 0.23 -0.16 -0.07 -0.42 0.00 0.00 0.00 173.10 172.67 3a9s s ILE 143 N 0.15 1.70 -0.11 0.90 1.01 0.06 -4.95 121.20 119.96 3a9s s ILE 143 Ca -0.01 -1.28 0.00 0.00 0.00 0.00 0.00 60.65 59.35 3a9s s ILE 143 Cb -0.14 -1.90 0.02 0.00 0.01 0.00 0.00 42.46 40.46 3a9s s ILE 143 CO 0.03 -0.04 -0.09 -0.47 0.00 0.00 0.00 174.94 174.36 3a9s s TYR 144 N 1.33 1.56 0.38 3.97 5.04 -1.26 -2.50 117.35 125.87 3a9s s TYR 144 Ca -0.06 -0.77 -0.25 0.00 -2.44 0.00 0.00 57.07 53.55 3a9s s TYR 144 Cb -0.19 -1.25 -0.09 0.00 0.35 0.00 0.00 41.96 40.78 3a9s s TYR 144 CO -0.06 -0.50 1.11 0.20 -1.34 0.00 0.00 175.55 174.96 3a9s s GLY 145 N 1.53 2.85 0.34 8.97 0.00 -1.26 -4.93 107.32 114.82 3a9s s GLY 145 Ca 0.02 0.85 0.16 0.00 0.00 0.00 0.00 44.72 45.76 3a9s s GLY 145 CO -0.07 1.34 1.67 0.07 0.00 0.00 0.00 173.10 176.12 3a9s h LYS 146 N 2.76 0.00 -5.28 2.90 2.10 -1.99 -3.45 116.57 113.61 3a9s h LYS 146 Ca -0.48 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 57.53 3a9s h LYS 146 Cb 1.22 0.00 -0.23 0.00 -0.90 0.00 0.00 32.23 32.33 3a9s h LYS 146 CO 0.63 0.45 -0.68 -0.51 -2.00 0.00 0.00 179.45 177.34 3a9s s ASP 147 N -6.53 4.65 0.22 7.07 1.01 -1.26 -5.08 116.67 116.75 3a9s s ASP 147 Ca 0.00 -0.18 -0.32 0.00 0.71 0.00 0.00 52.55 52.76 3a9s s ASP 147 Cb 0.11 -1.76 -0.13 0.00 1.01 0.00 0.00 42.92 42.16 3a9s s ASP 147 CO 0.71 0.15 1.58 0.52 0.21 0.00 0.00 175.17 178.35 3a9s n VAL 148 N 3.63 0.42 -4.19 -1.27 0.31 -1.26 -4.84 118.33 111.14 3a9s n VAL 148 Ca -0.17 -0.11 -0.30 0.00 -0.01 0.00 0.00 64.34 63.75 3a9s n VAL 148 Cb 0.52 -1.73 -0.09 0.00 -0.91 0.00 0.00 33.84 31.64 3a9s n VAL 148 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3a9s s GLN 149 N 0.39 2.29 0.46 5.55 -0.21 0.21 -5.03 119.66 123.31 3a9s s GLN 149 Ca 0.72 -0.98 -0.21 0.00 0.02 0.00 0.00 55.36 54.92 3a9s s GLN 149 Cb -0.59 -2.38 -0.10 0.00 1.00 0.00 0.00 33.01 30.94 3a9s s GLN 149 CO 0.41 0.51 1.00 -0.51 -2.12 0.00 0.00 175.29 174.58 3a9s s ASP 150 N -2.32 6.64 0.19 5.90 1.01 -1.26 -4.40 116.67 122.43 3a9s s ASP 150 Ca 0.23 1.81 -0.33 0.00 0.71 0.00 0.00 52.55 54.98 3a9s s ASP 150 Cb -0.11 -2.55 -0.15 0.00 1.01 0.00 0.00 42.92 41.12 3a9s s ASP 150 CO 0.16 -0.57 1.28 0.00 0.21 0.00 0.00 175.17 176.25 3a9s n ALA 151 N -0.78 -0.06 0.00 5.23 0.00 -1.26 -1.81 120.51 121.82 3a9s n ALA 151 Ca 0.08 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.97 3a9s n ALA 151 Cb 0.53 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.85 3a9s n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a9s n GLY 152 N 2.18 2.29 3.63 0.00 0.00 -1.26 -5.00 105.19 107.04 3a9s n GLY 152 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3a9s n GLY 152 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3a9s s ASP 153 N -2.81 6.04 0.00 1.61 -1.08 -0.75 -4.83 116.67 114.85 3a9s s ASP 153 Ca 0.00 2.25 0.27 0.00 -0.52 0.00 0.00 52.55 54.55 3a9s s ASP 153 Cb 0.00 -2.52 0.82 0.00 -1.46 0.00 0.00 42.92 39.76 3a9s s ASP 153 CO 0.00 -1.44 1.61 0.35 0.52 0.00 0.00 175.17 176.21 3a9s n THR 154 N 6.52 0.00 -2.47 1.71 -2.24 -1.26 -4.88 114.28 111.66 3a9s n THR 154 Ca 0.24 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 3a9s n THR 154 Cb 0.43 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 3a9s n THR 154 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3a9s s ASN 155 N -2.13 7.11 -0.24 3.42 0.01 -1.26 -4.94 114.94 116.90 3a9s s ASN 155 Ca 0.33 1.91 -0.19 0.00 -0.71 0.00 0.00 52.86 54.20 3a9s s ASN 155 Cb 0.20 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 39.27 3a9s s ASN 155 CO 0.38 -0.47 0.58 -0.63 -1.51 0.00 0.00 177.10 175.45 3a9s s ILE 156 N 1.38 5.03 0.69 0.60 1.01 -1.26 -5.04 121.20 123.61 3a9s s ILE 156 Ca 0.57 1.04 -0.17 0.00 0.00 0.00 0.00 60.65 62.10 3a9s s ILE 156 Cb -0.27 -3.89 -0.00 0.00 0.01 0.00 0.00 42.46 38.31 3a9s s ILE 156 CO 0.27 0.08 1.03 -2.65 0.00 0.00 0.00 174.94 173.67 3a9s n PRO 157 N 5.42 0.66 -0.34 2.79 -0.02 -1.26 -4.71 135.00 137.55 3a9s n PRO 157 Ca -0.02 0.28 -0.01 0.00 -2.02 0.00 0.00 63.50 61.73 3a9s n PRO 157 Cb 0.49 -2.28 0.13 0.00 -0.02 0.00 0.00 33.50 31.82 3a9s n PRO 157 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9s h GLU 158 N -0.02 1.11 -0.33 -0.52 4.57 -1.99 0.58 114.58 117.99 3a9s h GLU 158 Ca -0.48 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 57.54 3a9s h GLU 158 Cb 1.34 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 29.66 3a9s h GLU 158 CO 0.49 0.73 -0.19 0.38 -1.18 0.00 0.00 179.01 179.24 3a9s h ASP 159 N 1.14 0.60 -0.30 1.04 -0.00 -2.00 -1.65 116.42 115.25 3a9s h ASP 159 Ca 0.37 -0.19 -0.12 0.00 -0.00 0.00 0.00 57.03 57.08 3a9s h ASP 159 Cb 0.02 -0.16 -0.00 0.00 -0.00 0.00 0.00 39.33 39.18 3a9s h ASP 159 CO -0.13 0.80 -0.29 0.58 -0.00 0.00 0.00 179.24 180.20 3a9s h VAL 160 N 0.54 1.30 -0.68 4.15 2.07 -1.78 -2.98 116.25 118.87 3a9s h VAL 160 Ca 0.09 -1.46 0.03 0.00 0.82 0.00 0.00 66.70 66.18 3a9s h VAL 160 Cb 0.63 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 3a9s h VAL 160 CO 0.04 0.47 0.42 0.11 0.02 0.00 0.00 177.57 178.63 3a9s h LYS 161 N 0.49 0.79 -0.70 1.57 1.57 -0.63 -0.81 116.57 118.85 3a9s h LYS 161 Ca 0.05 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3a9s h LYS 161 Cb 0.86 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.96 3a9s h LYS 161 CO 0.07 0.52 0.44 1.49 -0.57 0.00 0.00 179.45 181.40 3a9s h GLU 162 N 0.81 0.94 -0.34 3.15 4.81 -1.26 -0.92 114.58 121.77 3a9s h GLU 162 Ca 0.28 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 59.29 3a9s h GLU 162 Cb 0.05 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 3a9s h GLU 162 CO -0.12 0.66 -0.33 0.87 -0.73 0.00 0.00 179.01 179.36 3a9s h LYS 163 N 0.96 0.83 -0.50 1.92 1.57 -1.32 -0.77 116.57 119.26 3a9s h LYS 163 Ca 0.25 -0.43 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 3a9s h LYS 163 Cb -0.06 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3a9s h LYS 163 CO -0.05 1.07 0.28 -0.07 -0.57 0.00 0.00 179.45 180.10 3a9s h LEU 164 N 0.62 0.62 -0.33 2.94 3.38 -0.93 -0.55 115.31 121.07 3a9s h LEU 164 Ca 0.06 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 3a9s h LEU 164 Cb 0.91 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3a9s h LEU 164 CO 0.08 0.53 -0.28 0.40 0.09 0.00 0.00 178.44 179.26 3a9s h ILE 165 N 0.66 1.29 -0.44 1.22 2.04 -1.14 -0.79 117.51 120.36 3a9s h ILE 165 Ca 0.18 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.56 3a9s h ILE 165 Cb 0.05 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3a9s h ILE 165 CO -0.03 0.47 0.17 -0.09 0.00 0.00 0.00 178.15 178.67 3a9s h ARG 166 N 0.53 0.67 -0.33 2.37 2.43 -1.02 -0.62 114.38 118.42 3a9s h ARG 166 Ca 0.06 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3a9s h ARG 166 Cb 0.85 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 3a9s h ARG 166 CO 0.07 0.62 0.15 0.35 -1.51 0.00 0.00 179.97 179.66 3a9s h PHE 167 N 0.58 0.48 -0.44 2.20 3.57 -1.08 -1.95 116.94 120.29 3a9s h PHE 167 Ca 0.15 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3a9s h PHE 167 Cb 0.21 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 3a9s h PHE 167 CO 0.00 0.42 0.29 0.00 -2.23 0.00 0.00 178.31 176.80 3a9s h ALA 168 N 1.00 0.56 -0.37 2.41 0.00 -0.89 0.31 119.26 122.28 3a9s h ALA 168 Ca 0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3a9s h ALA 168 Cb 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3a9s h ALA 168 CO -0.01 0.01 0.08 0.87 0.00 0.00 0.00 179.25 180.21 3a9s h LYS 169 N 0.60 0.60 -0.39 0.00 1.57 -1.05 0.45 116.57 118.35 3a9s h LYS 169 Ca 0.16 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3a9s h LYS 169 Cb -0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3a9s h LYS 169 CO -0.03 0.64 0.04 0.00 -0.57 0.00 0.00 179.45 179.53 3a9s h ALA 170 N 0.93 0.52 -0.58 3.86 0.00 -1.17 -1.13 119.26 121.69 3a9s h ALA 170 Ca 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3a9s h ALA 170 Cb 0.32 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3a9s h ALA 170 CO 0.00 0.26 0.32 0.78 0.00 0.00 0.00 179.25 180.61 3a9s h GLY 171 N 0.50 0.87 1.01 0.00 0.00 -0.26 -1.78 103.07 103.41 3a9s h GLY 171 Ca 0.12 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 3a9s h GLY 171 CO 0.01 0.38 0.21 -2.00 0.00 0.00 0.00 176.54 175.14 3a9s h LEU 172 N 0.79 0.91 -0.65 3.11 5.85 -0.75 -0.81 115.31 123.76 3a9s h LEU 172 Ca 0.21 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3a9s h LEU 172 Cb 0.05 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3a9s h LEU 172 CO -0.03 0.87 0.41 0.00 -0.34 0.00 0.00 178.44 179.35 3a9s h ALA 173 N 1.08 0.82 -0.38 1.25 0.00 -0.92 0.99 119.26 122.10 3a9s h ALA 173 Ca 0.20 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3a9s h ALA 173 Cb 0.28 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3a9s h ALA 173 CO -0.01 0.27 0.12 0.28 0.00 0.00 0.00 179.25 179.90 3a9s h VAL 174 N 0.88 1.22 -0.43 0.00 2.07 -1.06 -2.76 116.25 116.16 3a9s h VAL 174 Ca 0.23 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 3a9s h VAL 174 Cb -0.07 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3a9s h VAL 174 CO -0.05 0.25 0.14 0.00 0.02 0.00 0.00 177.57 177.93 3a9s h ALA 175 N 0.96 1.43 -0.57 1.67 0.00 -0.70 -2.92 119.26 119.13 3a9s h ALA 175 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3a9s h ALA 175 Cb 0.26 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3a9s h ALA 175 CO -0.00 0.42 0.36 0.52 0.00 0.00 0.00 179.25 180.55 3a9s h MET 176 N 0.62 0.76 -0.00 0.00 2.86 -0.52 -3.07 114.93 115.59 3a9s h MET 176 Ca 0.15 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.57 3a9s h MET 176 Cb 0.19 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 3a9s h MET 176 CO -0.01 0.52 -0.77 0.52 1.06 0.00 0.00 176.91 178.23 3a9s h MET 177 N 0.78 0.07 -6.45 1.72 2.86 -1.44 -3.44 114.93 109.02 3a9s h MET 177 Ca 0.21 -0.07 -0.59 0.00 -2.06 0.00 0.00 59.70 57.19 3a9s h MET 177 Cb -0.06 0.02 0.05 0.00 0.06 0.00 0.00 31.60 31.67 3a9s h MET 177 CO -0.04 0.81 0.85 1.63 1.06 0.00 0.00 176.91 181.21 3a9s n LYS 178 N -3.66 2.13 0.00 1.72 5.02 -1.16 -1.74 118.16 120.46 3a9s n LYS 178 Ca -0.02 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 3a9s n LYS 178 Cb 0.74 -2.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.20 3a9s n LYS 178 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9s n GLY 179 N 3.58 2.16 3.92 0.72 0.00 0.42 -4.98 105.19 111.01 3a9s n GLY 179 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3a9s n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9s s LYS 180 N -0.33 3.06 0.19 1.61 -0.14 -0.71 -4.73 119.74 118.69 3a9s s LYS 180 Ca 0.00 -0.08 0.06 0.00 -1.36 0.00 0.00 55.97 54.59 3a9s s LYS 180 Cb 0.00 -2.36 -0.04 0.00 -1.68 0.00 0.00 37.83 33.75 3a9s s LYS 180 CO 0.00 -0.51 0.12 -1.12 -0.76 0.00 0.00 175.35 173.08 3a9s s SER 181 N -4.25 5.35 -0.19 2.83 0.01 -0.50 -0.71 113.70 116.24 3a9s s SER 181 Ca 0.51 -0.23 -0.03 0.00 1.31 0.00 0.00 55.95 57.51 3a9s s SER 181 Cb -0.10 -1.33 -0.02 0.00 0.21 0.00 0.00 66.02 64.78 3a9s s SER 181 CO 0.43 0.04 -0.05 -0.47 0.41 0.00 0.00 173.24 173.61 3a9s s TYR 182 N -1.87 2.97 -0.27 2.43 5.04 -0.21 -1.88 117.35 123.57 3a9s s TYR 182 Ca 0.31 -0.62 -0.09 0.00 -2.44 0.00 0.00 57.07 54.23 3a9s s TYR 182 Cb -0.09 -2.02 -0.04 0.00 0.35 0.00 0.00 41.96 40.16 3a9s s TYR 182 CO 0.23 -0.30 0.13 -1.17 -1.34 0.00 0.00 175.55 173.10 3a9s s LEU 183 N 0.92 3.73 -0.39 6.97 2.96 -0.55 -1.51 118.68 130.81 3a9s s LEU 183 Ca -0.00 -0.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.59 3a9s s LEU 183 Cb -0.15 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.54 3a9s s LEU 183 CO 0.01 -0.05 0.54 -0.55 -1.32 0.00 0.00 176.35 174.98 3a9s s SER 184 N 1.68 6.30 -0.42 3.68 0.15 0.18 -1.47 113.70 123.79 3a9s s SER 184 Ca 0.07 -0.23 -0.12 0.00 0.70 0.00 0.00 55.95 56.37 3a9s s SER 184 Cb -0.16 -2.28 0.06 0.00 -1.71 0.00 0.00 66.02 61.94 3a9s s SER 184 CO 0.07 -0.59 0.29 -0.63 1.20 0.00 0.00 173.24 173.58 3a9s s ILE 185 N 2.48 4.66 0.00 6.45 1.01 -0.24 -1.03 121.20 134.54 3a9s s ILE 185 Ca 0.19 -1.14 0.00 0.00 0.00 0.00 0.00 60.65 59.70 3a9s s ILE 185 Cb -0.15 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.56 3a9s s ILE 185 CO 0.15 -0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.24 3a9s n GLY 186 N 5.03 -1.76 0.00 6.18 0.00 0.03 -0.83 105.19 113.84 3a9s n GLY 186 Ca -0.11 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.87 3a9s n GLY 186 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3a9s n SER 187 N 0.00 0.00 -4.77 1.61 2.88 -1.26 -4.79 113.62 107.29 3a9s n SER 187 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 3a9s n SER 187 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 3a9s n SER 187 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3a9s s VAL 188 N 2.75 2.86 -0.29 2.46 1.01 -1.26 -4.64 120.40 123.29 3a9s s VAL 188 Ca 0.00 0.86 -0.07 0.00 0.00 0.00 0.00 61.98 62.77 3a9s s VAL 188 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.83 3a9s s VAL 188 CO 0.00 0.21 0.08 -0.55 0.00 0.00 0.00 175.10 174.84 3a9s s SER 189 N -0.56 5.13 -1.57 3.32 0.15 -1.26 -4.71 113.70 114.19 3a9s s SER 189 Ca 0.48 -0.60 -0.05 0.00 0.70 0.00 0.00 55.95 56.48 3a9s s SER 189 Cb -0.38 -1.89 0.05 0.00 -1.71 0.00 0.00 66.02 62.08 3a9s s SER 189 CO 0.51 -0.16 0.25 0.23 1.20 0.00 0.00 173.24 175.26 3a9s n MET 190 N 4.88 -1.66 -1.81 5.44 2.81 -1.26 -1.09 117.12 124.44 3a9s n MET 190 Ca -0.15 0.20 -0.20 0.00 -1.81 0.00 0.00 57.70 55.73 3a9s n MET 190 Cb 0.49 -4.09 -0.06 0.00 -0.71 0.00 0.00 33.22 28.85 3a9s n MET 190 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a9s n GLY 191 N -2.14 1.26 3.66 3.03 0.00 -1.26 -4.95 105.19 104.80 3a9s n GLY 191 Ca -0.23 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 3a9s n GLY 191 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a9s s ILE 192 N -2.82 4.39 0.26 -0.61 1.01 -0.25 -4.92 121.20 118.25 3a9s s ILE 192 Ca 0.00 1.68 -0.02 0.00 0.00 0.00 0.00 60.65 62.31 3a9s s ILE 192 Cb 0.00 -4.09 0.23 0.00 0.01 0.00 0.00 42.46 38.61 3a9s s ILE 192 CO 0.00 -0.14 1.76 0.00 0.00 0.00 0.00 174.94 176.57 3a9s h ALA 193 N 7.94 1.21 0.00 9.38 0.00 -1.92 -0.77 119.26 135.10 3a9s h ALA 193 Ca -0.25 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3a9s h ALA 193 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3a9s h ALA 193 CO 0.96 -0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.53 3a9s n GLY 194 N -1.32 -0.81 0.62 0.00 0.00 -1.26 -1.72 105.19 100.70 3a9s n GLY 194 Ca 0.16 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.28 3a9s n GLY 194 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a9s n SER 195 N -1.51 1.98 -4.72 1.61 3.41 -0.29 -1.34 113.62 112.76 3a9s n SER 195 Ca 0.02 -1.61 -0.40 0.00 -0.26 0.00 0.00 58.87 56.62 3a9s n SER 195 Cb 0.11 0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.05 3a9s n SER 195 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3a9s s VAL 196 N -2.07 5.02 -0.24 -3.33 1.01 -0.70 -4.29 120.40 115.80 3a9s s VAL 196 Ca 0.32 1.54 -0.19 0.00 0.00 0.00 0.00 61.98 63.65 3a9s s VAL 196 Cb 0.20 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 3a9s s VAL 196 CO 0.35 0.24 0.57 -0.69 0.00 0.00 0.00 175.10 175.57 3a9s s VAL 197 N 0.82 5.04 -0.58 2.92 1.01 -1.26 -4.90 120.40 123.45 3a9s s VAL 197 Ca 0.40 1.02 -0.10 0.00 0.00 0.00 0.00 61.98 63.29 3a9s s VAL 197 Cb -0.18 -3.88 0.15 0.00 0.00 0.00 0.00 36.38 32.46 3a9s s VAL 197 CO 0.20 0.08 0.47 -1.10 0.00 0.00 0.00 175.10 174.75 3a9s s GLN 198 N 2.22 2.81 0.38 2.72 -0.21 -1.26 -4.94 119.66 121.37 3a9s s GLN 198 Ca 0.24 -2.01 0.10 0.00 0.02 0.00 0.00 55.36 53.71 3a9s s GLN 