#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a9t s LYS 3 N 0.00 4.81 -0.12 0.00 2.47 -1.26 -1.09 119.74 124.54 3a9t s LYS 3 Ca 0.00 1.46 -0.29 0.00 -1.56 0.00 0.00 55.97 55.57 3a9t s LYS 3 Cb 0.00 -3.30 -0.03 0.00 -1.46 0.00 0.00 37.83 33.05 3a9t s LYS 3 CO 0.00 0.47 1.33 0.34 0.16 0.00 0.00 175.35 177.65 3a9t s ASP 4 N -0.95 6.90 0.52 1.43 -1.08 -0.98 -4.67 116.67 117.84 3a9t s ASP 4 Ca 0.42 1.83 0.18 0.00 -0.52 0.00 0.00 52.55 54.45 3a9t s ASP 4 Cb -0.25 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 39.98 3a9t s ASP 4 CO 0.31 -0.77 2.15 1.55 0.52 0.00 0.00 175.17 178.93 3a9t h PRO 5 N 8.32 0.00 0.00 4.34 0.13 -1.94 -3.33 132.00 139.52 3a9t h PRO 5 Ca -0.30 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.64 3a9t h PRO 5 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 3a9t h PRO 5 CO 0.95 0.02 -1.69 0.54 -0.23 0.00 0.00 178.00 177.59 3a9t n ARG 6 N -4.42 1.48 -4.15 0.86 1.74 -1.26 -5.06 116.66 105.85 3a9t n ARG 6 Ca -0.03 0.03 -0.24 0.00 -0.77 0.00 0.00 57.85 56.84 3a9t n ARG 6 Cb 0.11 -1.25 -0.06 0.00 -1.02 0.00 0.00 32.46 30.24 3a9t n ARG 6 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3a9t s TYR 7 N -2.24 3.01 0.48 -1.55 1.51 -1.25 -4.95 117.35 112.35 3a9t s TYR 7 Ca -0.10 -0.12 -0.23 0.00 -1.01 0.00 0.00 57.07 55.61 3a9t s TYR 7 Cb 0.04 -1.38 -0.08 0.00 -0.11 0.00 0.00 41.96 40.42 3a9t s TYR 7 CO 0.35 0.54 1.22 0.28 -1.11 0.00 0.00 175.55 176.83 3a9t n VAL 8 N -0.81 3.02 -3.38 0.71 0.31 -1.26 -4.50 118.33 112.42 3a9t n VAL 8 Ca -0.08 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 3a9t n VAL 8 Cb 0.57 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 3a9t n VAL 8 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a9t n GLY 9 N 0.90 -1.93 3.95 2.92 0.00 -1.26 -4.91 105.19 104.85 3a9t n GLY 9 Ca 0.09 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.38 3a9t n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a9t s ASN 10 N -4.00 4.94 0.22 1.61 0.01 -1.26 -2.32 114.94 114.13 3a9t s ASN 10 Ca 0.00 -0.96 -0.22 0.00 -0.71 0.00 0.00 52.86 50.97 3a9t s ASN 10 Cb 0.00 0.11 -0.08 0.00 0.41 0.00 0.00 41.25 41.68 3a9t s ASN 10 CO 0.00 -1.07 0.76 -0.76 -1.51 0.00 0.00 177.10 174.52 3a9t s LEU 11 N -4.38 4.40 0.46 0.60 1.43 -0.25 -4.52 118.68 116.41 3a9t s LEU 11 Ca 0.47 1.51 -0.25 0.00 -1.03 0.00 0.00 54.13 54.84 3a9t s LEU 11 Cb -0.04 -3.56 -0.08 0.00 0.03 0.00 0.00 46.19 42.54 3a9t s LEU 11 CO 0.29 0.07 1.33 -2.65 0.23 0.00 0.00 176.35 175.61 3a9t n PRO 12 N 0.92 1.96 -4.28 1.29 -0.02 -1.26 -4.68 135.00 128.93 3a9t n PRO 12 Ca -0.03 0.70 -0.26 0.00 -2.02 0.00 0.00 63.50 61.90 3a9t n PRO 12 Cb 0.50 -2.49 -0.09 0.00 -0.02 0.00 0.00 33.50 31.41 3a9t n PRO 12 