198 Cb -0.16 -4.06 0.86 0.00 1.00 0.00 0.00 33.01 30.65 3a9s s GLN 198 CO 0.09 -1.23 1.92 0.93 -2.12 0.00 0.00 175.29 174.88 3a9s h GLU 199 N 8.17 0.61 -0.76 2.91 5.08 -2.00 -1.69 114.58 126.90 3a9s h GLU 199 Ca -0.13 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3a9s h GLU 199 Cb 1.05 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.12 3a9s h GLU 199 CO 0.85 0.41 0.50 0.22 -1.00 0.00 0.00 179.01 179.98 3a9s h ASP 200 N 0.63 0.72 0.26 1.42 1.82 -1.98 0.52 116.42 119.81 3a9s h ASP 200 Ca 0.37 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.00 3a9s h ASP 200 Cb 0.58 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 40.44 3a9s h ASP 200 CO -0.14 0.47 -0.12 0.15 -1.61 0.00 0.00 179.24 177.99 3a9s h PHE 201 N 0.82 -0.32 -0.41 0.28 3.57 -1.72 0.21 116.94 119.37 3a9s h PHE 201 Ca 0.33 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.83 3a9s h PHE 201 Cb 0.22 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3a9s h PHE 201 CO -0.00 -0.03 0.25 0.74 -2.23 0.00 0.00 178.31 177.04 3a9s h PHE 202 N -0.59 0.47 0.37 0.41 0.04 -1.44 -0.25 116.94 115.94 3a9s h PHE 202 Ca -0.04 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.73 3a9s h PHE 202 Cb 0.43 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.43 3a9s h PHE 202 CO 0.01 0.28 -0.18 0.37 -0.60 0.00 0.00 178.31 178.19 3a9s h GLN 203 N 0.51 -0.48 0.00 1.51 4.15 -0.91 0.82 115.11 120.72 3a9s h GLN 203 Ca 0.16 0.03 -0.21 0.00 0.77 0.00 0.00 58.65 59.41 3a9s h GLN 203 Cb -0.01 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 3a9s h GLN 203 CO -0.07 -0.17 -1.06 -0.91 -1.93 0.00 0.00 178.83 174.69 3a9s h ASN 204 N -0.82 0.00 0.08 -0.69 2.35 -0.98 -2.53 115.58 113.00 3a9s h ASN 204 Ca -0.05 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.33 3a9s h ASN 204 Cb 0.53 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 3a9s h ASN 204 CO 0.08 0.90 -2.19 -1.22 -1.65 0.00 0.00 177.43 173.36 3a9s n TYR 205 N -3.26 0.75 0.58 1.19 4.02 -0.11 -4.63 117.16 115.70 3a9s n TYR 205 Ca -0.03 0.16 0.07 0.00 -0.01 0.00 0.00 57.90 58.09 3a9s n TYR 205 Cb 0.92 -1.10 -0.09 0.00 -0.02 0.00 0.00 39.34 39.06 3a9s n TYR 205 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3a9s n LEU 206 N -3.38 0.58 -1.28 7.72 4.77 -1.04 -4.92 117.00 119.45 3a9s n LEU 206 Ca -0.37 -0.42 -0.12 0.00 -0.03 0.00 0.00 56.01 55.07 3a9s n LEU 206 Cb 1.03 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.10 3a9s n LEU 206 CO 0.36 0.14 -0.15 0.61 -1.33 0.00 0.00 177.39 177.03 3a9s n GLY 207 N 1.39 0.26 3.94 -0.72 0.00 -0.17 -3.63 105.19 106.27 3a9s n GLY 207 Ca 0.02 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 3a9s n GLY 207 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a9s s MET 208 N -4.18 3.18 0.13 1.61 1.00 0.11 -0.44 119.30 120.71 3a9s s MET 208 Ca 0.00 -0.94 0.03 0.00 0.00 0.00 0.00 55.69 54.78 3a9s s MET 208 Cb 0.00 -2.77 -0.04 0.00 0.00 0.00 0.00 34.83 32.02 3a9s s MET 208 CO 0.00 0.27 0.18 1.03 0.00 0.00 0.00 175.02 176.50 3a9s s ARG 209 N -4.02 3.11 -0.22 2.03 0.52 0.12 -3.52 118.95 116.97 3a9s s ARG 209 Ca 0.38 -0.71 -0.03 0.00 -0.52 0.00 0.00 55.73 54.85 3a9s s ARG 209 Cb -0.09 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.59 3a9s s ARG 209 CO 0.29 0.52 -0.07 -0.80 0.02 0.00 0.00 175.30 175.26 3a9s s ASN 210 N -2.94 4.07 0.09 0.23 0.01 -1.26 -1.04 114.94 114.10 3a9s s ASN 210 Ca 0.32 -0.51 0.08 0.00 -0.71 0.00 0.00 52.86 52.04 3a9s s ASN 210 Cb -0.11 -1.68 -0.04 0.00 0.41 0.00 0.00 41.25 39.83 3a9s s ASN 210 CO 0.25 -0.03 -0.14 -1.61 -1.51 0.00 0.00 177.10 174.06 3a9s s GLU 211 N 1.42 2.02 -0.01 -0.60 0.41 -0.57 -4.97 118.70 116.40 3a9s s GLU 211 Ca 0.05 -1.05 0.02 0.00 -0.41 0.00 0.00 54.97 53.58 3a9s s GLU 211 Cb -0.14 -2.22 -0.01 0.00 -1.78 0.00 0.00 34.13 29.98 3a9s s GLU 211 CO -0.05 0.51 -0.07 0.71 -0.49 0.00 0.00 175.26 175.86 3a9s s TYR 212 N -1.12 0.66 -0.14 1.61 1.51 -1.26 -0.65 117.35 117.96 3a9s s TYR 212 Ca 0.19 -0.12 -0.06 0.00 -1.01 0.00 0.00 57.07 56.06 3a9s s TYR 212 Cb -0.11 -0.42 0.06 0.00 -0.11 0.00 0.00 41.96 41.38 3a9s s TYR 212 CO 0.10 -0.01 0.31 0.54 -1.11 0.00 0.00 175.55 175.38 3a9s s VAL 213 N -0.17 -0.33 0.48 0.71 0.11 -0.20 -4.96 120.40 116.04 3a9s s VAL 213 Ca 0.03 0.20 -0.23 0.00 -2.93 0.00 0.00 61.98 59.06 3a9s s VAL 213 Cb -0.03 -0.50 -0.07 0.00 -1.53 0.00 0.00 36.38 34.26 3a9s s VAL 213 CO -0.00 0.09 1.19 -0.62 -3.33 0.00 0.00 175.10 172.42 3a9s s ASP 214 N 2.07 6.03 0.36 3.54 -1.08 -1.26 -0.79 116.67 125.53 3a9s s ASP 214 Ca -0.03 2.36 0.25 0.00 -0.52 0.00 0.00 52.55 54.61 3a9s s ASP 214 Cb -0.11 -2.61 1.31 0.00 -1.46 0.00 0.00 42.92 40.05 3a9s s ASP 214 CO -0.10 -1.02 1.76 0.24 0.52 0.00 0.00 175.17 176.57 3a9s h MET 215 N 1.92 0.00 0.00 4.34 2.86 -1.90 -1.49 114.93 120.66 3a9s h MET 215 Ca -0.50 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 3a9s h MET 215 Cb 1.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.92 3a9s h MET 215 CO 0.60 0.00 0.00 0.66 1.06 0.00 0.00 176.91 179.23 3a9s h SER 216 N 0.00 0.00 -0.45 1.22 4.64 -2.01 -0.45 113.55 116.50 3a9s h SER 216 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3a9s h SER 216 Cb 0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 3a9s h SER 216 CO 0.00 0.00 0.20 -0.08 -0.87 0.00 0.00 176.83 176.08 3a9s h GLU 217 N 0.00 0.71 -0.30 4.77 4.57 -1.64 -1.56 114.58 121.13 3a9s h GLU 217 Ca 0.00 -0.10 -0.09 0.00 -1.18 0.00 0.00 59.36 57.99 3a9s h GLU 217 Cb 0.09 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 3a9s h GLU 217 CO 0.00 0.59 -0.21 0.74 -1.18 0.00 0.00 179.01 178.94 3a9s h PHE 218 N 0.71 0.63 -0.27 0.92 -1.00 -1.29 -1.38 116.94 115.25 3a9s h PHE 218 Ca 0.17 -0.13 -0.02 0.00 2.81 0.00 0.00 57.97 60.81 3a9s h PHE 218 Cb 0.14 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.53 3a9s h PHE 218 CO 0.01 0.73 0.11 0.28 -1.61 0.00 0.00 178.31 177.83 3a9s h VAL 219 N 0.50 1.18 -0.04 -0.55 2.07 -1.36 -0.92 116.25 117.13 3a9s h VAL 219 Ca 0.08 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 3a9s h VAL 219 Cb 0.64 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3a9s h VAL 219 CO 0.05 0.18 0.02 -0.09 0.02 0.00 0.00 177.57 177.75 3a9s h ARG 220 N 0.29 0.05 -0.21 1.57 2.43 -1.13 -0.48 114.38 116.91 3a9s h ARG 220 Ca 0.09 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 3a9s h ARG 220 Cb 0.18 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3a9s h ARG 220 CO -0.01 0.10 -0.14 0.00 -1.51 0.00 0.00 179.97 178.41 3a9s h ARG 221 N -0.00 0.35 -0.01 0.20 3.08 -1.19 0.40 114.38 117.20 3a9s h ARG 221 Ca 0.01 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3a9s h ARG 221 Cb 0.06 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 3a9s h ARG 221 CO -0.00 0.49 -0.02 0.82 -1.07 0.00 0.00 179.97 180.19 3a9s h ILE 222 N 0.32 1.43 -0.80 2.04 2.04 -0.99 0.19 117.51 121.75 3a9s h ILE 222 Ca 0.06 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.58 3a9s h ILE 222 Cb 0.45 2.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.79 3a9s h ILE 222 CO 0.03 0.34 0.38 -0.33 0.00 0.00 0.00 178.15 178.57 3a9s h GLU 223 N -0.51 1.16 -0.22 2.37 4.39 -0.90 -2.94 114.58 117.93 3a9s h GLU 223 Ca 0.00 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.53 3a9s h GLU 223 Cb 0.57 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3a9s h GLU 223 CO 0.00 0.90 0.00 1.28 -1.16 0.00 0.00 179.01 180.03 3a9s n LEU 224 N -4.34 2.40 -3.11 1.33 4.77 0.12 -4.96 117.00 113.21 3a9s n LEU 224 Ca 0.07 -0.98 -0.19 0.00 -0.03 0.00 0.00 56.01 54.88 3a9s n LEU 224 Cb 0.14 -0.13 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 3a9s n LEU 224 CO 0.40 0.49 0.19 0.61 -1.33 0.00 0.00 177.39 177.75 3a9s n GLY 225 N 1.29 -0.30 3.28 -0.72 0.00 -0.65 -4.91 105.19 103.17 3a9s n GLY 225 Ca 0.17 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 3a9s n GLY 225 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3a9s n ILE 226 N -4.46 4.28 -3.62 -0.61 5.41 0.58 -4.84 119.36 116.10 3a9s n ILE 226 Ca -0.03 -4.62 -0.02 0.00 1.00 0.00 0.00 62.75 59.08 3a9s n ILE 226 Cb 0.57 -2.43 -0.01 0.00 -0.71 0.00 0.00 39.64 37.05 3a9s n ILE 226 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3a9s s TYR 227 N 1.24 -0.12 -0.59 1.39 -0.85 -1.26 -4.85 117.35 112.31 3a9s s TYR 227 Ca 0.42 0.00 -0.27 0.00 -0.52 0.00 0.00 57.07 56.70 3a9s s TYR 227 Cb 0.01 0.55 -0.01 0.00 0.38 0.00 0.00 41.96 42.89 3a9s s TYR 227 CO 0.00 -0.38 1.74 0.34 -1.52 0.00 0.00 175.55 175.74 3a9s s ASP 228 N -2.65 5.53 0.32 -0.18 -1.08 -1.26 -4.86 116.67 112.48 3a9s s ASP 228 Ca 0.11 0.37 0.02 0.00 -0.52 0.00 0.00 52.55 52.53 3a9s s ASP 228 Cb 0.01 -2.53 0.53 0.00 -1.46 0.00 0.00 42.92 39.47 3a9s s ASP 228 CO -0.04 -2.17 1.87 0.11 0.52 0.00 0.00 175.17 175.46 3a9s h LYS 229 N 13.79 0.68 -0.55 4.34 1.57 -1.99 0.18 116.57 134.59 3a9s h LYS 229 Ca -0.27 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.28 3a9s h LYS 229 Cb 1.14 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 3a9s h LYS 229 CO 1.20 0.63 -0.05 0.93 -0.57 0.00 0.00 179.45 181.58 3a9s h GLU 230 N 0.66 1.01 -0.53 3.15 5.08 -2.00 -1.75 114.58 120.20 3a9s h GLU 230 Ca 0.15 -0.35 -0.12 0.00 -1.00 0.00 0.00 59.36 58.04 3a9s h GLU 230 Cb 0.27 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3a9s h GLU 230 CO -0.00 1.03 -0.12 1.49 -1.00 0.00 0.00 179.01 180.41 3a9s h GLU 231 N 0.89 1.01 -0.46 2.33 4.81 -1.87 -2.57 114.58 118.74 3a9s h GLU 231 Ca 0.15 -0.39 0.07 0.00 -0.13 0.00 0.00 59.36 59.07 3a9s h GLU 231 Cb 0.61 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.87 3a9s h GLU 231 CO 0.04 1.07 0.09 -0.92 -0.73 0.00 0.00 179.01 178.56 3a9s h TYR 232 N 0.89 0.14 -0.77 0.92 5.03 -0.65 0.30 116.97 122.82 3a9s h TYR 232 Ca 0.13 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.46 3a9s h TYR 232 Cb 0.70 0.01 -0.04 0.00 1.55 0.00 0.00 36.73 38.95 3a9s h TYR 232 CO 0.05 -0.00 0.43 0.93 -1.32 0.00 0.00 178.16 178.24 3a9s h GLU 233 N 0.22 1.07 -0.61 1.82 4.39 -1.18 -0.03 114.58 120.27 3a9s h GLU 233 Ca 0.23 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.71 3a9s h GLU 233 Cb 0.29 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 3a9s h GLU 233 CO -0.30 0.79 0.01 0.00 -1.16 0.00 0.00 179.01 178.36 3a9s h ARG 234 N 1.07 1.06 -0.30 2.33 3.08 -0.92 -2.24 114.38 118.46 3a9s h ARG 234 Ca 0.27 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3a9s h ARG 234 Cb 0.03 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3a9s h ARG 234 CO -0.04 1.02 0.07 0.00 -1.07 0.00 0.00 179.97 179.95 3a9s h ALA 235 N 1.03 0.40 -0.80 0.04 0.00 0.05 -0.64 119.26 119.34 3a9s h ALA 235 Ca 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3a9s h ALA 235 Cb 0.54 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3a9s h ALA 235 CO 0.03 0.07 0.46 1.25 0.00 0.00 0.00 179.25 181.05 3a9s h LEU 236 N 0.33 0.98 -0.42 0.00 5.85 -0.93 0.24 115.31 121.36 3a9s h LEU 236 Ca 0.10 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 3a9s h LEU 236 Cb 0.30 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3a9s h LEU 236 CO 0.00 0.78 0.10 0.50 -0.34 0.00 0.00 178.44 179.48 3a9s h LYS 237 N 1.11 0.68 -0.74 1.25 3.64 -1.25 -1.50 116.57 119.77 3a9s h LYS 237 Ca 0.29 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3a9s h LYS 237 Cb -0.00 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 3a9s h LYS 237 CO -0.05 0.69 0.47 2.35 -2.27 0.00 0.00 179.45 180.65 3a9s h TRP 238 N 0.55 0.94 -0.07 1.91 7.01 -0.64 -1.84 115.95 123.82 3a9s h TRP 238 Ca 0.13 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 3a9s h TRP 238 Cb 0.32 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 27.06 3a9s h TRP 238 CO 0.02 0.61 0.04 0.28 -2.79 0.00 0.00 178.44 176.59 3a9s h VAL 239 N 1.00 1.10 -0.10 2.65 2.07 -0.72 0.44 116.25 122.70 3a9s h VAL 239 Ca 0.27 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 3a9s h VAL 239 Cb -0.09 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3a9s h VAL 239 CO -0.05 0.09 0.05 0.11 0.02 0.00 0.00 177.57 177.79 3a9s h LYS 240 N 0.00 0.13 0.02 1.57 1.79 -1.01 0.16 116.57 119.23 3a9s h LYS 240 Ca 0.02 -0.01 -0.27 0.00 -2.18 0.00 0.00 60.65 58.22 3a9s h LYS 240 Cb 0.11 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.69 3a9s h LYS 240 CO -0.00 0.09 -1.48 0.93 -1.08 0.00 0.00 179.45 177.91 3a9s h GLU 241 N 0.13 0.04 0.00 3.15 5.08 -1.02 -3.41 114.58 118.55 3a9s h GLU 241 Ca 0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3a9s h GLU 241 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3a9s h GLU 241 CO -0.01 0.74 -1.33 0.09 -1.00 0.00 0.00 179.01 177.51 3a9s n ASN 242 N -3.20 2.95 -4.35 1.42 3.02 0.12 -4.92 115.26 110.31 3a9s n ASN 242 Ca -0.12 -0.04 -0.45 0.00 -0.03 0.00 0.00 54.58 53.94 3a9s n ASN 242 Cb 1.02 1.36 -0.06 0.00 -0.61 0.00 0.00 39.78 41.49 3a9s n ASN 242 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a9s s LYS 244 N 1.67 4.45 -0.19 0.00 1.02 -1.26 -4.77 119.74 120.65 3a9s s LYS 244 Ca 0.04 1.79 -0.22 0.00 0.02 0.00 0.00 55.97 57.60 3a9s s LYS 244 Cb -0.27 -3.33 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 3a9s s LYS 244 CO 0.05 -0.22 0.67 0.08 -0.92 0.00 0.00 175.35 175.01 3a9s s VAL 245 N 0.84 5.00 0.82 3.17 1.01 -1.26 -0.29 120.40 129.68 3a9s s VAL 245 Ca 0.58 1.28 -0.05 0.00 0.00 0.00 0.00 61.98 63.78 3a9s s VAL 245 Cb -0.30 -3.99 0.17 0.00 0.00 0.00 0.00 36.38 32.27 3a9s s VAL 245 CO 0.30 0.10 1.12 0.61 0.00 0.00 0.00 175.10 177.24 3a9s n GLY 246 N 3.70 -0.00 3.70 4.51 0.00 0.44 -4.84 105.19 112.70 3a9s n GLY 246 Ca -0.00 -1.94 -0.38 0.00 0.00 0.00 0.00 46.02 43.70 3a9s n GLY 246 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a9s n PRO 247 N -3.18 1.35 -3.18 1.61 -0.02 -1.26 -4.62 135.00 125.69 3a9s n PRO 247 Ca 0.17 0.51 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3a9s n PRO 247 Cb 0.60 -2.45 -0.07 0.00 -0.02 0.00 0.00 33.50 31.56 3a9s n PRO 247 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3a9s s ASP 248 N -1.10 6.41 0.00 2.55 -1.08 -1.26 -4.49 116.67 117.70 3a9s s ASP 248 Ca 0.75 0.26 0.27 0.00 -0.52 0.00 0.00 52.55 53.31 3a9s s ASP 248 Cb -0.41 -2.30 0.88 0.00 -1.46 0.00 0.00 42.92 39.62 3a9s s ASP 248 CO 0.47 -0.45 1.65 0.59 0.52 0.00 0.00 175.17 177.95 3a9s n ASN 249 N 5.79 0.50 -4.72 -0.34 4.13 -1.26 -4.86 115.26 114.50 3a9s n ASN 249 Ca -0.03 -0.32 -0.42 0.00 1.68 0.00 0.00 54.58 55.49 3a9s n ASN 249 Cb 0.49 0.01 -0.03 0.00 -1.54 0.00 0.00 39.78 38.71 3a9s n ASN 249 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3a9s s ASN 250 N -2.77 6.75 -0.25 6.41 0.01 -1.26 -4.95 114.94 118.88 3a9s s ASN 250 Ca 0.19 2.44 -0.24 0.00 -0.71 0.00 0.00 52.86 54.54 3a9s s ASN 250 Cb 0.19 -2.59 -0.00 0.00 0.41 0.00 0.00 41.25 39.25 3a9s s ASN 250 CO 0.58 -0.69 0.82 -0.13 -1.51 0.00 0.00 177.10 176.16 3a9s s ARG 251 N 0.84 4.14 0.00 -0.60 0.52 -1.26 -4.52 118.95 118.08 3a9s s ARG 251 Ca 0.65 0.87 0.00 0.00 -0.52 0.00 0.00 55.73 56.72 3a9s s ARG 251 Cb -0.39 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.42 3a9s s ARG 251 CO 0.33 -0.54 0.00 -0.25 0.02 0.00 0.00 175.30 174.85 3a9s n ASP 252 N 6.04 0.00 0.27 0.23 8.00 -1.26 0.31 116.55 130.14 3a9s n ASP 252 Ca 0.05 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.73 3a9s n ASP 252 Cb 0.48 0.00 0.92 0.00 -0.02 0.00 0.00 41.12 42.50 3a9s n ASP 252 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3a9s h GLY 253 N 0.00 0.00 -0.94 0.44 0.00 -2.03 -1.91 103.07 98.63 3a9s h GLY 253 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3a9s h GLY 253 CO 0.00 0.00 -0.01 0.69 0.00 0.00 0.00 176.54 177.22 3a9s n PHE 254 N -3.34 0.00 -2.40 5.60 3.01 0.15 -5.02 117.46 115.46 3a9s n PHE 254 Ca -0.00 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.04 3a9s n PHE 254 Cb 0.29 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.73 3a9s n PHE 254 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3a9s s LYS 255 N -1.00 4.50 0.35 -1.08 1.02 -0.72 -4.65 119.74 118.18 3a9s s LYS 255 Ca 0.14 1.85 -0.12 0.00 0.02 0.00 0.00 55.97 57.86 3a9s s LYS 255 Cb 0.10 -3.25 -0.07 0.00 -0.52 0.00 0.00 37.83 34.09 3a9s s LYS 255 CO 0.15 -0.07 0.73 1.03 -0.92 0.00 0.00 175.35 176.27 3a9s s ARG 256 N -0.21 3.85 0.97 1.68 0.52 -1.26 -5.01 118.95 119.49 3a9s s ARG 256 Ca 0.52 0.49 -0.12 0.00 -0.52 0.00 0.00 55.73 56.10 3a9s s ARG 256 Cb -0.32 -2.44 0.17 0.00 0.52 0.00 0.00 34.95 32.88 3a9s s ARG 256 CO 0.36 0.08 1.10 0.95 0.02 0.00 0.00 175.30 177.81 3a9s s THR 257 N -2.17 2.07 0.22 0.02 -4.23 -1.26 -4.80 115.64 105.49 3a9s s THR 257 Ca 0.51 0.02 -0.08 0.00 -1.18 0.00 0.00 61.69 60.97 3a9s s THR 257 Cb -0.10 -2.59 0.18 0.00 1.34 0.00 0.00 72.50 71.32 3a9s s THR 257 CO 0.26 -0.03 1.82 -0.08 -0.54 0.00 0.00 174.62 176.04 3a9s h GLU 258 N -1.78 1.19 -0.41 3.99 4.81 -1.99 -0.73 114.58 119.66 3a9s h GLU 258 Ca -0.53 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 58.49 3a9s h GLU 258 Cb 1.33 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 3a9s h GLU 258 CO 0.59 0.91 0.11 1.49 -0.73 0.00 0.00 179.01 181.38 3a9s h GLU 259 N 1.18 0.65 -0.41 1.92 4.81 -2.00 -2.27 114.58 118.46 3a9s h GLU 259 Ca 0.29 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3a9s h GLU 259 Cb 0.10 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 3a9s h GLU 259 CO -0.04 0.66 0.21 1.96 -0.73 0.00 0.00 179.01 181.07 3a9s h GLN 260 N 0.52 0.58 -0.46 1.92 4.20 -1.84 -2.04 115.11 117.99 3a9s h GLN 260 Ca 0.13 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.79 3a9s h GLN 260 Cb 0.29 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 3a9s h GLN 260 CO -0.00 0.49 0.31 0.87 -0.67 0.00 0.00 178.83 179.82 3a9s h LYS 261 N 0.53 0.53 -0.24 1.46 1.57 -0.99 0.36 116.57 119.79 3a9s h LYS 261 Ca 0.14 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.72 3a9s h LYS 261 Cb 0.09 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3a9s h LYS 261 CO -0.02 0.35 -0.51 1.49 -0.57 0.00 0.00 179.45 180.19 3a9s h GLU 262 N 0.54 0.76 -0.32 3.15 4.57 -1.09 -2.74 114.58 119.46 3a9s h GLU 262 Ca 0.18 -0.50 -0.08 0.00 -1.18 0.00 0.00 59.36 57.77 3a9s h GLU 262 Cb 0.06 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 3a9s h GLU 262 CO -0.04 1.13 -0.16 -0.22 -1.18 0.00 0.00 179.01 178.54 3a9s h LYS 263 N 0.50 0.56 -0.99 1.92 3.64 -0.60 -2.18 116.57 119.42 3a9s h LYS 263 Ca 0.00 -0.18 0.05 0.00 -1.27 0.00 0.00 60.65 59.25 3a9s h LYS 263 Cb 1.12 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.83 3a9s h LYS 263 CO 0.11 0.70 0.65 -0.44 -2.27 0.00 0.00 179.45 178.20 3a9s h ASP 264 N 0.51 1.06 -0.19 4.20 3.32 -0.17 -0.43 116.42 124.72 3a9s h ASP 264 Ca 0.09 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 3a9s h ASP 264 Cb 0.57 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 3a9s h ASP 264 CO 0.04 0.70 -0.13 -0.50 -1.72 0.00 0.00 179.24 177.63 3a9s h TRP 265 N 1.21 0.49 -0.32 4.55 -0.00 -1.13 -1.03 115.95 119.72 3a9s h TRP 265 Ca 0.41 -0.13 0.01 0.00 -0.00 0.00 0.00 58.89 59.18 3a9s h TRP 265 Cb 0.07 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 29.10 3a9s h TRP 265 CO -0.00 0.75 0.19 0.93 -0.00 0.00 0.00 178.44 180.30 3a9s h GLU 266 N 0.09 0.37 -0.34 0.49 5.08 -0.94 -1.21 114.58 118.13 3a9s h GLU 266 Ca 0.04 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.24 3a9s h GLU 266 Cb 0.64 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 3a9s h GLU 266 CO 0.04 0.25 -0.35 0.82 -1.00 0.00 0.00 179.01 178.77 3a9s h ILE 267 N 0.38 1.28 -0.98 3.13 2.04 -1.14 -1.92 117.51 120.31 3a9s h ILE 267 Ca 0.13 -1.51 0.01 0.00 1.00 0.00 0.00 64.86 64.49 3a9s h ILE 267 Cb 0.00 1.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 3a9s h ILE 267 CO -0.06 0.49 0.64 0.28 0.00 0.00 0.00 178.15 179.50 3a9s h SER 268 N 0.65 1.14 -0.24 1.72 0.02 -0.85 0.82 113.55 116.81 3a9s h SER 268 Ca 0.06 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3a9s h SER 268 Cb 0.89 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 3a9s h SER 268 CO 0.08 0.83 -0.16 0.58 -1.14 0.00 0.00 176.83 177.02 3a9s h VAL 269 N 1.34 1.31 -0.62 2.27 2.07 -1.10 -2.67 116.25 118.85 3a9s h VAL 269 Ca 0.36 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3a9s h VAL 269 Cb -0.14 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 3a9s h VAL 269 CO -0.08 0.40 0.35 0.11 0.02 0.00 0.00 177.57 178.37 3a9s h LYS 270 N 0.24 0.84 -0.88 1.57 1.57 -0.91 -1.65 116.57 117.35 3a9s h LYS 270 Ca 0.05 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3a9s h LYS 270 Cb 0.69 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.78 3a9s h LYS 270 CO 0.04 0.61 0.47 0.52 -0.57 0.00 0.00 179.45 180.52 3a9s h MET 271 N 0.85 1.25 -0.36 3.15 2.86 -0.71 -0.62 114.93 121.36 3a9s h MET 271 Ca 0.22 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 3a9s h MET 271 Cb -0.00 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.41 3a9s h MET 271 CO -0.04 0.92 0.17 0.00 1.06 0.00 0.00 176.91 179.03 3a9s h ALA 272 N 1.26 0.46 -0.32 6.32 0.00 -0.97 -0.58 119.26 125.44 3a9s h ALA 272 Ca 0.31 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3a9s h ALA 272 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3a9s h ALA 272 CO -0.05 0.02 0.15 -0.07 0.00 0.00 0.00 179.25 179.31 3a9s h LEU 273 N 0.44 0.42 -0.39 0.00 3.38 -1.04 -2.17 115.31 115.95 3a9s h LEU 273 Ca 0.12 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3a9s h LEU 273 Cb 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3a9s h LEU 273 CO -0.02 0.43 0.19 0.40 0.09 0.00 0.00 178.44 179.54 3a9s h ILE 274 N 0.37 1.17 -0.29 1.22 2.04 -0.99 0.02 117.51 121.05 3a9s h ILE 274 Ca 0.11 -0.47 0.01 0.00 1.00 0.00 0.00 64.86 65.51 3a9s h ILE 274 Cb 0.13 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3a9s h ILE 274 CO -0.01 0.18 0.18 0.00 0.00 0.00 0.00 178.15 178.49 3a9s h ALA 275 N 1.04 0.36 -0.50 1.87 0.00 -1.02 -0.19 119.26 120.83 3a9s h ALA 275 Ca 0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3a9s h ALA 275 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3a9s h ALA 275 CO -0.02 -0.19 0.19 -0.09 0.00 0.00 0.00 179.25 179.15 3a9s h ARG 276 N 0.36 0.75 -0.55 0.00 2.43 -1.23 -1.82 114.38 114.33 3a9s h ARG 276 Ca 0.11 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3a9s h ARG 276 Cb -0.02 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 3a9s h ARG 276 CO -0.04 0.67 0.35 -0.44 -1.51 0.00 0.00 179.97 179.00 3a9s h ASP 277 N 0.67 0.64 -0.46 -3.80 3.32 -0.64 -1.50 116.42 114.65 3a9s h ASP 277 Ca 0.17 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 3a9s h ASP 277 Cb 0.21 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3a9s h ASP 277 CO -0.01 0.47 -0.21 -0.07 -1.72 0.00 0.00 179.24 177.70 3a9s h LEU 278 N 0.74 1.00 -0.09 1.55 3.38 -0.58 0.18 115.31 121.50 3a9s h LEU 278 Ca 0.20 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 3a9s h LEU 278 Cb -0.06 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 3a9s h LEU 278 CO -0.04 1.16 -0.08 0.24 0.09 0.00 0.00 178.44 179.81 3a9s h MET 279 N 0.84 0.22 0.00 1.13 2.86 -0.55 0.16 114.93 119.59 3a9s h MET 279 Ca 0.11 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3a9s h MET 279 Cb 0.78 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 3a9s h MET 279 CO 0.06 0.63 0.00 1.33 1.06 0.00 0.00 176.91 180.00 3a9s n VAL 280 N -4.68 0.66 -0.25 -2.22 0.24 -0.64 -0.95 118.33 110.49 3a9s n VAL 280 Ca -0.07 -0.77 0.03 0.00 -2.04 0.00 0.00 64.34 61.50 3a9s n VAL 280 Cb 0.31 0.70 -0.01 0.00 -1.47 0.00 0.00 33.84 33.37 3a9s n VAL 280 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3a9s n GLY 281 N -0.33 -1.39 3.27 7.63 0.00 0.65 -4.74 105.19 110.27 3a9s n GLY 281 Ca 0.00 -1.47 0.03 0.00 0.00 0.00 0.00 46.02 44.58 3a9s n GLY 281 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3a9s s ASN 282 N -2.95 -1.03 0.52 1.61 3.84 -0.23 -4.58 114.94 112.11 3a9s s ASN 282 Ca 0.00 0.85 0.23 0.00 0.21 0.00 0.00 52.86 54.15 3a9s s ASN 282 Cb 0.00 1.95 1.34 0.00 -0.55 0.00 0.00 41.25 43.99 3a9s s ASN 282 CO 0.00 -0.19 2.01 0.50 -2.79 0.00 0.00 177.10 176.63 3a9s h LYS 283 N 7.93 0.04 -0.56 0.43 1.63 -1.94 -0.91 116.57 123.20 3a9s h LYS 283 Ca -0.19 -0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.64 3a9s h LYS 283 Cb 1.15 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.74 3a9s h LYS 283 CO 0.13 0.03 0.37 -0.22 -3.45 0.00 0.00 179.45 176.31 3a9s h LYS 284 N 0.05 0.61 -0.27 1.90 1.63 -1.95 -1.56 116.57 116.97 3a9s h LYS 284 Ca 0.23 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.93 3a9s h LYS 284 Cb 0.86 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.33 3a9s h LYS 284 CO -0.01 0.40 -0.09 -0.07 -3.45 0.00 0.00 179.45 176.24 3a9s h LEU 285 N 0.63 0.42 -0.45 5.20 3.38 -1.47 -2.11 115.31 120.91 3a9s h LEU 285 Ca 0.22 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 3a9s h LEU 285 Cb 0.11 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3a9s h LEU 285 CO -0.06 0.55 0.03 -0.08 0.09 0.00 0.00 178.44 178.97 3a9s h GLU 286 N 0.42 0.77 0.00 1.13 4.81 -1.38 0.73 114.58 121.06 3a9s h GLU 286 Ca 0.08 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 3a9s h GLU 286 Cb 0.41 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 3a9s h GLU 286 CO 0.02 0.82 -0.10 0.93 -0.73 0.00 0.00 179.01 179.95 3a9s h GLU 287 N 0.62 0.00 -0.00 1.92 5.08 -1.25 -1.55 114.58 119.40 3a9s h GLU 287 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3a9s h GLU 287 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3a9s h GLU 287 CO 0.02 0.10 -0.08 -1.33 -1.00 0.00 0.00 179.01 176.72 3a9s n MET 288 N -4.17 0.70 -0.17 2.33 2.81 -0.83 -4.90 117.12 112.88 3a9s n MET 288 Ca -0.03 -0.20 0.00 0.00 -1.81 0.00 0.00 57.70 55.67 3a9s n MET 288 Cb 0.18 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 3a9s n MET 288 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a9s n GLY 289 N 1.25 0.90 2.57 3.03 0.00 -0.58 -5.02 105.19 107.34 3a9s n GLY 289 Ca 0.15 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 3a9s n GLY 289 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a9s n TYR 290 N -2.17 3.23 -0.29 1.61 4.02 0.20 -4.94 117.16 118.82 3a9s n TYR 290 Ca 0.00 -4.03 0.01 0.00 -0.01 0.00 0.00 57.90 53.87 3a9s n TYR 290 Cb 0.00 -0.51 0.21 0.00 -0.02 0.00 0.00 39.34 39.02 3a9s n TYR 290 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3a9s h GLY 291 N 3.65 1.25 0.74 2.72 0.00 -1.80 -1.53 103.07 108.10 3a9s h GLY 291 Ca 0.16 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 3a9s h GLY 291 CO 0.78 0.39 -0.04 -2.09 0.00 0.00 0.00 176.54 175.58 3a9s h GLU 292 N 1.12 0.26 -0.06 4.80 4.81 -1.94 -2.99 114.58 120.58 3a9s h GLU 292 Ca 0.34 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 3a9s h GLU 292 Cb -0.02 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 3a9s h GLU 292 CO -0.10 0.56 -0.06 0.93 -0.73 0.00 0.00 179.01 179.62 3a9s h GLU 293 N -0.05 0.08 0.00 1.92 3.07 -1.91 -2.28 114.58 115.40 3a9s h GLU 293 Ca 0.03 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.87 3a9s h GLU 293 Cb 0.47 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.36 3a9s h GLU 293 CO 0.01 0.15 -0.07 0.00 -1.40 0.00 0.00 179.01 177.70 3a9s h ALA 294 N 1.86 1.33 -0.54 3.43 0.00 -1.13 -3.09 119.26 121.12 3a9s h ALA 294 Ca 0.02 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3a9s h ALA 294 Cb 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3a9s h ALA 294 CO 0.01 0.09 -0.07 -0.07 0.00 0.00 0.00 179.25 179.21 3a9s h LEU 295 N 0.00 1.00 0.00 0.00 3.38 -1.43 -0.60 115.31 117.66 3a9s h LEU 295 Ca -0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3a9s h LEU 295 Cb 0.22 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3a9s h LEU 295 CO 0.01 1.10 0.00 0.61 0.09 0.00 0.00 178.44 180.25 3a9s n GLY 296 N -0.30 -1.10 0.87 0.83 0.00 -1.17 -4.05 105.19 100.27 3a9s n GLY 296 Ca 0.01 -1.63 0.08 0.00 0.00 0.00 0.00 46.02 44.48 3a9s n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9s n ARG 297 N -1.14 3.01 -4.10 1.61 5.12 0.57 -4.82 116.66 116.90 3a9s n ARG 297 Ca 0.00 -2.58 -0.29 0.00 -1.93 0.00 0.00 57.85 53.05 3a9s n ARG 297 Cb 0.00 -1.66 -0.04 0.00 -1.16 0.00 0.00 32.46 29.59 3a9s n ARG 297 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3a9s n ASN 298 N -0.05 -0.54 -4.61 0.55 5.15 -1.00 -4.57 115.26 110.20 3a9s n ASN 298 Ca 0.18 -1.08 -0.38 0.00 -0.60 0.00 0.00 54.58 52.70 3a9s n ASN 298 Cb 0.74 -2.61 -0.10 0.00 -0.53 0.00 0.00 39.78 37.28 3a9s n ASN 298 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3a9s s ALA 299 N -3.93 3.55 -1.27 5.20 0.00 -0.13 -1.41 121.76 123.76 3a9s s ALA 299 Ca 0.15 -0.96 0.27 0.00 0.00 0.00 0.00 51.96 51.42 3a9s s ALA 299 Cb -0.08 -2.52 0.89 0.00 0.00 0.00 0.00 23.12 21.41 3a9s s ALA 299 CO 0.93 -0.50 1.66 1.51 0.00 0.00 0.00 175.76 179.36 3a9s n ILE 300 N 4.91 0.00 -3.56 0.00 3.06 -0.79 -4.68 119.36 118.30 3a9s n ILE 300 Ca -0.13 -0.03 -0.17 0.00 -2.50 0.00 0.00 62.75 59.92 3a9s n ILE 300 Cb 0.52 0.02 -0.06 0.00 0.54 0.00 0.00 39.64 40.65 3a9s n ILE 300 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 3a9s s VAL 301 N -2.79 0.00 0.30 9.51 0.11 -1.22 -4.34 120.40 121.96 3a9s s VAL 301 Ca 0.18 -0.04 -0.11 0.00 -2.93 0.00 0.00 61.98 59.08 3a9s s VAL 301 Cb 0.19 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 3a9s s VAL 301 CO 0.58 -0.02 0.55 0.00 -3.33 0.00 0.00 175.10 172.87 3a9s s ALA 302 N -0.90 -0.13 0.06 1.54 0.00 -0.88 -1.48 121.76 119.97 3a9s s ALA 302 Ca -0.09 -0.98 -0.09 0.00 0.00 0.00 0.00 51.96 50.80 3a9s s ALA 302 Cb -0.01 1.01 -0.00 0.00 0.00 0.00 0.00 23.12 24.12 3a9s s ALA 302 CO 0.08 -0.87 0.18 0.20 0.00 0.00 0.00 175.76 175.34 3a9s s GLY 303 N -3.08 0.08 -0.13 0.00 0.00 -0.54 -0.05 107.32 103.60 3a9s s GLY 303 Ca 0.23 -0.46 -0.00 0.00 0.00 0.00 0.00 44.72 44.49 3a9s s GLY 303 CO 0.12 -0.63 -0.10 -0.12 0.00 0.00 0.00 173.10 172.37 3a9s s PHE 304 N -3.11 1.79 0.09 1.90 5.36 -0.66 -1.08 117.98 122.27 3a9s s PHE 304 Ca -0.01 -0.96 -0.33 0.00 -0.96 0.00 0.00 56.93 54.67 3a9s s PHE 304 Cb 0.02 -1.39 -0.15 0.00 -0.34 0.00 0.00 43.02 41.15 3a9s s PHE 304 CO -0.07 -0.58 1.59 0.37 -1.46 0.00 0.00 175.22 175.07 3a9s h GLN 305 N 8.12 -0.85 0.00 10.12 4.15 -1.25 -0.84 115.11 134.57 3a9s h GLN 305 Ca -0.33 0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.14 3a9s h GLN 305 Cb 1.13 0.19 0.00 0.00 0.21 0.00 0.00 27.48 29.01 3a9s h GLN 305 CO 0.46 -0.56 0.00 0.41 -1.93 0.00 0.00 178.83 177.21 3a9s n GLY 306 N -1.51 1.48 3.77 2.39 0.00 -1.26 -3.92 105.19 106.13 3a9s n GLY 306 Ca -0.11 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3a9s n GLY 306 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a9s s GLN 307 N 0.00 4.19 -0.17 1.61 -0.21 -1.26 -1.44 119.66 122.38 3a9s s GLN 307 Ca 0.00 2.00 0.17 0.00 0.02 0.00 0.00 55.36 57.55 3a9s s GLN 307 Cb 0.00 -2.86 -0.25 0.00 1.00 0.00 0.00 33.01 30.90 3a9s s GLN 307 CO 0.00 -0.25 0.18 0.54 -2.12 0.00 0.00 175.29 173.64 3a9s n ARG 308 N 0.43 0.68 -0.10 2.91 5.12 -1.26 -4.07 116.66 120.37 3a9s n ARG 308 Ca 0.02 0.04 -0.06 0.00 -1.93 0.00 0.00 57.85 55.93 3a9s n ARG 308 Cb 0.44 -1.57 0.00 0.00 -1.16 0.00 0.00 32.46 30.18 3a9s n ARG 308 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 3a9s h GLN 309 N 0.00 -0.11 -0.05 5.56 7.50 -1.96 -1.58 115.11 124.47 3a9s h GLN 309 Ca -0.50 0.01 -0.03 