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3a9t s LYS 13 N -2.41 2.15 -0.20 -0.52 1.02 -0.98 -4.66 119.74 114.14 3a9t s LYS 13 Ca 0.63 -1.28 -0.08 0.00 0.02 0.00 0.00 55.97 55.25 3a9t s LYS 13 Cb -0.47 -2.18 -0.04 0.00 -0.52 0.00 0.00 37.83 34.62 3a9t s LYS 13 CO 0.56 0.42 0.09 0.42 -0.92 0.00 0.00 175.35 175.92 3a9t s ILE 14 N -1.85 4.93 -0.13 2.17 1.01 -0.83 -0.87 121.20 125.62 3a9t s ILE 14 Ca 0.27 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.88 3a9t s ILE 14 Cb -0.08 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 3a9t s ILE 14 CO 0.17 0.43 0.08 -0.83 0.00 0.00 0.00 174.94 174.78 3a9t s GLY 15 N 0.57 1.99 -0.18 6.18 0.00 0.92 -0.67 107.32 116.13 3a9t s GLY 15 Ca 0.05 -0.72 -0.04 0.00 0.00 0.00 0.00 44.72 44.00 3a9t s GLY 15 CO 0.01 -0.29 -0.02 -0.42 0.00 0.00 0.00 173.10 172.38 3a9t s ILE 16 N -0.53 3.86 -0.36 0.90 -1.09 0.83 -0.73 121.20 124.07 3a9t s ILE 16 Ca 0.11 -0.36 -0.05 0.00 -2.23 0.00 0.00 60.65 58.12 3a9t s ILE 16 Cb -0.12 -2.72 0.07 0.00 -1.58 0.00 0.00 42.46 38.11 3a9t s ILE 16 CO 0.02 0.46 0.12 -0.13 -1.23 0.00 0.00 174.94 174.18 3a9t s ARG 17 N 0.71 2.42 -0.73 2.79 0.52 0.25 -2.15 118.95 122.77 3a9t s ARG 17 Ca -0.01 -1.40 -0.23 0.00 -0.52 0.00 0.00 55.73 53.57 3a9t s ARG 17 Cb -0.14 -3.46 0.07 0.00 0.52 0.00 0.00 34.95 31.93 3a9t s ARG 17 CO 0.02 -0.80 1.09 -2.14 0.02 0.00 0.00 175.30 173.49 3a9t s PRO 18 N 1.30 3.21 0.26 3.54 0.02 -1.26 -0.55 135.00 141.51 3a9t s PRO 18 Ca 0.00 -0.82 -0.18 0.00 0.02 0.00 0.00 61.00 60.02 3a9t s PRO 18 Cb -0.21 -4.37 -0.09 0.00 0.02 0.00 0.00 34.50 29.86 3a9t s PRO 18 CO -0.00 -1.91 0.74 0.95 -0.33 0.00 0.00 177.00 176.44 3a9t s THR 19 N 4.36 4.59 0.21 0.99 -4.23 -0.46 0.62 115.64 121.72 3a9t s THR 19 Ca 0.28 1.20 -0.05 0.00 -1.18 0.00 0.00 61.69 61.94 3a9t s THR 19 Cb -0.12 -3.79 -0.03 0.00 1.34 0.00 0.00 72.50 69.90 3a9t s THR 19 CO 0.08 0.08 0.25 -0.51 -0.54 0.00 0.00 174.62 173.98 3a9t s ILE 20 N -1.67 0.00 -0.15 2.99 2.07 0.10 -4.56 121.20 119.99 3a9t s ILE 20 Ca 0.47 -1.78 -0.29 0.00 -1.41 0.00 0.00 60.65 57.63 3a9t s ILE 20 Cb -0.15 -2.38 -0.01 0.00 0.13 0.00 0.00 42.46 40.06 3a9t s ILE 20 CO 0.20 -0.01 1.15 -0.62 -1.91 0.00 0.00 174.94 173.74 3a9t s ASP 21 N -3.11 7.06 0.51 4.50 -1.08 -1.11 -4.07 116.67 119.37 3a9t s ASP 21 Ca 0.33 1.60 0.34 0.00 -0.52 0.00 0.00 52.55 54.30 3a9t s ASP 21 Cb 0.04 -2.55 1.62 0.00 -1.46 0.00 0.00 42.92 40.58 3a9t s ASP 21 CO 0.11 -0.65 2.02 1.23 0.52 0.00 0.00 175.17 178.40 3a9t h GLY 22 N 9.08 0.00 -5.96 2.66 0.00 -1.86 -3.37 103.07 103.63 3a9t h GLY 22 Ca -0.26 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.51 3a9t h GLY 22 CO 0.94 0.00 1.30 0.50 0.00 0.00 0.00 176.54 179.28 3a9t s ARG 