0.00 0.50 0.00 0.00 58.65 58.63 3a9s h GLN 309 Cb 2.20 0.02 -0.00 0.00 0.05 0.00 0.00 27.48 29.75 3a9s h GLN 309 CO 0.04 -0.07 -0.07 2.35 -1.50 0.00 0.00 178.83 179.58 3a9s h TRP 310 N -0.11 0.16 0.00 2.96 2.91 -1.58 -3.28 115.95 117.01 3a9s h TRP 310 Ca 0.18 -0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.14 3a9s h TRP 310 Cb 0.39 -0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.00 3a9s h TRP 310 CO -0.39 0.62 0.00 1.79 -1.03 0.00 0.00 178.44 179.43 3a9s h THR 311 N -0.35 0.00 0.00 2.65 1.35 -1.51 0.18 112.91 115.23 3a9s h THR 311 Ca 0.01 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 3a9s h THR 311 Cb 0.61 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3a9s h THR 311 CO 0.02 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.76 3a9s n ASP 312 N -2.82 0.42 0.00 5.36 8.00 -0.60 -0.48 116.55 126.43 3a9s n ASP 312 Ca 0.00 0.59 0.00 0.00 0.71 0.00 0.00 54.79 56.10 3a9s n ASP 312 Cb 0.23 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 3a9s n ASP 312 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a9s n TYR 313 N -1.95 0.00 -3.93 1.24 4.19 -0.97 -4.30 117.16 111.44 3a9s n TYR 313 Ca 0.03 0.00 -0.22 0.00 3.31 0.00 0.00 57.90 61.03 3a9s n TYR 313 Cb 0.23 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 40.02 3a9s n TYR 313 CO 0.00 0.00 0.00 -0.06 0.91 0.00 0.00 176.86 177.71 3a9s s PHE 314 N -1.22 2.93 0.39 2.98 0.08 0.59 -4.44 117.98 119.29 3a9s s PHE 314 Ca 0.00 -0.26 -0.27 0.00 0.12 0.00 0.00 56.93 56.52 3a9s s PHE 314 Cb 0.00 -1.66 -0.11 0.00 -0.57 0.00 0.00 43.02 40.68 3a9s s PHE 314 CO 0.00 0.30 1.36 -2.30 -0.10 0.00 0.00 175.22 174.48 3a9s n PRO 315 N -1.29 2.23 -1.06 0.24 -0.02 -1.10 -3.90 135.00 130.10 3a9s n PRO 315 Ca -0.04 0.79 -0.29 0.00 -2.02 0.00 0.00 63.50 61.94 3a9s n PRO 315 Cb 0.59 -2.48 0.21 0.00 -0.02 0.00 0.00 33.50 31.80 3a9s n PRO 315 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3a9s s ASN 316 N -0.36 1.74 -0.03 2.55 2.20 -0.15 -4.82 114.94 116.08 3a9s s ASN 316 Ca 0.57 1.01 0.08 0.00 -0.94 0.00 0.00 52.86 53.58 3a9s s ASN 316 Cb -0.51 -1.54 0.27 0.00 -2.00 0.00 0.00 41.25 37.48 3a9s s ASN 316 CO 0.61 -3.66 1.15 0.61 -2.94 0.00 0.00 177.10 172.87 3a9s n GLY 317 N -0.80 0.83 0.12 0.45 0.00 -1.26 -4.47 105.19 100.07 3a9s n GLY 317 Ca 0.08 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 3a9s n GLY 317 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3a9s h ASP 318 N 1.65 -0.13 -0.12 1.61 3.32 -1.87 0.95 116.42 121.85 3a9s h ASP 318 Ca 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 3a9s h ASP 318 Cb 0.58 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3a9s h ASP 318 CO 0.05 -0.03 0.02 0.15 -1.72 0.00 0.00 179.24 177.71 3a9s h PHE 319 N 0.06 0.20 -0.30 4.55 3.04 -1.78 0.15 116.94 122.87 3a9s h PHE 319 Ca 0.12 -0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.09 3a9s h PHE 319 Cb 0.16 -0.06 -0.05 0.00 2.56 0.00 0.00 35.95 38.56 3a9s h PHE 319 CO -0.21 0.38 0.00 1.98 -2.02 0.00 0.00 178.31 178.44 3a9s h MET 320 N -0.03 0.09 0.00 1.11 4.05 -1.73 0.12 114.93 118.54 3a9s h MET 320 Ca 0.04 -0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.38 3a9s h MET 320 Cb 0.28 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 3a9s h MET 320 CO 0.00 0.06 -0.35 0.93 0.23 0.00 0.00 176.91 177.78 3a9s h GLU 321 N 0.09 0.00 0.14 0.39 5.08 -0.73 -1.55 114.58 118.00 3a9s h GLU 321 Ca 0.14 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3a9s h GLU 321 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3a9s h GLU 321 CO -0.24 0.35 -0.07 1.15 -1.00 0.00 0.00 179.01 179.21 3a9s h THR 322 N 0.00 0.95 -0.50 1.13 2.02 -0.16 -3.23 112.91 113.13 3a9s h THR 322 Ca -0.00 -1.15 -0.09 0.00 0.77 0.00 0.00 66.41 65.93 3a9s h THR 322 Cb 0.64 1.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 3a9s h THR 322 CO 0.05 0.24 -0.06 -0.29 0.37 0.00 0.00 175.52 175.83 3a9s h ILE 323 N -0.81 1.27 -0.74 3.11 6.09 -0.76 -2.79 117.51 122.88 3a9s h ILE 323 Ca -0.02 -1.17 0.01 0.00 -1.37 0.00 0.00 64.86 62.30 3a9s h ILE 323 Cb 0.54 1.02 -0.04 0.00 0.47 0.00 0.00 36.82 38.81 3a9s h ILE 323 CO 0.03 0.41 0.48 -0.07 -3.07 0.00 0.00 178.15 175.94 3a9s h LEU 324 N 0.78 0.85 -0.16 2.19 4.07 -1.43 -2.13 115.31 119.48 3a9s h LEU 324 Ca 0.13 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.07 3a9s h LEU 324 Cb 0.60 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.13 3a9s h LEU 324 CO 0.04 0.63 0.00 0.59 -1.08 0.00 0.00 178.44 178.61 3a9s n ASN 325 N -4.56 0.35 -4.84 -0.43 3.02 -1.20 -0.79 115.26 106.81 3a9s n ASN 325 Ca 0.07 0.56 -0.30 0.00 -0.03 0.00 0.00 54.58 54.87 3a9s n ASN 325 Cb 0.02 -0.64 0.07 0.00 -0.61 0.00 0.00 39.78 38.62 3a9s n ASN 325 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3a9s s SER 326 N -3.65 5.02 -0.11 6.41 0.01 -0.80 -4.50 113.70 116.07 3a9s s SER 326 Ca 0.09 1.27 0.10 0.00 1.31 0.00 0.00 55.95 58.72 3a9s s SER 326 Cb 0.13 -2.05 0.49 0.00 0.21 0.00 0.00 66.02 64.80 3a9s s SER 326 CO 0.45 -1.63 1.30 -1.54 0.41 0.00 0.00 173.24 172.23 3a9s n SER 327 N -3.21 3.63 -3.53 2.44 3.41 -1.26 -4.08 113.62 111.02 3a9s n SER 327 Ca 0.07 -2.44 -0.07 0.00 -0.26 0.00 0.00 58.87 56.16 3a9s n SER 327 Cb 0.56 -0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 3a9s n SER 327 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3a9s s PHE 328 N -1.93 -0.29 0.00 7.33 -0.12 -1.26 -1.15 117.98 120.56 3a9s s PHE 328 Ca 0.34 0.17 0.00 0.00 -0.05 0.00 0.00 56.93 57.39 3a9s s PHE 328 Cb 0.24 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 43.16 3a9s s PHE 328 CO 0.13 -0.47 0.00 -0.40 -0.05 0.00 0.00 175.22 174.43 3a9s n ASP 329 N -0.21 0.00 0.16 1.98 5.68 -0.90 -4.96 116.55 118.30 3a9s n ASP 329 Ca -0.07 -0.13 0.11 0.00 -0.50 0.00 0.00 54.79 54.20 3a9s n ASP 329 Cb 0.61 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.17 3a9s n ASP 329 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 3a9s n TRP 330 N 0.00 0.73 0.33 2.11 2.14 -1.26 -0.87 117.44 120.61 3a9s n TRP 330 Ca 0.00 0.38 0.12 0.00 2.07 0.00 0.00 57.50 60.07 3a9s n TRP 330 Cb 0.00 -1.11 0.21 0.00 -0.81 0.00 0.00 31.31 29.61 3a9s n TRP 330 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 3a9s n ASN 331 N -2.25 3.48 0.00 -0.67 3.02 -1.26 -4.96 115.26 112.61 3a9s n ASN 331 Ca -0.01 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 3a9s n ASN 331 Cb 0.04 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 38.96 3a9s n ASN 331 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a9s n GLY 332 N 1.51 -1.71 3.77 7.41 0.00 -0.05 -4.98 105.19 111.14 3a9s n GLY 332 Ca 0.19 -2.09 -0.37 0.00 0.00 0.00 0.00 46.02 43.75 3a9s n GLY 332 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a9s s LYS 333 N -0.10 3.73 0.11 1.61 -2.85 -1.26 -2.13 119.74 118.85 3a9s s LYS 333 Ca 0.00 1.85 -0.26 0.00 -1.00 0.00 0.00 55.97 56.56 3a9s s LYS 333 Cb 0.00 -2.44 0.07 0.00 -2.06 0.00 0.00 37.83 33.41 3a9s s LYS 333 CO 0.00 -0.60 0.92 -0.98 0.10 0.00 0.00 175.35 174.80 3a9s s ARG 334 N -2.65 1.10 0.46 1.78 1.70 -0.30 -4.93 118.95 116.12 3a9s s ARG 334 Ca 0.63 -0.55 -0.23 0.00 -0.47 0.00 0.00 55.73 55.11 3a9s s ARG 334 Cb -0.31 0.41 -0.07 0.00 -0.57 0.00 0.00 34.95 34.41 3a9s s ARG 334 CO 0.37 -0.50 1.18 0.00 -1.08 0.00 0.00 175.30 175.27 3a9s s ALA 335 N -3.27 2.96 0.95 7.88 0.00 -1.26 -4.18 121.76 124.84 3a9s s ALA 335 Ca 0.10 0.96 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 3a9s s ALA 335 Cb -0.01 -3.39 0.16 0.00 0.00 0.00 0.00 23.12 19.87 3a9s s ALA 335 CO -0.02 -0.70 1.09 -2.14 0.00 0.00 0.00 175.76 174.00 3a9s s PRO 336 N -2.71 0.85 -0.30 0.00 0.02 -1.26 -4.90 135.00 126.70 3a9s s PRO 336 Ca 0.64 0.82 0.01 0.00 0.02 0.00 0.00 61.00 62.49 3a9s s PRO 336 Cb -0.29 -1.76 0.06 0.00 0.02 0.00 0.00 34.50 32.53 3a9s s PRO 336 CO 0.35 -2.52 -0.03 0.71 -0.33 0.00 0.00 177.00 175.19 3a9s s TYR 337 N -2.86 3.33 -0.17 6.54 2.02 0.03 -5.00 117.35 121.23 3a9s s TYR 337 Ca 0.65 -2.19 -0.29 0.00 -0.37 0.00 0.00 57.07 54.87 3a9s s TYR 337 Cb -0.19 -2.19 -0.05 0.00 -0.40 0.00 0.00 41.96 39.13 3a9s s TYR 337 CO 0.58 -0.86 1.96 0.42 -1.57 0.00 0.00 175.55 176.08 3a9s s ILE 338 N 1.15 3.24 -0.08 2.71 -1.09 -1.26 -3.61 121.20 122.27 3a9s s ILE 338 Ca -0.04 0.27 -0.01 0.00 -2.23 0.00 0.00 60.65 58.64 3a9s s ILE 338 Cb -0.20 -3.26 0.03 0.00 -1.58 0.00 0.00 42.46 37.44 3a9s s ILE 338 CO -0.03 -0.13 -0.02 0.12 -1.23 0.00 0.00 174.94 173.65 3a9s s PHE 339 N 6.43 0.86 -0.10 3.97 2.19 -1.26 -2.07 117.98 128.01 3a9s s PHE 339 Ca 0.88 -0.30 -0.20 0.00 0.33 0.00 0.00 56.93 57.64 3a9s s PHE 339 Cb -0.32 -0.88 -0.04 0.00 -1.31 0.00 0.00 43.02 40.47 3a9s s PHE 339 CO 0.35 -0.35 0.56 0.00 1.83 0.00 0.00 175.22 177.61 3a9s s ALA 340 N 1.77 3.43 0.53 11.12 0.00 0.93 -4.91 121.76 134.63 3a9s s ALA 340 Ca 0.03 -0.07 -0.19 0.00 0.00 0.00 0.00 51.96 51.72 3a9s s ALA 340 Cb -0.13 -2.76 -0.06 0.00 0.00 0.00 0.00 23.12 20.17 3a9s s ALA 340 CO -0.05 -0.04 1.10 0.99 0.00 0.00 0.00 175.76 177.76 3a9s s THR 341 N 0.70 3.35 -1.30 0.00 2.01 -1.26 -1.65 115.64 117.49 3a9s s THR 341 Ca 0.30 0.83 0.00 0.00 0.31 0.00 0.00 61.69 63.13 3a9s s THR 341 Cb -0.16 -3.33 0.00 0.00 0.01 0.00 0.00 72.50 69.02 3a9s s THR 341 CO 0.13 -0.20 0.00 -0.62 -0.69 0.00 0.00 174.62 173.24 3a9s n GLU 342 N -1.27 -1.82 -2.95 4.92 1.02 -0.91 -2.12 120.64 117.51 3a9s n GLU 342 Ca 0.11 0.73 -0.17 0.00 -0.02 0.00 0.00 57.16 57.81 3a9s n GLU 342 Cb 0.51 -5.21 -0.01 0.00 -0.02 0.00 0.00 31.44 26.72 3a9s n GLU 342 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3a9s n ASN 343 N -1.38 -3.34 -4.56 1.62 5.15 -0.37 -4.28 115.26 108.10 3a9s n ASN 343 Ca -0.16 -0.08 -0.38 0.00 -0.60 0.00 0.00 54.58 53.36 3a9s n ASN 343 Cb 0.56 -2.82 -0.03 0.00 -0.53 0.00 0.00 39.78 36.96 3a9s n ASN 343 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3a9s s ASP 344 N -2.39 6.18 0.49 1.20 -1.08 -0.90 -4.15 116.67 116.03 3a9s s ASP 344 Ca 0.22 -1.43 0.17 0.00 -0.52 0.00 0.00 52.55 50.99 3a9s s ASP 344 Cb -0.12 -2.57 1.22 0.00 -1.46 0.00 0.00 42.92 39.99 3a9s s ASP 344 CO 0.27 -1.81 2.09 -0.55 0.52 0.00 0.00 175.17 175.68 3a9s h ASN 345 N 9.82 0.00 0.39 -0.34 7.08 -1.53 -0.77 115.58 130.22 3a9s h ASN 345 Ca 0.21 0.00 -0.14 0.00 -3.08 0.00 0.00 56.30 53.29 3a9s h ASN 345 Cb 0.99 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.21 3a9s h ASN 345 CO 1.38 0.09 -0.58 -0.07 -2.08 0.00 0.00 177.43 176.16 3a9s h LEU 346 N 0.00 0.22 -0.31 6.14 3.38 -1.86 -0.20 115.31 122.68 3a9s h LEU 346 Ca -0.00 -0.12 -0.18 0.00 0.09 0.00 0.00 57.88 57.67 3a9s h LEU 346 Cb 0.17 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3a9s h LEU 346 CO 0.01 0.75 -0.85 -1.13 0.09 0.00 0.00 178.44 177.32 3a9s h ASN 347 N 0.15 0.04 -0.65 -0.43 -1.24 -1.62 -1.52 115.58 110.31 3a9s h ASN 347 Ca -0.00 -0.04 -0.01 0.00 0.71 0.00 0.00 56.30 56.96 3a9s h ASN 347 Cb 1.07 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 40.07 3a9s h ASN 347 CO 0.09 0.87 0.35 1.23 -1.29 0.00 0.00 177.43 178.68 3a9s h GLY 348 N 2.40 0.98 1.55 1.57 0.00 -0.66 0.77 103.07 109.67 3a9s h GLY 348 Ca -0.02 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 46.72 3a9s h GLY 348 CO 0.11 0.43 -0.52 -2.22 0.00 0.00 0.00 176.54 174.35 3a9s h ILE 349 N 0.89 1.33 -0.74 2.60 1.08 -0.95 0.43 117.51 122.15 3a9s h ILE 349 Ca 0.23 -1.76 -0.00 0.00 -0.39 0.00 0.00 64.86 62.94 3a9s h ILE 349 Cb 0.05 1.76 -0.04 0.00 -3.07 0.00 0.00 36.82 35.52 3a9s h ILE 349 CO -0.04 0.54 0.45 0.28 -0.69 0.00 0.00 178.15 178.70 3a9s h SER 350 N 0.38 0.88 -0.44 1.72 0.02 -0.71 -0.03 113.55 115.37 3a9s h SER 350 Ca 0.01 -0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 60.82 3a9s h SER 350 Cb 1.04 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 3a9s h SER 350 CO 0.09 0.68 -0.08 0.24 -1.14 0.00 0.00 176.83 176.62 3a9s h MET 351 N 1.00 0.83 -0.84 3.45 2.86 -0.61 -3.00 114.93 118.62 3a9s h MET 351 Ca 0.27 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3a9s h MET 351 Cb -0.05 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 3a9s h MET 351 CO -0.05 0.93 0.48 1.25 1.06 0.00 0.00 176.91 180.58 3a9s h LEU 352 N 0.66 1.03 -0.06 1.22 5.85 -0.25 0.49 115.31 124.25 3a9s h LEU 352 Ca 0.11 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3a9s h LEU 352 Cb 0.61 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 3a9s h LEU 352 CO 0.04 0.81 -0.06 -0.26 -0.34 0.00 0.00 178.44 178.63 3a9s h PHE 353 N 1.16 -0.14 -0.75 1.25 0.05 -0.96 0.53 116.94 118.09 3a9s h PHE 353 Ca 0.30 0.01 -0.05 0.00 3.82 0.00 0.00 57.97 62.05 3a9s h PHE 353 Cb -0.01 0.07 -0.03 0.00 2.00 0.00 0.00 35.95 37.98 3a9s h PHE 353 CO 0.00 -0.09 0.29 0.78 -0.18 0.00 0.00 178.31 179.11 3a9s h GLY 354 N -0.07 1.21 0.83 -1.45 0.00 -1.34 -2.56 103.07 99.69 3a9s h GLY 354 Ca 0.04 -0.67 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 3a9s h GLY 354 CO -0.10 0.63 0.01 -1.82 0.00 0.00 0.00 176.54 175.26 3a9s h TYR 355 N 1.08 0.05 0.00 5.60 5.03 -0.57 -2.34 116.97 125.83 3a9s h TYR 355 Ca 0.25 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.55 3a9s h TYR 355 Cb 0.23 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.50 3a9s h TYR 355 CO 0.02 0.21 0.00 -0.07 -1.32 0.00 0.00 178.16 177.00 3a9s h LEU 356 N -0.12 0.00 0.00 2.82 3.38 -0.82 0.83 115.31 121.40 3a9s h LEU 356 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3a9s h LEU 356 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3a9s h LEU 356 CO -0.00 0.00 -0.90 0.18 0.09 0.00 0.00 178.44 177.81 3a9s n LEU 357 N -2.93 0.63 0.00 1.67 4.77 -0.97 -4.58 117.00 115.59 3a9s n LEU 357 Ca -0.01 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3a9s n LEU 357 Cb 0.18 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3a9s n LEU 357 CO 0.22 0.03 -0.25 0.35 -1.33 0.00 0.00 177.39 176.41 3a9s n THR 358 N -1.96 0.00 -1.16 -5.08 -2.24 -0.81 -5.02 114.28 98.02 3a9s n THR 358 Ca 0.02 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.75 3a9s n THR 358 Cb 0.43 0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 3a9s n THR 358 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3a9s n ASN 359 N -0.81 -4.46 -4.68 3.42 3.02 0.28 -4.75 115.26 107.28 3a9s n ASN 359 Ca 0.00 0.14 -0.29 0.00 -0.03 0.00 0.00 54.58 54.39 3a9s n ASN 359 Cb 0.03 -2.45 -0.08 0.00 -0.61 0.00 0.00 39.78 36.67 3a9s n ASN 359 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3a9s s THR 360 N -1.94 3.96 0.44 3.41 -4.23 -1.26 -4.25 115.64 111.76 3a9s s THR 360 Ca 0.00 -1.07 -0.26 0.00 -1.18 0.00 0.00 61.69 59.18 3a9s s THR 360 Cb 0.00 -2.90 -0.09 0.00 1.34 0.00 0.00 72.50 70.85 3a9s s THR 360 CO 0.00 0.08 1.39 0.00 -0.54 0.00 0.00 174.62 175.55 3a9s n ALA 361 N 0.44 1.86 -2.59 3.99 0.00 -1.26 -4.49 120.51 118.46 3a9s n ALA 361 Ca -0.11 0.26 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 3a9s n ALA 361 Cb 0.52 -2.36 -0.11 0.00 0.00 0.00 0.00 19.45 17.51 3a9s n ALA 361 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3a9s s GLN 362 N -2.35 2.64 -0.28 0.00 -1.52 -1.26 -4.71 119.66 112.17 3a9s s GLN 362 Ca 0.60 -0.65 -0.13 0.00 -1.95 0.00 0.00 55.36 53.24 3a9s s GLN 362 Cb -0.47 -2.54 -0.04 0.00 -0.22 0.00 0.00 33.01 29.74 3a9s s GLN 362 CO 0.58 0.63 0.28 0.42 -0.25 0.00 0.00 175.29 176.95 3a9s s ILE 363 N -0.92 5.24 0.05 1.08 -1.09 0.04 -4.60 121.20 121.00 3a9s s ILE 363 Ca 0.15 0.31 -0.29 0.00 -2.23 0.00 0.00 60.65 58.59 3a9s s ILE 363 Cb -0.11 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 3a9s s ILE 363 CO 0.05 0.18 0.93 0.12 -1.23 0.00 0.00 174.94 174.98 3a9s s PHE 364 N 1.90 3.73 0.06 3.97 2.19 -1.26 -0.30 117.98 128.27 3a9s s PHE 364 Ca 0.11 1.69 -0.14 0.00 0.33 0.00 