23 N -3.75 3.77 0.00 4.80 0.52 -1.26 -4.88 118.95 118.15 3a9t s ARG 23 Ca -0.01 2.30 0.00 0.00 -0.52 0.00 0.00 55.73 57.50 3a9t s ARG 23 Cb 0.10 -4.21 0.00 0.00 0.52 0.00 0.00 34.95 31.36 3a9t s ARG 23 CO 0.43 -1.37 0.00 0.54 0.02 0.00 0.00 175.30 174.92 3a9t n ARG 24 N 7.94 2.53 -1.06 3.54 1.74 -1.26 -1.10 116.66 128.99 3a9t n ARG 24 Ca 0.23 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.29 3a9t n ARG 24 Cb 0.43 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.86 3a9t n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3a9t n LYS 25 N 0.00 -0.90 0.00 5.56 4.76 -1.26 -3.95 118.16 122.37 3a9t n LYS 25 Ca 0.00 0.37 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 3a9t n LYS 25 Cb 0.00 -4.13 0.00 0.00 -1.84 0.00 0.00 35.03 29.06 3a9t n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a9t n GLY 26 N -1.24 2.74 0.19 0.72 0.00 -1.26 -5.04 105.19 101.30 3a9t n GLY 26 Ca -0.02 -0.37 -0.07 0.00 0.00 0.00 0.00 46.02 45.56 3a9t n GLY 26 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3a9t h VAL 27 N 0.00 0.00 -0.76 1.61 2.07 -1.68 -3.17 116.25 114.31 3a9t h VAL 27 Ca 0.00 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3a9t h VAL 27 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 3a9t h VAL 27 CO 0.00 0.00 0.48 -0.09 0.02 0.00 0.00 177.57 177.98 3a9t h ARG 28 N -0.52 0.88 -0.58 1.57 2.43 -1.27 -2.29 114.38 114.60 3a9t h ARG 28 Ca -0.05 -0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.22 3a9t h ARG 28 Cb 0.36 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3a9t h ARG 28 CO 0.08 0.59 0.41 0.93 -1.51 0.00 0.00 179.97 180.46 3a9t h GLU 29 N 0.91 0.07 -0.02 0.20 3.07 -1.83 -0.10 114.58 116.89 3a9t h GLU 29 Ca 0.32 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 3a9t h GLU 29 Cb 0.07 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3a9t h GLU 29 CO -0.13 0.05 -0.05 -1.13 -1.40 0.00 0.00 179.01 176.35 3a9t n SER 30 N -4.39 1.81 -0.01 1.42 3.41 -0.87 -4.33 113.62 110.66 3a9t n SER 30 Ca 0.11 -1.54 0.01 0.00 -0.26 0.00 0.00 58.87 57.18 3a9t n SER 30 Cb 0.60 0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.58 3a9t n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3a9t n LEU 31 N 0.34 0.19 -0.01 1.04 4.77 -0.08 -4.76 117.00 118.48 3a9t n LEU 31 Ca 0.17 -0.54 -0.10 0.00 -0.03 0.00 0.00 56.01 55.51 3a9t n LEU 31 Cb 0.42 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.46 3a9t n LEU 31 CO 0.18 0.05 0.87 -0.33 -1.33 0.00 0.00 177.39 176.83 3a9t h GLU 32 N 0.04 0.06 -0.05 3.23 5.08 -1.65 -1.08 114.58 120.20 3a9t h GLU 32 Ca 0.00 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 32 Cb 0.06 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3a9t h GLU 32 CO 