0.00 56.93 58.92 3a9s s PHE 364 Cb -0.16 -3.03 0.02 0.00 -1.31 0.00 0.00 43.02 38.54 3a9s s PHE 364 CO 0.11 0.12 0.31 0.00 1.83 0.00 0.00 175.22 177.59 3a9s s ALA 365 N 0.43 -0.67 0.04 11.12 0.00 -0.78 -4.25 121.76 127.64 3a9s s ALA 365 Ca 0.47 -0.07 -0.13 0.00 0.00 0.00 0.00 51.96 52.24 3a9s s ALA 365 Cb -0.22 0.39 -0.06 0.00 0.00 0.00 0.00 23.12 23.24 3a9s s ALA 365 CO 0.28 -0.46 0.41 -0.51 0.00 0.00 0.00 175.76 175.47 3a9s s ASP 366 N -2.26 6.74 -0.97 0.00 -0.00 -1.16 -1.34 116.67 117.68 3a9s s ASP 366 Ca -0.03 0.90 -0.17 0.00 -0.00 0.00 0.00 52.55 53.25 3a9s s ASP 366 Cb 0.00 -2.22 0.16 0.00 -0.00 0.00 0.00 42.92 40.86 3a9s s ASP 366 CO -0.05 0.26 1.13 -0.69 -0.00 0.00 0.00 175.17 175.81 3a9s s VAL 367 N -1.22 4.98 -0.10 -1.27 1.01 -0.11 -1.58 120.40 122.10 3a9s s VAL 367 Ca 0.28 -1.99 -0.23 0.00 0.00 0.00 0.00 61.98 60.04 3a9s s VAL 367 Cb -0.15 -4.75 -0.20 0.00 0.00 0.00 0.00 36.38 31.28 3a9s s VAL 367 CO 0.15 -1.44 0.75 -0.09 0.00 0.00 0.00 175.10 174.48 3a9s h ARG 368 N 8.27 -0.04 -3.01 2.72 9.65 -1.61 -3.48 114.38 126.88 3a9s h ARG 368 Ca 0.18 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.91 3a9s h ARG 368 Cb 0.99 0.01 -0.25 0.00 -1.39 0.00 0.00 29.97 29.33 3a9s h ARG 368 CO 1.07 0.65 -0.36 0.99 2.80 0.00 0.00 179.97 185.12 3a9s s THR 369 N -2.64 0.00 -0.27 0.20 2.01 -1.20 -4.99 115.64 108.76 3a9s s THR 369 Ca -0.15 -0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.72 3a9s s THR 369 Cb -0.01 -0.43 -0.05 0.00 0.01 0.00 0.00 72.50 72.02 3a9s s THR 369 CO 0.55 -0.01 0.18 -0.47 -0.69 0.00 0.00 174.62 174.18 3a9s s TYR 370 N 0.09 3.24 -0.39 4.92 5.04 -1.26 -0.34 117.35 128.66 3a9s s TYR 370 Ca -0.01 0.15 -0.09 0.00 -2.44 0.00 0.00 57.07 54.68 3a9s s TYR 370 Cb -0.02 -2.35 0.06 0.00 0.35 0.00 0.00 41.96 39.99 3a9s s TYR 370 CO 0.01 -0.10 0.21 -1.58 -1.34 0.00 0.00 175.55 172.75 3a9s s TRP 371 N 1.58 3.30 0.66 4.97 0.52 0.27 -5.01 118.94 125.23 3a9s s TRP 371 Ca 0.07 -1.37 -0.11 0.00 0.02 0.00 0.00 56.10 54.71 3a9s s TRP 371 Cb -0.15 -2.69 -0.02 0.00 -1.15 0.00 0.00 33.47 29.46 3a9s s TRP 371 CO 0.09 -0.77 1.05 -1.54 0.02 0.00 0.00 176.95 175.80 3a9s s SER 372 N 1.82 5.81 0.27 2.95 1.04 -1.26 -1.64 113.70 122.69 3a9s s SER 372 Ca 0.02 1.46 -0.03 0.00 0.48 0.00 0.00 55.95 57.88 3a9s s SER 372 Cb -0.21 -2.42 0.39 0.00 0.10 0.00 0.00 66.02 63.87 3a9s s SER 372 CO 0.03 -1.15 1.91 -0.65 0.98 0.00 0.00 173.24 174.37 3a9s h PRO 373 N -0.51 1.17 -0.50 4.02 0.11 -1.86 -1.11 132.00 133.32 3a9s h PRO 373 Ca -0.44 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.61 3a9s h PRO 373 Cb 1.20 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 3a9s h PRO 373 CO 0.60 0.78 0.32 1.49 -0.21 0.00 0.00 178.00 180.98 3a9s h GLU 374 N 1.21 0.64 -0.40 1.05 4.22 -1.96 -0.65 114.58 118.69 3a9s h GLU 374 Ca 0.39 -0.04 -0.06 0.00 0.08 0.00 0.00 59.36 59.73 3a9s h GLU 374 Cb 0.03 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3a9s h GLU 374 CO -0.13 0.42 -0.00 0.00 -2.18 0.00 0.00 179.01 177.12 3a9s h ALA 375 N 1.19 0.54 -0.74 2.92 0.00 -1.75 -1.30 119.26 120.13 3a9s h ALA 375 Ca 0.19 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3a9s h ALA 375 Cb -0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3a9s h ALA 375 CO -0.05 0.32 0.23 0.28 0.00 0.00 0.00 179.25 180.03 3a9s h VAL 376 N 0.53 1.26 -0.49 0.00 2.07 -1.03 -1.19 116.25 117.41 3a9s h VAL 376 Ca 0.11 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 3a9s h VAL 376 Cb 0.48 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3a9s h VAL 376 CO 0.02 0.36 0.12 0.50 0.02 0.00 0.00 177.57 178.59 3a9s h LYS 377 N 1.10 0.78 -0.02 1.57 1.63 -0.94 0.64 116.57 121.32 3a9s h LYS 377 Ca 0.24 -0.18 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 3a9s h LYS 377 Cb 0.31 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.83 3a9s h LYS 377 CO -0.01 0.75 0.01 -0.09 -3.45 0.00 0.00 179.45 176.66 3a9s h ARG 378 N 0.66 0.02 -0.03 1.90 2.43 -0.98 0.32 114.38 118.71 3a9s h ARG 378 Ca 0.15 -0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.17 3a9s h ARG 378 Cb 0.32 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3a9s h ARG 378 CO 0.00 0.16 -0.67 0.28 -1.51 0.00 0.00 179.97 178.23 3a9s h VAL 379 N -0.12 1.44 0.00 0.20 2.07 -1.15 -3.38 116.25 115.31 3a9s h VAL 379 Ca 0.01 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.32 3a9s h VAL 379 Cb 0.14 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 3a9s h VAL 379 CO -0.00 0.64 -0.82 0.35 0.02 0.00 0.00 177.57 177.76 3a9s n THR 380 N -3.79 0.00 -0.79 2.57 -2.24 0.21 -5.01 114.28 105.23 3a9s n THR 380 Ca -0.02 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3a9s n THR 380 Cb 0.66 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 3a9s n THR 380 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a9s n GLY 381 N 2.11 0.85 3.87 3.38 0.00 0.11 -5.01 105.19 110.49 3a9s n GLY 381 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3a9s n GLY 381 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3a9s s TYR 382 N -3.31 3.60 -0.30 1.61 6.14 -1.26 -4.95 117.35 118.88 3a9s s TYR 382 Ca 0.00 0.57 -0.15 0.00 0.64 0.00 0.00 57.07 58.13 3a9s s TYR 382 Cb 0.00 -1.99 -0.03 0.00 0.42 0.00 0.00 41.96 40.36 3a9s s TYR 382 CO 0.00 0.70 0.38 0.99 0.64 0.00 0.00 175.55 178.27 3a9s s THR 383 N -0.95 5.16 0.34 4.34 2.01 -1.26 -3.44 115.64 121.83 3a9s s THR 383 Ca 0.16 0.38 -0.28 0.00 0.31 0.00 0.00 61.69 62.25 3a9s s THR 383 Cb -0.12 -3.76 -0.12 0.00 0.01 0.00 0.00 72.50 68.50 3a9s s THR 383 CO 0.05 0.04 1.38 0.18 -0.69 0.00 0.00 174.62 175.58 3a9s n LEU 384 N 5.39 3.92 -4.59 4.42 4.77 -1.26 -5.00 117.00 124.66 3a9s n LEU 384 Ca -0.08 1.20 -0.27 0.00 -0.03 0.00 0.00 56.01 56.83 3a9s n LEU 384 Cb 0.50 -1.53 -0.11 0.00 -2.33 0.00 0.00 43.42 39.96 3a9s n LEU 384 CO 0.39 -0.25 -0.28 -1.61 -1.33 0.00 0.00 177.39 174.31 3a9s s GLU 385 N -1.68 1.91 3.58 3.23 2.02 -1.26 -4.24 118.70 122.26 3a9s s GLU 385 Ca 0.57 -2.08 0.00 0.00 0.02 0.00 0.00 54.97 53.48 3a9s s GLU 385 Cb -0.54 -1.48 0.00 0.00 0.10 0.00 0.00 34.13 32.21 3a9s s GLU 385 CO 0.60 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 176.20 3a9s n GLY 386 N -0.92 2.72 0.32 -1.39 0.00 -1.26 -1.43 105.19 103.23 3a9s n GLY 386 Ca -0.05 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 45.98 3a9s n GLY 386 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3a9s h ARG 387 N 0.00 0.00 -0.00 1.61 3.08 -2.00 -1.03 114.38 116.04 3a9s h ARG 387 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3a9s h ARG 387 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3a9s h ARG 387 CO 0.00 0.00 -0.16 0.00 -1.07 0.00 0.00 179.97 178.74 3a9s n ALA 388 N -2.44 2.86 -0.07 0.04 0.00 -0.51 -4.39 120.51 116.00 3a9s n ALA 388 Ca 0.01 -0.30 0.26 0.00 0.00 0.00 0.00 53.44 53.40 3a9s n ALA 388 Cb 0.27 -1.27 0.70 0.00 0.00 0.00 0.00 19.45 19.15 3a9s n ALA 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a9s h ALA 389 N 3.58 2.54 -0.54 0.00 0.00 -0.83 -0.37 119.26 123.64 3a9s h ALA 389 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3a9s h ALA 389 Cb 0.41 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3a9s h ALA 389 CO 0.00 -1.02 0.00 0.09 0.00 0.00 0.00 179.25 178.32 3a9s n ASN 390 N -3.84 4.20 0.00 0.00 3.02 -1.26 -4.79 115.26 112.59 3a9s n ASN 390 Ca 0.15 -2.39 0.00 0.00 -0.03 0.00 0.00 54.58 52.31 3a9s n ASN 390 Cb 0.91 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 3a9s n ASN 390 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a9s n GLY 391 N 0.83 2.92 3.16 7.41 0.00 -0.15 -4.50 105.19 114.86 3a9s n GLY 391 Ca 0.22 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 3a9s n GLY 391 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3a9s s ILE 392 N -2.94 0.52 -0.11 -0.61 -4.36 -0.65 -4.75 121.20 108.29 3a9s s ILE 392 Ca 0.00 -1.91 0.04 0.00 -0.26 0.00 0.00 60.65 58.52 3a9s s ILE 392 Cb 0.00 -1.75 0.00 0.00 1.25 0.00 0.00 42.46 41.97 3a9s s ILE 392 CO 0.00 -0.80 -0.23 -0.63 0.24 0.00 0.00 174.94 173.51 3a9s s ILE 393 N -3.74 2.04 -0.42 8.37 1.01 0.25 -0.56 121.20 128.15 3a9s s ILE 393 Ca 0.14 -1.00 -0.25 0.00 0.00 0.00 0.00 60.65 59.54 3a9s s ILE 393 Cb 0.06 -1.78 0.02 0.00 0.01 0.00 0.00 42.46 40.77 3a9s s ILE 393 CO -0.04 0.55 0.88 -2.28 0.00 0.00 0.00 174.94 174.06 3a9s s HIS 394 N 0.49 3.00 -0.26 3.97 5.65 0.54 -1.18 115.29 127.51 3a9s s HIS 394 Ca -0.15 0.48 -0.08 0.00 0.25 0.00 0.00 55.06 55.56 3a9s s HIS 394 Cb -0.17 -3.75 -0.03 0.00 -1.18 0.00 0.00 32.58 27.44 3a9s s HIS 394 CO 0.05 -0.95 0.11 -0.51 -0.65 0.00 0.00 174.74 172.79 3a9s s LEU 395 N 3.51 3.62 -0.30 8.88 1.43 -0.47 -1.65 118.68 133.70 3a9s s LEU 395 Ca 0.35 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.26 3a9s s LEU 395 Cb -0.11 -1.98 0.18 0.00 0.03 0.00 0.00 46.19 44.31 3a9s s LEU 395 CO 0.22 -0.04 0.63 -0.51 0.23 0.00 0.00 176.35 176.88 3a9s s ILE 396 N 1.66 -0.96 0.86 -0.59 2.07 -0.61 -1.36 121.20 122.27 3a9s s ILE 396 Ca 0.07 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.19 3a9s s ILE 396 Cb -0.15 -1.00 0.11 0.00 0.13 0.00 0.00 42.46 41.55 3a9s s ILE 396 CO 0.06 0.00 1.09 0.21 -1.91 0.00 0.00 174.94 174.39 3a9s s ASN 397 N 2.87 3.79 0.00 4.50 2.47 -1.26 -2.97 114.94 124.34 3a9s s ASN 397 Ca 0.15 1.44 -0.04 0.00 0.42 0.00 0.00 52.86 54.83 3a9s s ASN 397 Cb -0.14 -2.13 -0.17 0.00 -1.45 0.00 0.00 41.25 37.36 3a9s s ASN 397 CO -0.20 -2.43 2.54 -1.54 -3.72 0.00 0.00 177.10 171.75 3a9s n SER 398 N -3.74 3.70 0.00 -4.21 3.41 -1.26 -4.41 113.62 107.11 3a9s n SER 398 Ca 0.07 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.51 3a9s n SER 398 Cb 0.55 -0.97 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 3a9s n SER 398 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a9s n GLY 399 N 2.52 0.65 3.11 5.00 0.00 -1.26 -4.96 105.19 110.25 3a9s n GLY 399 Ca 0.26 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.06 3a9s n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9s s ALA 400 N -2.00 1.17 -0.28 4.61 0.00 -1.26 -0.30 121.76 123.69 3a9s s ALA 400 Ca 0.00 -0.62 -0.25 0.00 0.00 0.00 0.00 51.96 51.08 3a9s s ALA 400 Cb 0.00 -0.29 0.14 0.00 0.00 0.00 0.00 23.12 22.97 3a9s s ALA 400 CO 0.00 0.28 1.12 0.00 0.00 0.00 0.00 175.76 177.16 3a9s s ALA 401 N -0.38 -2.02 0.29 0.00 0.00 -1.26 -4.62 121.76 113.77 3a9s s ALA 401 Ca 0.05 1.83 -0.30 0.00 0.00 0.00 0.00 51.96 53.54 3a9s s ALA 401 Cb -0.06 -1.49 -0.13 0.00 0.00 0.00 0.00 23.12 21.44 3a9s s ALA 401 CO -0.00 -0.21 1.32 0.00 0.00 0.00 0.00 175.76 176.86 3a9s n ALA 402 N 2.04 1.05 0.30 0.00 0.00 -1.26 -4.66 120.51 117.97 3a9s n ALA 402 Ca -0.12 0.39 0.19 0.00 0.00 0.00 0.00 53.44 53.90 3a9s n ALA 402 Cb 0.56 -2.24 1.01 0.00 0.00 0.00 0.00 19.45 18.79 3a9s n ALA 402 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3a9s h LEU 403 N 3.28 0.00 -2.33 0.00 3.38 -1.89 0.16 115.31 117.91 3a9s h LEU 403 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3a9s h LEU 403 Cb 1.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 3a9s h LEU 403 CO 0.69 0.00 -0.03 0.44 0.09 0.00 0.00 178.44 179.62 3a9s h ASP 404 N 0.00 0.00 0.23 -0.43 5.19 -1.92 -2.22 116.42 117.27 3a9s h ASP 404 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3a9s h ASP 404 Cb 0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.57 3a9s h ASP 404 CO 0.00 0.03 0.00 0.61 -3.12 0.00 0.00 179.24 176.76 3a9s n GLY 405 N -1.14 -0.83 0.23 2.75 0.00 0.55 -2.09 105.19 104.66 3a9s n GLY 405 Ca -0.03 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.12 3a9s n GLY 405 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3a9s h THR 406 N 0.00 0.95 -0.02 2.61 1.35 -1.60 -3.36 112.91 112.84 3a9s h THR 406 Ca 0.00 -0.74 -0.01 0.00 -0.55 0.00 0.00 66.41 65.11 3a9s h THR 406 Cb 0.11 1.42 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 3a9s h THR 406 CO 0.00 0.20 -0.01 0.61 -0.25 0.00 0.00 175.52 176.07 3a9s n GLY 407 N -0.76 0.47 0.23 5.82 0.00 -0.89 -1.72 105.19 108.34 3a9s n GLY 407 Ca -0.02 -0.38 0.14 0.00 0.00 0.00 0.00 46.02 45.76 3a9s n GLY 407 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3a9s h GLU 408 N 0.59 0.00 -6.90 1.61 4.39 -1.82 -3.37 114.58 109.09 3a9s h GLU 408 Ca -0.01 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.17 3a9s h GLU 408 Cb 0.07 0.00 0.07 0.00 -0.10 0.00 0.00 28.75 28.79 3a9s h GLU 408 CO 0.01 0.00 0.64 -0.65 -1.16 0.00 0.00 179.01 177.85 3a9s s GLN 409 N -3.39 4.25 0.01 2.33 -0.21 -1.25 -4.85 119.66 116.54 3a9s s GLN 409 Ca 0.05 2.21 0.04 0.00 0.02 0.00 0.00 55.36 57.67 3a9s s GLN 409 Cb 0.07 -2.98 -0.01 0.00 1.00 0.00 0.00 33.01 31.09 3a9s s GLN 409 CO 0.59 -0.28 -0.12 0.99 -2.12 0.00 0.00 175.29 174.36 3a9s s THR 410 N -1.18 0.92 -0.07 -0.19 2.01 -1.26 -1.60 115.64 114.28 3a9s s THR 410 Ca 0.51 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 61.79 3a9s s THR 410 Cb -0.39 -0.81 0.04 0.00 0.01 0.00 0.00 72.50 71.35 3a9s s THR 410 CO 0.52 0.11 0.12 -0.75 -0.69 0.00 0.00 174.62 173.93 3a9s s LYS 411 N -0.66 -0.01 -1.42 4.92 2.20 -0.55 -4.85 119.74 119.36 3a9s s LYS 411 Ca 0.02 0.46 -0.11 0.00 -0.36 0.00 0.00 55.97 55.98 3a9s s LYS 411 Cb -0.06 -0.44 0.04 0.00 -1.51 0.00 0.00 37.83 35.86 3a9s s LYS 411 CO 0.00 -0.34 1.11 -0.25 -0.36 0.00 0.00 175.35 175.52 3a9s n ASP 412 N 5.31 -5.78 -0.33 1.43 8.00 -1.26 -1.70 116.55 122.22 3a9s n ASP 412 Ca -0.04 -0.63 -0.04 0.00 0.71 0.00 0.00 54.79 54.79 3a9s n ASP 412 Cb 0.50 -4.62 -0.02 0.00 -0.02 0.00 0.00 41.12 36.96 3a9s n ASP 412 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a9s n GLY 413 N -1.89 0.62 3.40 0.44 0.00 -1.26 -5.01 105.19 101.50 3a9s n GLY 413 Ca 0.02 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 3a9s n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9s s LYS 414 N -1.78 1.44 0.12 1.61 1.02 -0.69 -5.12 119.74 116.34 3a9s s LYS 414 Ca 0.00 -1.42 -0.30 0.00 0.02 0.00 0.00 55.97 54.27 3a9s s LYS 414 Cb 0.00 -1.85 -0.06 0.00 -0.52 0.00 0.00 37.83 35.39 3a9s s LYS 414 CO 0.00 0.42 1.09 -1.25 -0.92 0.00 0.00 175.35 174.69 3a9s s PRO 415 N -2.33 4.57 0.36 -1.68 0.04 -1.26 -1.48 135.00 133.20 3a9s s PRO 415 Ca 0.17 1.66 -0.07 0.00 0.04 0.00 0.00 61.00 62.79 3a9s s PRO 415 Cb -0.09 -3.33 0.02 0.00 0.04 0.00 0.00 34.50 31.14 3a9s s PRO 415 CO 0.08 0.00 0.58 0.14 0.04 0.00 0.00 177.00 177.84 3a9s s VAL 416 N 0.25 0.00 -0.13 -0.36 -7.23 -0.63 -4.69 120.40 107.62 3a9s s VAL 416 Ca 0.52 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 3a9s s VAL 416 Cb -0.28 -2.71 0.02 0.00 0.56 0.00 0.00 36.38 33.97 3a9s s VAL 416 CO 0.32 0.00 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.36 3a9s s ILE 417 N -2.81 1.33 0.22 -0.62 1.01 -1.26 -3.95 121.20 115.11 3a9s s ILE 417 Ca 0.25 -0.49 0.07 0.00 0.00 0.00 0.00 60.65 60.49 3a9s s ILE 417 Cb -0.02 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 3a9s s ILE 417 CO 0.17 0.42 0.09 -0.54 0.00 0.00 0.00 174.94 175.08 3a9s s LYS 418 N 1.47 2.63 0.54 2.79 1.02 -1.26 -4.90 119.74 122.03 3a9s s LYS 418 Ca 0.03 -1.13 -0.22 0.00 0.02 0.00 0.00 55.97 54.67 3a9s s LYS 418 Cb -0.13 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.70 3a9s s LYS 418 CO -0.08 0.42 1.30 -2.14 -0.92 0.00 0.00 175.35 173.93 3a9s s PRO 419 N -3.45 3.23 0.40 -1.68 0.02 -1.26 -4.65 135.00 127.61 3a9s s PRO 419 Ca 0.31 2.10 0.14 0.00 0.02 0.00 0.00 61.00 63.57 3a9s s PRO 419 Cb -0.08 -2.25 0.99 0.00 0.02 0.00 0.00 34.50 33.18 3a9s s PRO 419 CO 0.22 -1.07 1.86 0.10 -0.33 0.00 0.00 177.00 177.78 3a9s h TYR 420 N 1.50 0.64 0.00 6.54 -0.00 -1.84 -0.79 116.97 123.01 3a9s h TYR 420 Ca -0.51 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.24 3a9s h TYR 420 Cb 1.29 -0.20 0.00 0.00 -0.00 0.00 0.00 36.73 37.82 3a9s h TYR 420 CO 0.47 0.20 0.00 2.48 -0.00 0.00 0.00 178.16 181.31 3a9s n TYR 421 N -4.53 0.00 0.45 0.10 4.11 -1.26 -1.98 117.16 114.04 3a9s n TYR 421 Ca 0.18 0.00 0.05 0.00 -0.00 0.00 0.00 57.90 58.13 3a9s n TYR 421 Cb 0.60 -0.16 0.02 0.00 -0.00 0.00 0.00 39.34 39.80 3a9s n TYR 421 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 3a9s n GLU 422 N -1.16 1.39 -2.14 -3.48 1.02 -0.30 -5.03 120.64 110.93 3a9s n GLU 422 Ca 0.08 -0.84 -0.40 0.00 -0.02 0.00 0.00 57.16 55.98 3a9s n GLU 422 Cb 0.08 -1.14 -0.01 0.00 -0.02 0.00 0.00 31.44 30.34 3a9s n GLU 422 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3a9s s LEU 423 N -1.31 4.29 0.30 -4.62 1.43 -0.84 -5.00 118.68 112.93 3a9s s LEU 423 Ca 0.10 2.58 0.07 0.00 -1.03 0.00 0.00 54.13 55.85 3a9s s LEU 423 Cb 0.08 -3.84 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 3a9s s LEU 423 CO 0.20 -0.69 0.32 0.42 0.23 0.00 0.00 176.35 176.83 3a9s s THR 424 N -1.25 4.21 0.41 5.49 -4.23 -1.26 -5.00 115.64 114.00 3a9s s THR 424 Ca 0.54 -1.22 0.09 0.00 -1.18 0.00 0.00 61.69 59.92 3a9s s THR 424 Cb -0.37 -3.41 0.21 0.00 1.34 0.00 0.00 72.50 70.27 3a9s s THR 424 CO 0.47 -0.24 1.99 0.44 -0.54 0.00 0.00 174.62 176.74 3a9s h ASP 425 N 1.21 0.30 -0.52 3.99 3.32 -2.00 -2.15 116.42 120.58 3a9s h ASP 425 Ca -0.47 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 3a9s h ASP 425 Cb 1.25 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 3a9s h ASP 425 CO 0.58 0.34 0.06 -0.08 -1.72 0.00 0.00 179.24 178.42 3a9s h GLU 426 N 0.33 0.87 -0.17 3.56 4.81 -1.98 -0.37 114.58 121.62 3a9s h GLU 426 Ca 0.08 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.10 3a9s h GLU 426 Cb 0.18 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 3a9s h GLU 426 CO 0.00 0.87 -0.07 -0.44 -0.73 0.00 0.00 179.01 178.64 3a9s h ASP 427 N 0.75 -0.25 -0.13 1.04 3.32 -1.73 -0.29 116.42 119.13 3a9s h ASP 427 Ca 0.16 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 3a9s h ASP 427 Cb 0.43 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3a9s h ASP 427 CO 0.01 -0.10 0.06 0.40 -1.72 0.00 0.00 179.24 177.90 3a9s h ILE 428 N -0.05 1.13 -0.68 0.35 2.04 -1.35 -2.02 117.51 116.92 3a9s h ILE 428 Ca 0.09 -0.37 0.08 0.00 1.00 0.00 0.00 64.86 65.67 3a9s h ILE 428 Cb 0.19 1.13 -0.07 0.00 -0.74 0.00 0.00 36.82 37.34 3a9s h ILE 428 CO -0.21 0.11 0.34 0.50 0.00 0.00 0.00 178.15 178.90 3a9s h LYS 429 N 0.08 0.58 -0.15 2.37 3.64 -0.79 -2.08 116.57 120.21 3a9s h LYS 429 Ca 0.04 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 3a9s h LYS 429 Cb 0.13 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3a9s h LYS 429 CO -0.01 0.38 -0.38 0.87 -2.27 0.00 0.00 179.45 178.05 3a9s h LYS 430 N 0.60 0.34 -0.62 1.90 1.57 -0.89 -1.34 116.57 118.11 3a9s h LYS 430 Ca 0.33 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 3a9s h LYS 430 Cb 0.31 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 3a9s h LYS 430 CO -0.25 0.67 0.24 0.00 -0.57 0.00 0.00 179.45 179.54 3a9s h LEU 432 N 0.88 0.57 -1.76 0.00 3.38 -1.24 -3.07 115.31 114.07 3a9s h LEU 432 Ca 0.21 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3a9s h LEU 432 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3a9s h LEU 432 CO -0.02 0.84 0.04 -0.33 0.09 0.00 0.00 178.44 179.06 3a9s h GLU 433 N 0.29 0.19 -0.01 1.13 5.08 -1.11 -1.68 114.58 118.47 3a9s h GLU 433 Ca 0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3a9s h GLU 433 Cb 0.62 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3a9s h GLU 433 CO 0.04 0.18 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 3a9s n ALA 434 N -2.51 2.64 -2.48 3.43 0.00 -0.68 -4.85 120.51 116.06 3a9s n ALA 434 Ca -0.01 -0.29 -0.31 0.00 0.00 0.00 0.00 53.44 52.83 3a9s n ALA 434 Cb 0.12 -1.37 -0.12 0.00 0.00 0.00 0.00 19.45 18.08 3a9s n ALA 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3a9s s THR 435 N -1.99 3.00 -0.03 0.00 2.01 -0.63 -4.55 115.64 113.44 3a9s s THR 435 Ca 0.42 -1.00 0.05 0.00 0.31 0.00 0.00 61.69 61.47 3a9s s THR 435 Cb 0.21 -2.25 -0.01 0.00 0.01 0.00 0.00 72.50 70.46 3a9s s THR 435 CO 0.34 0.41 -0.17 -1.10 -0.69 0.00 0.00 174.62 173.41 3a9s s GLN 436 N -1.25 1.67 -0.28 4.92 -0.21 -0.36 -4.50 119.66 119.66 3a9s s GLN 436 Ca 0.14 -0.62 -0.09 0.00 0.02 0.00 0.00 55.36 54.81 3a9s s GLN 436 Cb -0.11 -1.50 -0.03 0.00 1.00 0.00 0.00 33.01 32.37 3a9s s GLN 436 CO 0.04 0.29 0.14 -0.06 -2.12 0.00 0.00 175.29 173.58 3a9s s PHE 437 N -0.12 3.16 -0.12 0.91 0.40 0.60 -0.65 117.98 122.17 3a9s s PHE 437 Ca -0.00 -0.28 -0.05 0.00 -0.60 0.00 0.00 56.93 56.00 3a9s s PHE 437 Cb -0.10 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.07 3a9s s PHE 437 CO 0.01 -0.32 0.06 1.03 0.70 0.00 0.00 175.22 176.70 3a9s s ARG 438 N 1.67 3.40 0.18 0.44 1.81 -0.32 -0.42 118.95 125.71 3a9s s ARG 438 Ca 0.06 -0.32 -0.33 0.00 -1.72 0.00 0.00 55.73 53.42 3a9s s ARG 438 Cb -0.16 -3.02 -0.14 0.00 -0.45 0.00 0.00 34.95 31.18 3a9s s ARG 438 CO 0.07 0.60 1.54 -2.30 -0.68 0.00 0.00 175.30 174.53 3a9s n PRO 439 N 2.51 2.13 -1.72 3.54 -0.02 -1.26 -0.38 135.00 139.80 3a9s n PRO 439 Ca -0.18 0.76 -0.39 0.00 -2.02 0.00 0.00 63.50 61.67 3a9s n PRO 439 Cb 0.54 -2.51 0.04 0.00 -0.02 0.00 0.00 33.50 31.55 3a9s n PRO 439 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9s n ALA 440 N 3.10 1.31 -2.05 3.55 0.00 -0.22 -4.70 120.51 121.50 3a9s n ALA 440 Ca 0.16 0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.30 3a9s n ALA 440 Cb 0.29 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.41 3a9s n ALA 440 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3a9s s SER 441 N -0.93 5.89 0.54 0.00 0.01 -1.26 -4.85 113.70 113.10 3a9s s SER 441 Ca 0.71 1.14 0.36 0.00 1.31 0.00 0.00 55.95 59.47 3a9s s SER 441 Cb -0.43 -2.53 1.71 0.00 0.21 0.00 0.00 66.02 64.99 3a9s s SER 441 CO 0.50 -1.74 2.07 0.71 0.41 0.00 0.00 173.24 175.19 3a9s h THR 442 N 6.77 0.00 0.00 1.44 1.35 -1.83 0.28 112.91 120.92 3a9s h THR 442 Ca -0.32 -0.23 -0.06 0.00 -0.55 0.00 0.00 66.41 65.25 3a9s h THR 442 Cb 1.16 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3a9s h THR 442 CO 1.06 0.00 -0.29 1.05 -0.25 0.00 0.00 175.52 177.09 3a9s h GLU 443 N 0.00 0.00 0.00 4.72 4.11 -1.91 -2.97 114.58 118.53 3a9s h GLU 443 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 59.36 59.02 3a9s h GLU 443 Cb 0.25 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.43 3a9s h GLU 443 CO 0.00 0.29 -2.44 0.66 0.07 0.00 0.00 179.01 177.59 3a9s n TYR 444 N -3.97 0.00 -3.72 2.06 4.01 -0.76 -4.80 117.16 109.97 3a9s n TYR 444 Ca -0.02 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.38 3a9s n TYR 444 Cb 0.36 -0.95 -0.09 0.00 -0.31 0.00 0.00 39.34 38.35 3a9s n TYR 444 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3a9s s PHE 445 N -2.49 3.69 0.52 -0.72 0.08 0.91 -4.87 117.98 115.10 3a9s s PHE 445 Ca -0.35 -3.03 0.20 0.00 0.12 0.00 0.00 56.93 53.87 3a9s s PHE 445 Cb 0.11 -3.11 1.30 0.00 -0.57 0.00 0.00 43.02 40.75 3a9s s PHE 445 CO 0.52 -0.72 2.07 0.00 -0.10 0.00 0.00 175.22 176.98 3a9s h ARG 446 N 6.14 0.04 -0.01 0.44 3.08 -1.33 -1.67 114.38 121.06 3a9s h ARG 446 Ca 0.11 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3a9s h ARG 446 Cb 0.84 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.88 3a9s h ARG 446 CO 0.79 0.03 0.00 0.41 -1.07 0.00 0.00 179.97 180.13 3a9s n GLY 447 N -1.58 -0.75 5.72 0.04 0.00 0.37 -4.85 105.19 104.13 3a9s n GLY 447 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3a9s n GLY 447 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9s n GLY 448 N 0.99 -0.80 0.00 -0.02 0.00 -0.63 -2.71 105.19 102.02 3a9s n GLY 448 Ca 0.20 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.90 3a9s n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9s n GLY 449 N 0.00 0.05 2.75 -0.02 0.00 -1.26 -0.98 105.19 105.73 3a9s n GLY 449 Ca 0.00 -2.29 -0.18 0.00 0.00 0.00 0.00 46.02 43.55 3a9s n GLY 449 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a9s s TYR 450 N -0.04 0.22 0.35 1.61 2.02 -1.26 -1.06 117.35 119.18 3a9s s TYR 450 Ca 0.00 0.09 -0.06 0.00 -0.37 0.00 0.00 57.07 56.74 3a9s s TYR 450 Cb 0.00 -0.46 -0.05 0.00 -0.40 0.00 0.00 41.96 41.05 3a9s s TYR 450 CO 0.00 -0.17 0.63 -1.54 -1.57 0.00 0.00 175.55 172.90 3a9s s SER 451 N 1.57 6.42 -0.31 2.29 1.04 0.49 -3.54 113.70 121.66 3a9s s SER 451 Ca -0.02 0.80 -0.18 0.00 0.48 0.00 0.00 55.95 57.04 3a9s s SER 451 Cb -0.13 -2.18 -0.01 0.00 0.10 0.00 0.00 66.02 63.79 3a9s s SER 451 CO -0.03 -0.31 0.50 -0.89 0.98 0.00 0.00 173.24 173.49 3a9s s THR 452 N -2.27 5.05 -0.31 2.02 2.01 0.58 -1.17 115.64 121.55 3a9s s THR 452 Ca 0.46 0.53 -0.03 0.00 0.31 0.00 0.00 61.69 62.96 3a9s s THR 452 Cb -0.10 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.56 3a9s s THR 452 CO 0.33 -0.08 0.03 -0.62 -0.69 0.00 0.00 174.62 173.59 3a9s s ASP 453 N 1.68 5.00 0.30 3.53 2.15 0.18 -1.08 116.67 128.44 3a9s s ASP 453 Ca 0.19 -1.27 -0.07 0.00 0.43 0.00 0.00 52.55 51.83 3a9s s ASP 453 Cb -0.16 -1.75 0.00 0.00 -0.30 0.00 0.00 42.92 40.71 3a9s s ASP 453 CO 0.12 -0.29 0.47 0.72 -0.17 0.00 0.00 175.17 176.02 3a9s s PHE 454 N 1.28 0.76 -0.14 -5.34 -0.12 -1.26 -1.22 117.98 111.93 3a9s s PHE 454 Ca -0.04 -1.07 -0.03 0.00 -0.05 0.00 0.00 56.93 55.75 3a9s s PHE 454 Cb -0.20 0.04 0.05 0.00 -0.63 0.00 0.00 43.02 42.28 3a9s s PHE 454 CO -0.00 -1.08 0.03 -1.17 -0.05 0.00 0.00 175.22 172.95 3a9s s LEU 455 N -3.14 0.84 0.22 -1.99 2.96 -1.26 -1.50 118.68 114.80 3a9s s LEU 455 Ca 0.27 -0.51 -0.31 0.00 -0.22 0.00 0.00 54.13 53.36 3a9s s LEU 455 Cb -0.00 -0.49 -0.12 0.00 0.50 0.00 0.00 46.19 46.08 3a9s s LEU 455 CO 0.15 -0.27 1.68 -0.89 -1.32 0.00 0.00 176.35 175.70 3a9s s THR 456 N 1.94 2.11 0.46 3.68 2.01 -0.37 -4.83 115.64 120.63 3a9s s THR 456 Ca 0.02 0.08 -0.24 0.00 0.31 0.00 0.00 61.69 61.86 3a9s s THR 456 Cb -0.15 -3.05 -0.07 0.00 0.01 0.00 0.00 72.50 69.23 3a9s s THR 456 CO -0.07 0.01 1.31 -0.54 -0.69 0.00 0.00 174.62 174.64 3a9s s LYS 457 N 0.80 3.67 0.72 4.92 1.02 -0.70 -4.76 119.74 125.41 3a9s s LYS 457 Ca 0.72 2.15 -0.09 0.00 0.02 0.00 0.00 55.97 58.77 3a9s s LYS 457 Cb -0.49 -2.55 0.05 0.00 -0.52 0.00 0.00 37.83 34.33 3a9s s LYS 457 CO 0.35 -0.74 1.06 0.20 -0.92 0.00 0.00 175.35 175.30 3a9s s GLY 458 N -0.87 1.64 0.00 -3.33 0.00 -1.26 -4.35 107.32 99.15 3a9s s GLY 458 Ca 0.63 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.63 3a9s s GLY 458 CO 0.47 -0.31 0.00 0.61 0.00 0.00 0.00 173.10 173.87 3a9s n GLY 459 N -2.99 0.79 3.70 0.20 0.00 0.13 -4.84 105.19 102.18 3a9s n GLY 459 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3a9s n GLY 459 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3a9s s MET 460 N -0.30 4.31 0.19 1.61 0.00 -1.25 -4.83 119.30 119.03 3a9s s MET 460 Ca 0.00 0.54 -0.30 0.00 0.00 0.00 0.00 55.69 55.93 3a9s s MET 460 Cb 0.00 -3.48 -0.08 0.00 0.00 0.00 0.00 34.83 31.27 3a9s s MET 460 CO 0.00 0.03 1.23 -1.25 0.00 0.00 0.00 175.02 175.04 3a9s s PRO 461 N 1.00 4.46 0.21 4.11 0.04 -1.26 -1.13 135.00 142.44 3a9s s PRO 461 Ca 0.28 1.93 -0.05 0.00 0.04 0.00 0.00 61.00 63.20 3a9s s PRO 461 Cb -0.16 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 3a9s s PRO 461 CO 0.11 -0.14 0.24 0.14 0.04 0.00 0.00 177.00 177.39 3a9s s VAL 462 N -0.00 0.00 -0.04 -0.36 -7.23 -0.36 0.37 120.40 112.79 3a9s s VAL 462 Ca 0.54 -1.80 -0.01 0.00 -1.81 0.00 0.00 61.98 58.90 3a9s s VAL 462 Cb -0.34 -2.38 0.03 0.00 0.56 0.00 0.00 36.38 34.25 3a9s s VAL 462 CO 0.37 -0.02 0.02 -0.89 -0.31 0.00 0.00 175.10 174.28 3a9s s THR 463 N -4.11 0.07 0.04 5.32 2.01 -0.24 -0.86 115.64 117.87 3a9s s THR 463 Ca 0.33 0.22 0.02 0.00 0.31 0.00 0.00 61.69 62.56 3a9s s THR 463 Cb 0.05 -0.23 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 3a9s s THR 463 CO 0.11 0.16 0.08 0.27 -0.69 0.00 0.00 174.62 174.54 3a9s s ILE 464 N 1.48 4.60 0.14 1.82 -4.36 -0.44 -1.25 121.20 123.20 3a9s s ILE 464 Ca -0.04 -0.61 -0.11 0.00 -0.26 0.00 0.00 60.65 59.64 3a9s s ILE 464 Cb -0.13 -3.16 0.01 0.00 1.25 0.00 0.00 42.46 40.42 3a9s s ILE 464 CO -0.03 0.23 0.30 -0.94 0.24 0.00 0.00 174.94 174.74 3a9s s SER 465 N -2.08 -0.01 -0.23 4.36 1.04 -0.47 -0.89 113.70 115.43 3a9s s SER 465 Ca 0.26 -0.66 -0.12 0.00 0.48 0.00 0.00 55.95 55.91 3a9s s SER 465 Cb -0.12 0.43 0.07 0.00 0.10 0.00 0.00 66.02 66.50 3a9s s SER 465 CO 0.18 -0.85 0.55 -0.60 0.98 0.00 0.00 173.24 173.50 3a9s s ARG 466 N -3.89 0.55 -0.16 4.02 6.06 -0.62 -1.30 118.95 123.60 3a9s s ARG 466 Ca 0.10 1.03 -0.10 0.00 -2.50 0.00 0.00 55.73 54.26 3a9s s ARG 466 Cb 0.03 0.10 -0.05 0.00 0.06 0.00 0.00 34.95 35.09 3a9s s ARG 466 CO -0.06 -0.16 0.17 -1.17 -2.50 0.00 0.00 175.30 171.58 3a9s s LEU 467 N 1.62 4.28 0.14 -0.88 2.96 -1.26 -1.65 118.68 123.89 3a9s s LEU 467 Ca -0.09 0.38 0.06 0.00 -0.22 0.00 0.00 54.13 54.26 3a9s s LEU 467 Cb -0.07 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 3a9s s LEU 467 CO -0.16 0.24 -0.14 0.20 -1.32 0.00 0.00 176.35 175.17 3a9s s ASN 468 N -0.12 2.13 -0.20 3.68 0.01 -0.16 -4.71 114.94 115.57 3a9s s ASN 468 Ca 0.12 -0.88 0.01 0.00 -0.71 0.00 0.00 52.86 51.40 3a9s s ASN 468 Cb -0.12 -0.08 0.03 0.00 0.41 0.00 0.00 41.25 41.49 3a9s s ASN 468 CO 0.02 -0.17 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.65 3a9s s ILE 469 N -2.46 2.26 -0.13 0.60 1.01 -1.26 -0.55 121.20 120.66 3a9s s ILE 469 Ca 0.13 -1.03 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 3a9s s ILE 469 Cb -0.03 -2.04 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 3a9s s ILE 469 CO 0.04 0.40 -0.13 -0.69 0.00 0.00 0.00 174.94 174.56 3a9s s VAL 470 N 1.28 3.07 0.21 2.92 1.01 -0.21 -4.94 120.40 123.73 3a9s s VAL 470 Ca 0.02 -0.65 -0.32 0.00 0.00 0.00 0.00 61.98 61.03 3a9s s VAL 470 Cb -0.15 -2.29 -0.12 0.00 0.00 0.00 0.00 36.38 33.82 3a9s s VAL 470 CO -0.10 0.52 1.67 1.17 0.00 0.00 0.00 175.10 178.36 3a9s n LYS 471 N 3.55 2.62 -0.42 2.72 3.00 -1.26 0.13 118.16 128.50 3a9s n LYS 471 Ca -0.18 0.94 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 3a9s n LYS 471 Cb 0.53 -2.76 0.00 0.00 0.00 0.00 0.00 35.03 32.79 3a9s n LYS 471 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3a9s n GLY 472 N 3.63 0.87 1.12 3.14 0.00 -1.26 -4.78 105.19 107.91 3a9s n GLY 472 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3a9s n GLY 472 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3a9s n LEU 473 N 0.00 0.22 0.00 0.99 7.94 -0.29 -5.16 117.00 120.70 3a9s n LEU 473 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3a9s n LEU 473 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3a9s n LEU 473 CO 0.00 -0.22 0.00 0.61 -1.11 0.00 0.00 177.39 176.67 3a9s n GLY 474 N 1.82 -0.09 3.77 -3.96 0.00 0.12 -4.94 105.19 101.91 3a9s n GLY 474 Ca 0.00 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.84 3a9s n GLY 474 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a9s s PRO 475 N 0.00 4.03 -0.14 1.61 0.04 -1.26 -1.05 135.00 138.23 3a9s s PRO 475 Ca 0.00 2.02 -0.10 0.00 0.04 0.00 0.00 61.00 62.95 3a9s s PRO 475 Cb 0.00 -2.74 0.04 0.00 0.04 0.00 0.00 34.50 31.84 3a9s s PRO 475 CO 0.00 -0.40 0.36 0.54 0.04 0.00 0.00 177.00 177.54 3a9s s VAL 476 N -1.31 -0.01 -0.08 -0.36 0.11 0.28 -4.15 120.40 114.88 3a9s s VAL 476 Ca 0.56 0.05 0.01 0.00 -2.93 0.00 0.00 61.98 59.67 3a9s s VAL 476 Cb -0.35 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 33.95 3a9s s VAL 476 CO 0.45 0.02 -0.08 -0.22 -3.33 0.00 0.00 175.10 171.94 3a9s s LEU 477 N 0.74 3.08 0.01 2.54 2.96 -0.26 -0.98 118.68 126.77 3a9s s LEU 477 Ca -0.04 -0.08 0.08 0.00 -0.22 0.00 0.00 54.13 53.86 3a9s s LEU 477 Cb -0.06 -1.68 -0.02 0.00 0.50 0.00 0.00 46.19 44.94 3a9s s LEU 477 CO -0.05 0.32 -0.24 0.00 -1.32 0.00 0.00 176.35 175.06 3a9s s GLN 478 N -0.56 1.80 0.01 1.98 -2.07 -0.66 -1.87 119.66 118.29 3a9s s GLN 478 Ca 0.08 -0.96 0.02 0.00 -1.82 0.00 0.00 55.36 52.68 3a9s s GLN 478 Cb -0.12 -1.85 -0.01 0.00 -1.09 0.00 0.00 33.01 29.94 3a9s s GLN 478 CO 0.02 0.49 -0.07 0.42 -1.32 0.00 0.00 175.29 174.83 3a9s s ILE 479 N -0.69 0.57 -0.25 3.63 1.01 0.96 -1.59 121.20 124.83 3a9s s ILE 479 Ca 0.10 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 3a9s s ILE 479 Cb -0.09 -0.52 0.10 0.00 0.01 0.00 0.00 42.46 41.96 3a9s s ILE 479 CO 0.01 -0.00 0.20 0.00 0.00 0.00 0.00 174.94 175.14 3a9s s ALA 480 N -0.52 0.03 0.44 9.38 0.00 -0.06 -3.71 121.76 127.32 3a9s s ALA 480 Ca -0.01 -0.41 -0.18 0.00 0.00 0.00 0.00 51.96 51.36 3a9s s ALA 480 Cb -0.05 -1.46 -0.09 0.00 0.00 0.00 0.00 23.12 21.52 3a9s s ALA 480 CO 0.00 -1.50 0.92 -1.21 0.00 0.00 0.00 175.76 173.98 3a9s s GLU 481 N 2.24 4.08 0.00 0.00 2.02 -1.26 -1.32 118.70 124.46 3a9s s GLU 481 Ca 0.08 0.97 0.00 0.00 0.02 0.00 0.00 54.97 56.03 3a9s s GLU 481 Cb -0.15 -2.21 0.00 0.00 0.10 0.00 0.00 34.13 31.87 3a9s s GLU 481 CO -0.26 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.34 3a9s n GLY 482 N -0.97 1.10 3.11 -1.39 0.00 -0.04 -0.63 105.19 106.37 3a9s n GLY 482 Ca 0.06 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 3a9s n GLY 482 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a9s s TYR 483 N -1.06 0.26 0.37 1.61 1.51 -0.38 -1.22 117.35 118.44 3a9s s TYR 483 Ca 0.00 -0.63 -0.08 0.00 -1.01 0.00 0.00 57.07 55.35 3a9s s TYR 483 Cb 0.00 -0.19 -0.06 0.00 -0.11 0.00 0.00 41.96 41.60 3a9s s TYR 483 CO 0.00 -0.38 0.69 0.95 -1.11 0.00 0.00 175.55 175.71 3a9s s THR 484 N -2.93 4.87 0.15 -0.71 -4.23 -0.28 -1.21 115.64 111.31 3a9s s THR 484 Ca -0.02 0.40 0.04 0.00 -1.18 0.00 0.00 61.69 60.93 3a9s s THR 484 Cb 0.01 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 3a9s s THR 484 CO -0.06 -0.46 -0.08 0.68 -0.54 0.00 0.00 174.62 174.16 3a9s s VAL 485 N -2.28 1.06 -0.10 2.29 -7.23 -0.16 0.20 120.40 114.18 3a9s s VAL 485 Ca 0.48 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.59 3a9s s VAL 485 Cb -0.10 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 3a9s s VAL 485 CO 0.31 -0.70 0.02 -1.81 -0.31 0.00 0.00 175.10 172.61 3a9s s ASP 486 N -3.17 5.41 0.17 4.85 1.01 -1.26 -4.20 116.67 119.49 3a9s s ASP 486 Ca 0.18 0.19 0.09 0.00 0.71 0.00 0.00 52.55 53.71 3a9s s ASP 486 Cb 0.03 -1.59 -0.04 0.00 1.01 0.00 0.00 42.92 42.33 3a9s s ASP 486 CO 0.01 0.37 -0.10 -0.76 0.21 0.00 0.00 175.17 174.90 3a9s s LEU 487 N -0.83 2.95 0.46 1.23 1.43 -1.26 -5.03 118.68 117.63 3a9s s LEU 487 Ca 0.13 -0.57 -0.24 0.00 -1.03 0.00 0.00 54.13 52.42 3a9s s LEU 487 Cb -0.12 -1.65 -0.08 0.00 0.03 0.00 0.00 46.19 44.37 3a9s s LEU 487 CO 0.02 0.11 1.25 -2.65 0.23 0.00 0.00 176.35 175.31 3a9s n PRO 488 N 0.12 1.77 -0.25 1.29 -0.02 -1.26 -4.66 135.00 131.99 3a9s n PRO 488 Ca -0.11 0.64 0.02 0.00 -2.02 0.00 0.00 63.50 62.02 3a9s n PRO 488 Cb 0.55 -2.38 0.09 0.00 -0.02 0.00 0.00 33.50 31.74 3a9s n PRO 488 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9s h GLU 489 N 1.80 0.01 -0.24 -0.52 4.81 -1.99 0.03 114.58 118.47 3a9s h GLU 489 Ca -0.48 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.67 3a9s h GLU 489 Cb 1.30 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 3a9s h GLU 489 CO 0.58 0.00 -0.18 1.49 -0.73 0.00 0.00 179.01 180.18 3a9s h GLU 490 N 0.01 0.41 -0.10 1.92 4.22 -1.99 -1.13 114.58 117.92 3a9s h GLU 490 Ca 0.36 -0.13 -0.03 0.00 0.08 0.00 0.00 59.36 59.64 3a9s h GLU 490 Cb 0.55 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 3a9s h GLU 490 CO -0.75 0.58 -0.06 0.28 -2.18 0.00 0.00 179.01 176.89 3a9s h VAL 491 N 0.38 1.33 -0.19 0.32 2.07 -1.40 -2.49 116.25 116.26 3a9s h VAL 491 Ca 0.07 -1.11 0.03 0.00 0.82 0.00 0.00 66.70 66.52 3a9s h VAL 491 Cb 0.53 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 3a9s h VAL 491 CO 0.03 0.31 -0.02 -0.74 0.02 0.00 0.00 177.57 177.18 3a9s h HIS 492 N -0.16 -0.05 -0.87 1.57 -0.00 -0.96 -2.28 115.15 112.42 3a9s h HIS 492 Ca 0.02 0.02 0.17 0.00 -0.00 0.00 0.00 60.37 60.57 3a9s h HIS 492 Cb 0.52 0.05 -0.10 0.00 -0.00 0.00 0.00 27.41 27.88 3a9s h HIS 492 CO 0.07 -0.05 0.43 -0.44 -0.00 0.00 0.00 177.93 177.95 3a9s h ASP 493 N 0.04 0.49 -0.08 3.26 3.32 -1.13 0.21 116.42 122.53 3a9s h ASP 493 Ca 0.09 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 3a9s h ASP 493 Cb 0.12 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 3a9s h ASP 493 CO -0.17 0.17 -0.03 0.58 -1.72 0.00 0.00 179.24 178.08 3a9s h VAL 494 N 0.58 1.31 -0.65 -1.35 2.07 -0.98 -0.57 116.25 116.66 3a9s h VAL 494 Ca 0.49 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 3a9s h VAL 494 Cb 0.76 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.30 3a9s h VAL 494 CO -0.40 0.28 0.14 -0.07 0.02 0.00 0.00 177.57 177.54 3a9s h LEU 495 N -0.19 0.98 -0.10 2.57 3.38 -0.88 -3.13 115.31 117.94 3a9s h LEU 495 Ca 0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3a9s h LEU 495 Cb 0.45 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3a9s h LEU 495 CO 0.01 0.96 -0.00 -0.78 0.09 0.00 0.00 178.44 178.72 3a9s h ASP 496 N 0.98 0.18 -0.04 -0.43 3.58 -0.58 -3.24 116.42 116.87 3a9s h ASP 496 Ca 0.20 -0.31 -0.01 0.00 0.42 0.00 0.00 57.03 57.33 3a9s h ASP 496 Cb 0.37 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 3a9s h ASP 496 CO 0.00 0.44 -0.00 0.11 -2.88 0.00 0.00 179.24 176.92 3a9s h LYS 497 N -0.10 0.13 -0.28 0.28 1.79 -1.07 -1.84 116.57 115.49 3a9s h LYS 497 Ca 0.03 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3a9s h LYS 497 Cb 0.35 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 3a9s h LYS 497 CO 0.01 0.15 0.00 2.89 -1.08 0.00 0.00 179.45 181.41 3a9s n ARG 498 N -4.45 1.81 0.00 3.15 1.85 -1.19 -4.63 116.66 113.19 3a9s n ARG 498 Ca -0.02 -1.24 0.00 0.00 -1.00 0.00 0.00 57.85 55.60 3a9s n ARG 498 Cb 0.14 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 30.21 3a9s n ARG 498 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 3a9s n THR 499 N 0.48 0.00 -2.83 8.89 -1.04 -0.71 -5.06 114.28 114.01 3a9s n THR 499 Ca 0.14 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.08 3a9s n THR 499 Cb 0.32 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 68.64 3a9s n THR 499 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3a9s n ASP 500 N -0.17 -3.08 0.12 8.00 8.00 -1.11 -5.03 116.55 123.28 3a9s n ASP 500 Ca 0.00 -2.90 0.08 0.00 0.71 0.00 0.00 54.79 52.68 3a9s n ASP 500 Cb 0.00 1.51 0.41 0.00 -0.02 0.00 0.00 41.12 43.02 3a9s n ASP 500 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3a9s n PRO 501 N 2.80 0.10 0.00 -0.24 -0.04 -1.18 -1.60 135.00 134.83 3a9s n PRO 501 Ca 0.18 0.59 0.13 0.00 -0.04 0.00 0.00 63.50 64.37 3a9s n PRO 501 Cb 0.56 -1.83 0.37 0.00 -0.04 0.00 0.00 33.50 32.55 3a9s n PRO 501 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3a9s n THR 502 N -2.03 0.00 -3.89 0.52 -2.24 -1.26 -4.91 114.28 100.48 3a9s n THR 502 Ca -0.01 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.23 3a9s n THR 502 Cb 0.04 0.84 -0.04 0.00 -2.10 0.00 0.00 70.33 69.07 3a9s n THR 502 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 3a9s s TRP 503 N -2.04 2.96 -0.03 4.78 0.51 -0.63 -4.00 118.94 120.49 3a9s s TRP 503 Ca 0.34 -0.25 -0.30 0.00 -2.12 0.00 0.00 56.10 53.76 3a9s s TRP 503 Cb 0.21 -1.70 -0.03 0.00 -0.81 0.00 0.00 33.47 31.14 3a9s s TRP 503 CO 0.34 0.27 1.06 -1.25 -0.51 0.00 0.00 176.95 176.85 3a9s s PRO 504 N -3.96 4.47 -0.11 4.98 0.04 -0.24 -4.39 135.00 135.79 3a9s s PRO 504 Ca 0.39 1.51 -0.03 0.00 0.04 0.00 0.00 61.00 62.90 3a9s s PRO 504 Cb -0.06 -3.48 -0.03 0.00 0.04 0.00 0.00 34.50 30.96 3a9s s PRO 504 CO 0.26 -0.21 0.02 0.99 0.04 0.00 0.00 177.00 178.10 3a9s s THR 505 N 1.47 4.45 -0.07 1.26 2.01 -0.56 -4.04 115.64 120.15 3a9s s THR 505 Ca 0.53 -0.19 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 3a9s s THR 505 Cb -0.22 -2.90 0.03 0.00 0.01 0.00 0.00 72.50 69.41 3a9s s THR 505 CO 0.25 0.58 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.86 3a9s s THR 506 N -0.61 0.41 -0.31 -0.82 2.01 -0.46 -1.24 115.64 114.62 3a9s s THR 506 Ca 0.10 0.08 -0.17 0.00 0.31 0.00 0.00 61.69 62.01 3a9s s THR 506 Cb -0.12 -0.55 -0.02 0.00 0.01 0.00 0.00 72.50 71.83 3a9s s THR 506 CO 0.02 0.26 0.46 0.26 -0.69 0.00 0.00 174.62 174.93 3a9s s TRP 507 N 1.81 3.22 -0.06 4.92 0.52 -1.26 -1.36 118.94 126.73 3a9s s TRP 507 Ca 0.03 0.30 0.03 0.00 0.02 0.00 0.00 56.10 56.48 3a9s s TRP 507 Cb -0.13 -2.76 -0.02 0.00 -1.15 0.00 0.00 33.47 29.41 3a9s s TRP 507 CO -0.05 -0.40 -0.15 0.12 0.02 0.00 0.00 176.95 176.50 3a9s s PHE 508 N 2.24 2.69 -0.16 -1.98 5.36 -0.32 -0.98 117.98 124.83 3a9s s PHE 508 Ca 0.17 -0.23 -0.00 0.00 -0.96 0.00 0.00 56.93 55.91 3a9s s PHE 508 Cb -0.16 -1.65 0.04 0.00 -0.34 0.00 0.00 43.02 40.91 3a9s s PHE 508 CO 0.11 0.13 -0.07 0.08 -1.46 0.00 0.00 175.22 174.01 3a9s s VAL 509 N -0.60 1.21 0.36 3.12 1.01 -0.35 -0.58 120.40 124.58 3a9s s VAL 509 Ca 0.09 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.20 3a9s s VAL 509 Cb -0.11 -1.32 -0.10 0.00 0.00 0.00 0.00 36.38 34.84 3a9s s VAL 509 CO 0.01 0.21 0.94 -2.16 0.00 0.00 0.00 175.10 174.10 3a9s s PRO 510 N 1.60 4.43 0.25 2.72 0.04 -1.26 -1.25 135.00 141.53 3a9s s PRO 510 Ca 0.02 1.23 -0.30 0.00 0.04 0.00 0.00 61.00 61.99 3a9s s PRO 510 Cb -0.15 -2.55 -0.10 0.00 0.04 0.00 0.00 34.50 31.75 3a9s s PRO 510 CO -0.08 0.15 1.35 -0.80 0.04 0.00 0.00 177.00 177.66 3a9s s ASN 511 N -1.85 6.80 0.08 6.66 0.01 0.20 -4.93 114.94 121.90 3a9s s ASN 511 Ca 0.55 2.55 0.02 0.00 -0.71 0.00 0.00 52.86 55.27 3a9s s ASN 511 Cb -0.15 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.85 3a9s s ASN 511 CO 0.19 -0.58 0.17 -0.76 -1.51 0.00 0.00 177.10 174.61 3a9s s LEU 512 N -0.60 4.12 -0.00 0.60 1.43 -1.26 -4.90 118.68 118.06 3a9s s LEU 512 Ca 0.56 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.80 3a9s s LEU 512 Cb -0.39 -2.75 -0.02 0.00 0.03 0.00 0.00 46.19 43.07 3a9s s LEU 512 CO 0.43 0.15 0.04 0.35 0.23 0.00 0.00 176.35 177.56 3a9s n THR 513 N 0.21 0.00 -0.80 5.49 -2.24 -0.35 -5.00 114.28 111.59 3a9s n THR 513 Ca -0.07 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 3a9s n THR 513 Cb 0.52 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 3a9s n THR 513 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a9s n GLY 514 N 1.61 0.87 3.23 3.38 0.00 -0.71 -4.97 105.19 108.61 3a9s n GLY 514 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 3a9s n GLY 514 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a9s s GLU 515 N -0.20 1.36 4.30 1.61 2.02 -1.26 -4.66 118.70 121.87 3a9s s GLU 515 Ca 0.00 -1.74 0.00 0.00 0.02 0.00 0.00 54.97 53.25 3a9s s GLU 515 Cb 0.00 0.24 0.00 0.00 0.10 0.00 0.00 34.13 34.47 3a9s s GLU 515 CO 0.00 -0.45 0.00 0.41 0.02 0.00 0.00 175.26 175.24 3a9s n GLY 516 N -0.38 2.76 0.42 -1.39 0.00 -1.26 -1.13 105.19 104.21 3a9s n GLY 516 Ca 0.03 -0.20 0.08 0.00 0.00 0.00 0.00 46.02 45.93 3a9s n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9s n ALA 517 N 8.75 2.51 -1.74 4.61 0.00 -1.26 -3.89 120.51 129.49 3a9s n ALA 517 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 53.44 52.94 3a9s n ALA 517 Cb 0.00 -1.08 0.13 0.00 0.00 0.00 0.00 19.45 18.50 3a9s n ALA 517 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a9s n PHE 518 N 0.08 1.33 0.09 0.00 3.72 -0.29 -2.70 117.46 119.70 3a9s n PHE 518 Ca 0.13 -1.85 -0.06 0.00 -0.05 0.00 0.00 57.45 55.61 3a9s n PHE 518 Cb 0.23 -0.36 0.04 0.00 -0.94 0.00 0.00 39.48 38.45 3a9s n PHE 518 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3a9s h LYS 519 N 1.50 0.15 -3.26 -1.08 1.57 -1.65 -0.71 116.57 113.09 3a9s h LYS 519 Ca 0.19 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3a9s h LYS 519 Cb 1.29 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 33.55 3a9s h LYS 519 CO 0.40 0.86 0.07 0.16 -0.57 0.00 0.00 179.45 180.37 3a9s s ASP 520 N -6.88 -0.25 0.26 0.86 1.47 -1.26 -4.47 116.67 106.39 3a9s s ASP 520 Ca -0.02 -0.58 -0.05 0.00 1.18 0.00 0.00 52.55 53.07 3a9s s ASP 520 Cb 0.11 0.63 0.29 0.00 -0.34 0.00 0.00 42.92 43.61 3a9s s ASP 520 CO 0.81 -1.16 1.90 0.58 0.68 0.00 0.00 175.17 177.98 3a9s h VAL 521 N 2.13 1.25 -0.55 2.11 2.07 -1.91 -2.55 116.25 118.80 3a9s h VAL 521 Ca -0.25 -0.54 0.06 0.00 0.82 0.00 0.00 66.70 66.79 3a9s h VAL 521 Cb 1.26 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 3a9s h VAL 521 CO 0.32 0.26 0.25 0.22 0.02 0.00 0.00 177.57 178.65 3a9s h TYR 522 N 1.24 0.45 -0.19 1.57 3.20 -1.95 -2.11 116.97 119.19 3a9s h TYR 522 Ca 0.32 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.22 3a9s h TYR 522 Cb -0.05 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 3a9s h TYR 522 CO 0.01 0.19 0.11 0.77 -1.64 0.00 0.00 178.16 177.59 3a9s h SER 523 N 0.48 0.22 -0.37 -2.11 0.02 -1.72 0.37 113.55 110.44 3a9s h SER 523 Ca 0.26 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.17 3a9s h SER 523 Cb 0.22 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 3a9s h SER 523 CO -0.21 0.17 0.10 0.58 -1.14 0.00 0.00 176.83 176.34 3a9s h VAL 524 N 0.26 1.22 -0.14 2.27 2.07 -1.16 -1.38 116.25 119.38 3a9s h VAL 524 Ca 0.07 -0.72 -0.22 0.00 0.82 0.00 0.00 66.70 66.65 3a9s h VAL 524 Cb -0.00 0.99 0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3a9s h VAL 524 CO -0.01 0.25 -0.77 -0.03 0.02 0.00 0.00 177.57 177.03 3a9s h MET 525 N 0.45 0.74 0.00 1.57 1.85 -1.33 -2.85 114.93 115.36 3a9s h MET 525 Ca 0.12 -0.60 -0.01 0.00 -0.61 0.00 0.00 59.70 58.59 3a9s h MET 525 Cb 0.28 0.12 -0.00 0.00 0.43 0.00 0.00 31.60 32.43 3a9s h MET 525 CO -0.00 1.21 -0.06 -0.97 -0.40 0.00 0.00 176.91 176.69 3a9s h ASN 526 N 0.50 0.00 -0.17 1.39 -1.24 -0.85 -1.58 115.58 113.63 3a9s h ASN 526 Ca -0.05 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.96 3a9s h ASN 526 Cb 1.39 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.44 3a9s h ASN 526 CO 0.16 0.06 0.00 0.59 -1.29 0.00 0.00 177.43 176.95 3a9s n ASN 527 N -4.21 2.52 -4.72 1.15 3.02 -0.53 -4.91 115.26 107.59 3a9s n ASN 527 Ca -0.03 -1.83 -0.42 0.00 -0.03 0.00 0.00 54.58 52.27 3a9s n ASN 527 Cb 0.15 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 3a9s n ASN 527 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3a9s s TRP 528 N -1.80 3.41 -2.08 3.10 -0.11 -0.60 -4.92 118.94 115.94 3a9s s TRP 528 Ca 0.34 1.29 0.14 0.00 1.22 0.00 0.00 56.10 59.08 3a9s s TRP 528 Cb 0.20 -3.46 0.56 0.00 -1.50 0.00 0.00 33.47 29.28 3a9s s TRP 528 CO 0.30 -1.40 1.40 0.41 -4.62 0.00 0.00 176.95 173.04 3a9s n GLY 529 N 3.00 -0.15 3.78 5.86 0.00 -1.26 -4.92 105.19 111.50 3a9s n GLY 529 Ca 0.08 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 3a9s n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9s s ALA 530 N -1.81 -0.87 -1.16 4.61 0.00 -1.26 -5.04 121.76 116.23 3a9s s ALA 530 Ca 0.23 -0.53 0.28 0.00 0.00 0.00 0.00 51.96 51.94 3a9s s ALA 530 Cb 0.12 0.89 1.13 0.00 0.00 0.00 0.00 23.12 25.26 3a9s s ALA 530 CO 0.17 -0.98 1.84 0.27 0.00 0.00 0.00 175.76 177.06 3a9s n ASN 531 N -0.58 0.17 -4.50 0.00 6.94 -1.26 -4.85 115.26 111.19 3a9s n ASN 531 Ca -0.04 0.10 -0.25 0.00 -0.02 0.00 0.00 54.58 54.37 3a9s n ASN 531 Cb 0.60 -0.26 -0.10 0.00 -2.36 0.00 0.00 39.78 37.66 3a9s n ASN 531 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 3a9s s HIS 532 N -2.86 2.30 0.23 -2.53 3.76 -1.26 -0.93 115.29 114.00 3a9s s HIS 532 Ca 0.18 -0.43 -0.14 0.00 -0.15 0.00 0.00 55.06 54.51 3a9s s HIS 532 Cb 0.19 -1.17 0.00 0.00 1.11 0.00 0.00 32.58 32.72 3a9s s HIS 532 CO 0.54 0.63 0.49 0.00 -0.85 0.00 0.00 174.74 175.55 3a9s s SER 534 N -2.98 3.27 -0.14 0.00 0.15 -0.42 -1.87 113.70 111.71 3a9s s SER 534 Ca 0.18 -0.45 -0.02 0.00 0.70 0.00 0.00 55.95 56.36 3a9s s SER 534 Cb -0.01 -0.88 -0.02 0.00 -1.71 0.00 0.00 66.02 63.40 3a9s s SER 534 CO 0.06 0.25 -0.07 -0.63 1.20 0.00 0.00 173.24 174.05 3a9s s ILE 535 N -0.21 3.58 0.06 6.45 1.01 0.59 -1.37 121.20 131.31 3a9s s ILE 535 Ca -0.02 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.25 3a9s s ILE 535 Cb -0.13 -2.55 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 3a9s s ILE 535 CO 0.03 0.51 -0.23 -0.55 0.00 0.00 0.00 174.94 174.70 3a9s s SER 536 N 0.33 2.75 0.48 3.58 0.15 -0.38 -0.78 113.70 119.82 3a9s s SER 536 Ca -0.06 -0.58 -0.22 0.00 0.70 0.00 0.00 55.95 55.79 3a9s s SER 536 Cb -0.15 -0.22 -0.07 0.00 -1.71 0.00 0.00 66.02 63.87 3a9s s SER 536 CO 0.04 0.18 1.14 -0.47 1.20 0.00 0.00 173.24 175.33 3a9s s TYR 537 N -0.87 2.86 0.00 3.44 6.14 -1.26 -1.08 117.35 126.58 3a9s s TYR 537 Ca 0.09 1.55 0.00 0.00 0.64 0.00 0.00 57.07 59.35 3a9s s TYR 537 Cb -0.09 -3.33 0.00 0.00 0.42 0.00 0.00 41.96 38.96 3a9s s TYR 537 CO 0.03 -1.44 0.00 0.41 0.64 0.00 0.00 175.55 175.19 3a9s n GLY 538 N 0.34 -0.60 3.26 8.97 0.00 0.16 -4.75 105.19 112.57 3a9s n GLY 538 Ca 0.08 -1.71 -0.44 0.00 0.00 0.00 0.00 46.02 43.95 3a9s n GLY 538 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a9s s HIS 539 N -1.86 3.54 -0.44 1.61 3.76 -1.26 -2.41 115.29 118.23 3a9s s HIS 539 Ca 0.00 -1.96 0.15 0.00 -0.15 0.00 0.00 55.06 53.10 3a9s s HIS 539 Cb 0.00 -3.64 0.57 0.00 1.11 0.00 0.00 32.58 30.61 3a9s s HIS 539 CO 0.00 -0.97 1.48 0.44 -0.85 0.00 0.00 174.74 174.84 3a9s n ILE 540 N 4.31 2.10 -0.26 0.60 -5.35 -1.26 -4.67 119.36 114.83 3a9s n ILE 540 Ca 0.03 -1.57 -0.00 0.00 -0.27 0.00 0.00 62.75 60.94 3a9s n ILE 540 Cb 0.43 -0.08 0.12 0.00 -1.74 0.00 0.00 39.64 38.36 3a9s n ILE 540 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3a9s h GLY 541 N 2.49 1.09 1.12 3.28 0.00 -1.97 -0.09 103.07 108.99 3a9s h GLY 541 Ca 0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 3a9s h GLY 541 CO 0.23 0.17 0.17 0.00 0.00 0.00 0.00 176.54 177.11 3a9s h ALA 542 N 1.38 1.00 -0.54 3.60 0.00 -1.89 -0.31 119.26 122.50 3a9s h ALA 542 Ca 0.33 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3a9s h ALA 542 Cb 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3a9s h ALA 542 CO -0.20 0.65 0.00 -0.44 0.00 0.00 0.00 179.25 179.27 3a9s h ASP 543 N 1.04 0.92 -0.39 0.00 3.32 -1.73 -2.12 116.42 117.47 3a9s h ASP 543 Ca 0.22 -0.31 -0.07 0.00 0.02 0.00 0.00 57.03 56.90 3a9s h ASP 543 Cb 0.36 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3a9s h ASP 543 CO 0.00 1.00 0.02 -0.07 -1.72 0.00 0.00 179.24 178.48 3a9s h LEU 544 N 0.82 0.73 -0.40 1.55 3.38 -0.70 -1.05 115.31 119.64 3a9s h LEU 544 Ca 0.15 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3a9s h LEU 544 Cb 0.53 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3a9s h LEU 544 CO 0.03 0.78 0.07 0.40 0.09 0.00 0.00 178.44 179.81 3a9s h ILE 545 N 0.72 1.24 -0.45 1.22 2.04 -0.85 0.11 117.51 121.54 3a9s h ILE 545 Ca 0.14 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 3a9s h ILE 545 Cb 0.41 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3a9s h ILE 545 CO 0.02 0.29 0.15 0.74 0.00 0.00 0.00 178.15 179.35 3a9s h THR 546 N 0.52 1.22 -0.53 -0.27 2.02 -1.15 -1.43 112.91 113.30 3a9s h THR 546 Ca 0.12 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 3a9s h THR 546 Cb 0.36 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 3a9s h THR 546 CO 0.01 0.26 0.32 0.25 0.37 0.00 0.00 175.52 176.73 3a9s h LEU 547 N 0.59 0.63 -0.88 2.58 6.46 -1.01 -2.18 115.31 121.49 3a9s h LEU 547 Ca 0.15 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 3a9s h LEU 547 Cb 0.25 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 39.98 3a9s h LEU 547 CO -0.01 0.49 0.56 0.00 -0.62 0.00 0.00 178.44 178.87 3a9s h ALA 548 N 1.16 1.12 -0.27 1.25 0.00 -0.51 -2.00 119.26 120.02 3a9s h ALA 548 Ca 0.19 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3a9s h ALA 548 Cb -0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3a9s h ALA 548 CO -0.04 0.55 -0.19 0.66 0.00 0.00 0.00 179.25 180.23 3a9s h SER 549 N 1.20 0.47 -0.39 0.00 4.64 -0.90 0.32 113.55 118.90 3a9s h SER 549 Ca 0.32 -0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 61.42 3a9s h SER 549 Cb -0.10 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 61.84 3a9s h SER 549 CO -0.07 0.68 -0.02 0.40 -0.87 0.00 0.00 176.83 176.95 3a9s h ILE 550 N 0.44 1.24 -0.00 0.95 2.04 -0.87 -2.34 117.51 118.97 3a9s h ILE 550 Ca 0.07 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.91 3a9s h ILE 550 Cb 0.57 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3a9s h ILE 550 CO 0.04 0.36 -0.06 0.18 0.00 0.00 0.00 178.15 178.67 3a9s n LEU 551 N -4.21 0.51 -2.98 1.44 4.77 -0.80 -4.92 117.00 110.81 3a9s n LEU 551 Ca 0.02 -0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.73 3a9s n LEU 551 Cb 0.31 -0.12 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 3a9s n LEU 551 CO 0.42 0.09 0.05 0.54 -1.33 0.00 0.00 177.39 177.16 3a9s n ARG 552 N -0.80 -5.27 -3.70 3.23 1.74 -0.06 -4.95 116.66 106.85 3a9s n ARG 552 Ca 0.17 0.85 -0.38 0.00 -0.77 0.00 0.00 57.85 57.72 3a9s n ARG 552 Cb 0.25 -5.64 -0.12 0.00 -1.02 0.00 0.00 32.46 25.93 3a9s n ARG 552 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3a9s s ILE 553 N -3.18 4.34 0.63 0.55 1.01 -0.24 -4.81 121.20 119.50 3a9s s ILE 553 Ca 0.34 -0.54 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 3a9s s ILE 553 Cb -0.15 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.08 3a9s s ILE 553 CO 0.43 0.06 1.15 -2.16 0.00 0.00 0.00 174.94 174.42 3a9s s PRO 554 N 1.57 2.86 -0.41 2.79 0.04 -1.26 -4.37 135.00 136.22 3a9s s PRO 554 Ca 0.04 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 62.59 3a9s s PRO 554 Cb -0.17 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.52 3a9s s PRO 554 CO 0.05 -1.24 0.23 0.08 0.04 0.00 0.00 177.00 176.16 3a9s s VAL 555 N -2.00 3.88 -0.13 -0.36 1.01 -1.26 -1.11 120.40 120.42 3a9s s VAL 555 Ca 0.71 -1.61 0.28 0.00 0.00 0.00 0.00 61.98 61.37 3a9s s VAL 555 Cb -0.24 -3.45 0.35 0.00 0.00 0.00 0.00 36.38 33.04 3a9s s VAL 555 CO 0.37 -0.55 1.80 -0.55 0.00 0.00 0.00 175.10 176.17 3a9s h ASN 556 N 8.29 0.00 -3.00 3.32 -1.07 -1.73 -3.45 115.58 117.94 3a9s h ASN 556 Ca -0.20 0.00 -0.05 0.00 0.07 0.00 0.00 56.30 56.12 3a9s h ASN 556 Cb 1.07 0.00 -0.24 0.00 -2.07 0.00 0.00 38.32 37.08 3a9s h ASN 556 CO 0.74 0.03 -0.17 -0.32 0.07 0.00 0.00 177.43 177.77 3a9s s MET 557 N -3.45 0.52 -0.08 4.14 0.00 -1.25 -5.05 119.30 114.12 3a9s s MET 557 Ca 0.04 1.02 -0.30 0.00 0.00 0.00 0.00 55.69 56.45 3a9s s MET 557 Cb 0.07 0.13 0.11 0.00 0.00 0.00 0.00 34.83 35.14 3a9s s MET 557 CO 0.61 -0.17 0.89 -3.38 0.00 0.00 0.00 175.02 172.97 3a9s s HIS 558 N 1.69 -0.43 -0.30 4.11 -3.43 -1.25 -0.03 115.29 115.66 3a9s s HIS 558 Ca -0.09 0.60 0.08 0.00 -0.80 0.00 0.00 55.06 54.85 3a9s s HIS 558 Cb -0.08 0.47 0.46 0.00 -1.43 0.00 0.00 32.58 32.00 3a9s s HIS 558 CO -0.16 -0.47 1.32 0.27 -2.00 0.00 0.00 174.74 173.70 3a9s n ASN 559 N 0.45 3.70 -4.74 7.38 6.94 -1.24 -5.01 115.26 122.75 3a9s n ASN 559 Ca -0.12 -3.81 -0.40 0.00 -0.02 0.00 0.00 54.58 50.24 3a9s n ASN 559 Cb 0.59 -0.51 -0.05 0.00 -2.36 0.00 0.00 39.78 37.45 3a9s n ASN 559 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3a9s s VAL 560 N -3.95 4.88 0.25 3.53 1.01 -1.26 -4.86 120.40 120.01 3a9s s VAL 560 Ca 0.47 1.52 -0.31 0.00 0.00 0.00 0.00 61.98 63.67 3a9s s VAL 560 Cb 0.41 -4.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.58 3a9s s VAL 560 CO -0.00 0.32 1.35 -2.65 0.00 0.00 0.00 175.10 174.12 3a9s n PRO 561 N 3.21 1.96 0.25 2.72 -0.02 -1.26 -4.84 135.00 137.02 3a9s n PRO 561 Ca -0.02 0.69 0.15 0.00 -2.02 0.00 0.00 63.50 62.30 3a9s n PRO 561 Cb 0.51 -2.31 0.84 0.00 -0.02 0.00 0.00 33.50 32.52 3a9s n PRO 561 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3a9s h GLU 562 N 3.78 0.00 0.00 -0.52 5.08 -1.98 -0.49 114.58 120.45 3a9s h GLU 562 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3a9s h GLU 562 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3a9s h GLU 562 CO 0.72 0.00 0.00 1.05 -1.00 0.00 0.00 179.01 179.78 3a9s h GLU 563 N 0.00 0.00 -0.01 2.33 9.09 -2.05 -2.28 114.58 121.66 3a9s h GLU 563 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 3a9s h GLU 563 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 3a9s h GLU 563 CO -0.00 0.00 -0.38 1.63 0.05 0.00 0.00 179.01 180.30 3a9s n LYS 564 N -2.64 1.03 -2.22 1.06 4.76 -0.19 -4.90 118.16 115.06 3a9s n LYS 564 Ca 0.00 -0.76 -0.42 0.00 -2.87 0.00 0.00 58.31 54.26 3a9s n LYS 564 Cb 0.21 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.89 3a9s n LYS 564 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3a9s s ILE 565 N -2.49 3.78 -0.26 -0.18 1.01 -0.86 -4.86 121.20 117.34 3a9s s ILE 565 Ca 0.21 1.10 -0.01 0.00 0.00 0.00 0.00 60.65 61.96 3a9s s ILE 565 Cb 0.19 -3.71 0.08 0.00 0.01 0.00 0.00 42.46 39.03 3a9s s ILE 565 CO 0.55 -0.03 0.04 0.12 0.00 0.00 0.00 174.94 175.62 3a9s s PHE 566 N 2.83 1.83 0.27 3.97 5.36 -1.26 -5.09 117.98 125.89 3a9s s PHE 566 Ca 0.64 -1.58 0.05 0.00 -0.96 0.00 0.00 56.93 55.07 3a9s s PHE 566 Cb -0.30 -1.57 -0.06 0.00 -0.34 0.00 0.00 43.02 40.75 3a9s s PHE 566 CO 0.25 -0.78 -0.00 1.03 -1.46 0.00 0.00 175.22 174.26 3a9s s ARG 567 N 1.58 1.50 0.63 10.12 0.52 -1.26 -4.08 118.95 127.97 3a9s s ARG 567 Ca 0.03 -1.78 -0.18 0.00 -0.52 0.00 0.00 55.73 53.28 3a9s s ARG 567 Cb -0.18 -0.87 -0.03 0.00 0.52 0.00 0.00 34.95 34.39 3a9s s ARG 567 CO -0.15 -0.08 0.98 -2.30 0.02 0.00 0.00 175.30 173.78 3a9s n PRO 568 N -0.55 0.82 -0.15 3.54 -0.02 -1.26 -4.74 135.00 132.63 3a9s n PRO 568 Ca -0.04 0.33 0.16 0.00 -2.02 0.00 0.00 63.50 61.92 3a9s n PRO 568 Cb 0.64 -2.20 0.52 0.00 -0.02 0.00 0.00 33.50 32.44 3a9s n PRO 568 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3a9s h ASP 569 N 0.31 0.36 -0.33 2.55 3.58 -1.46 -1.69 116.42 119.73 3a9s h ASP 569 Ca -0.49 0.02 0.09 0.00 0.42 0.00 0.00 57.03 57.07 3a9s h ASP 569 Cb 1.36 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 42.34 3a9s h ASP 569 CO 0.50 0.18 0.24 0.00 -2.88 0.00 0.00 179.24 177.28 3a9s h ALA 570 N 1.65 2.25 -0.82 -0.78 0.00 -1.89 -2.33 119.26 117.33 3a9s h ALA 570 Ca 0.36 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.33 3a9s h ALA 570 Cb 0.88 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 3a9s h ALA 570 CO -0.11 -0.34 0.54 -1.49 0.00 0.00 0.00 179.25 177.85 3a9s h TRP 571 N 0.05 0.90 0.00 0.00 6.55 -1.64 -0.91 115.95 120.90 3a9s h TRP 571 Ca 0.16 0.02 -0.03 0.00 0.95 0.00 0.00 58.89 59.99 3a9s h TRP 571 Cb 0.56 -0.30 -0.00 0.00 -0.86 0.00 0.00 29.16 28.56 3a9s h TRP 571 CO -0.00 0.47 -0.14 0.66 -1.05 0.00 0.00 178.44 178.37 3a9s h SER 572 N 0.88 0.00 0.88 -3.49 4.64 -1.60 -1.18 113.55 113.67 3a9s h SER 572 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3a9s h SER 572 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3a9s h SER 572 CO -0.13 0.14 0.00 0.24 -0.87 0.00 0.00 176.83 176.21 3a9s h MET 573 N 0.00 0.00 -0.44 4.77 2.86 -1.28 -2.22 114.93 118.62 3a9s h MET 573 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3a9s h MET 573 Cb 0.37 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.03 3a9s h MET 573 CO 0.02 0.00 0.00 1.19 1.06 0.00 0.00 176.91 179.18 3a9s n PHE 574 N -2.62 0.58 0.00 -0.22 3.01 -0.45 -5.00 117.46 112.76 3a9s n PHE 574 Ca 0.01 -0.29 0.00 0.00 1.01 0.00 0.00 57.45 58.19 3a9s n PHE 574 Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 3a9s n PHE 574 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3a9s n GLY 575 N 1.53 4.48 0.00 1.37 0.00 -0.83 -4.25 105.19 107.48 3a9s n GLY 575 Ca 0.20 -0.73 0.03 0.00 0.00 0.00 0.00 46.02 45.52 3a9s n GLY 575 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3a9s n THR 576 N -0.80 0.00 -0.04 2.61 -2.24 -1.26 -4.48 114.28 108.08 3a9s n THR 576 Ca 0.00 -0.14 -0.15 0.00 -2.27 0.00 0.00 64.05 61.49 3a9s n THR 576 Cb 0.00 0.39 -0.13 0.00 -2.10 0.00 0.00 70.33 68.49 3a9s n THR 576 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3a9s h LYS 577 N 0.00 0.07 -4.01 -0.78 1.63 -1.96 -3.41 116.57 108.11 3a9s h LYS 577 Ca 0.00 -0.12 -0.67 0.00 -0.85 0.00 0.00 60.65 59.01 3a9s h LYS 577 Cb 0.26 0.04 -0.38 0.00 -0.60 0.00 0.00 32.23 31.55 3a9s h LYS 577 CO 0.00 1.04 -0.57 0.34 -3.45 0.00 0.00 179.45 176.81 3a9s s ASP 578 N -6.38 4.86 0.42 4.20 2.15 -1.26 -4.96 116.67 115.71 3a9s s ASP 578 Ca -0.18 -2.54 0.10 0.00 0.43 0.00 0.00 52.55 50.37 3a9s s ASP 578 Cb -0.02 -1.73 0.90 0.00 -0.30 0.00 0.00 42.92 41.77 3a9s s ASP 578 CO 0.72 -0.37 2.00 -0.07 -0.17 0.00 0.00 175.17 177.28 3a9s h LEU 579 N 7.26 0.24 0.05 -1.34 3.38 -1.83 -1.71 115.31 121.36 3a9s h LEU 579 Ca -0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3a9s h LEU 579 Cb 0.97 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3a9s h LEU 579 CO 0.65 0.30 -0.02 -0.08 0.09 0.00 0.00 178.44 179.38 3a9s h GLU 580 N 0.26 -0.06 -0.90 1.13 4.81 -1.94 -0.61 114.58 117.27 3a9s h GLU 580 Ca 0.06 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3a9s h GLU 580 Cb 0.19 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 3a9s h GLU 580 CO 0.00 0.21 0.59 0.78 -0.73 0.00 0.00 179.01 179.87 3a9s h GLY 581 N -0.34 1.27 1.40 1.92 0.00 -1.91 -1.75 103.07 103.67 3a9s h GLY 581 Ca -0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 3a9s h GLY 581 CO 0.01 0.47 0.19 0.00 0.00 0.00 0.00 176.54 177.21 3a9s h ALA 582 N 1.33 1.34 -0.21 3.60 0.00 -1.19 -1.18 119.26 122.95 3a9s h ALA 582 Ca 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3a9s h ALA 582 Cb -0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3a9s h ALA 582 CO -0.07 0.49 0.09 0.22 0.00 0.00 0.00 179.25 179.98 3a9s h ASP 583 N 0.76 0.28 -0.60 0.00 3.58 -0.27 0.14 116.42 120.30 3a9s h ASP 583 Ca 0.18 -0.14 -0.04 0.00 0.42 0.00 0.00 57.03 57.45 3a9s h ASP 583 Cb 0.19 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 3a9s h ASP 583 CO -0.01 0.34 0.21 1.88 -2.88 0.00 0.00 179.24 178.78 3a9s h TYR 584 N 0.20 0.94 -0.60 0.28 -1.99 -1.01 -0.99 116.97 113.79 3a9s h TYR 584 Ca 0.07 -0.08 -0.07 0.00 2.00 0.00 0.00 58.73 60.65 3a9s h TYR 584 Cb 0.14 -0.28 -0.02 0.00 2.00 0.00 0.00 36.73 38.57 3a9s h TYR 584 CO -0.02 0.77 0.11 0.00 -0.00 0.00 0.00 178.16 179.02 3a9s h ARG 585 N 0.84 0.99 -0.26 4.88 3.08 -1.00 -2.42 114.38 120.49 3a9s h ARG 585 Ca 0.20 -0.26 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 3a9s h ARG 585 Cb 0.25 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3a9s h ARG 585 CO -0.01 0.92 -0.10 0.00 -1.07 0.00 0.00 179.97 179.71 3a9s h ALA 586 N 1.02 0.36 -0.44 0.04 0.00 -0.57 -2.10 119.26 117.58 3a9s h ALA 586 Ca 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3a9s h ALA 586 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3a9s h ALA 586 CO 0.01 0.21 0.18 0.00 0.00 0.00 0.00 179.25 179.65 3a9s h LYS 588 N 0.62 0.10 -0.04 0.00 1.63 -1.37 -3.37 116.57 114.13 3a9s h LYS 588 Ca 0.15 -0.09 -0.10 0.00 -0.85 0.00 0.00 60.65 59.75 3a9s h LYS 588 Cb 0.12 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 31.78 3a9s h LYS 588 CO -0.02 0.81 -0.37 0.87 -3.45 0.00 0.00 179.45 177.30 3a9s h LYS 589 N -0.58 0.32 0.00 1.90 1.79 -1.33 -3.52 116.57 115.16 3a9s h LYS 589 Ca -0.01 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 3a9s h LYS 589 Cb 0.85 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 3a9s h LYS 589 CO 0.02 0.96 0.00 1.28 -1.08 0.00 0.00 179.45 180.64