0.00 0.04 -0.03 1.49 -1.00 0.00 0.00 179.01 179.51 3a9t h GLU 33 N 0.06 -0.03 -0.73 2.33 4.81 -1.87 -0.67 114.58 118.49 3a9t h GLU 33 Ca 0.06 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3a9t h GLU 33 Cb 0.06 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.41 3a9t h GLU 33 CO -0.08 -0.02 0.48 1.15 -0.73 0.00 0.00 179.01 179.81 3a9t h THR 34 N -0.03 1.18 0.16 0.32 2.02 -1.84 -0.84 112.91 113.89 3a9t h THR 34 Ca 0.03 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 3a9t h THR 34 Cb 0.07 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 3a9t h THR 34 CO -0.07 0.18 -0.08 0.74 0.37 0.00 0.00 175.52 176.66 3a9t h THR 35 N 0.98 0.95 -0.92 3.16 2.02 -0.93 -2.22 112.91 115.95 3a9t h THR 35 Ca 0.27 -0.50 0.11 0.00 0.77 0.00 0.00 66.41 67.07 3a9t h THR 35 Cb -0.10 1.25 -0.07 0.00 -1.74 0.00 0.00 68.15 67.49 3a9t h THR 35 CO -0.06 0.12 0.59 0.24 0.37 0.00 0.00 175.52 176.77 3a9t h MET 36 N -0.45 0.83 -0.29 6.66 2.07 -1.02 -0.33 114.93 122.40 3a9t h MET 36 Ca -0.02 -0.05 -0.03 0.00 -2.07 0.00 0.00 59.70 57.52 3a9t h MET 36 Cb 0.36 -0.19 -0.02 0.00 -1.87 0.00 0.00 31.60 29.88 3a9t h MET 36 CO 0.04 0.55 0.03 -0.91 1.07 0.00 0.00 176.91 177.68 3a9t h ASN 37 N 0.86 0.39 -0.19 1.22 -0.26 -0.85 0.13 115.58 116.88 3a9t h ASN 37 Ca 0.44 -0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 56.10 3a9t h ASN 37 Cb 0.51 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 3a9t h ASN 37 CO -0.20 0.44 0.01 0.24 -1.06 0.00 0.00 177.43 176.85 3a9t h MET 38 N 0.42 0.33 -0.22 0.81 2.86 -0.46 0.73 114.93 119.40 3a9t h MET 38 Ca 0.10 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 3a9t h MET 38 Cb 0.24 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 3a9t h MET 38 CO 0.00 0.52 0.06 0.00 1.06 0.00 0.00 176.91 178.55 3a9t h ALA 39 N 0.79 0.23 -0.88 6.32 0.00 -0.84 0.67 119.26 125.56 3a9t h ALA 39 Ca 0.05 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3a9t h ALA 39 Cb 0.37 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 3a9t h ALA 39 CO 0.01 -0.37 0.57 0.87 0.00 0.00 0.00 179.25 180.33 3a9t h LYS 40 N 0.15 1.17 -0.68 0.00 1.57 -0.64 -0.74 116.57 117.39 3a9t h LYS 40 Ca 0.10 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3a9t h LYS 40 Cb 0.08 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 3a9t h LYS 40 CO -0.11 0.78 0.22 0.00 -0.57 0.00 0.00 179.45 179.77 3a9t h ALA 41 N 1.31 0.89 -0.44 3.86 0.00 -0.11 -1.04 119.26 123.74 3a9t h ALA 41 Ca 0.32 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3a9t h ALA 41 Cb -0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 3a9t h ALA 41 CO -0.07 0.56 -0.21 0.28 0.00 0.00 0.00 179.25 179.81 3a9t h VAL 42 N 1.00 1.27 -0.27 0.00 2.07 -0.46 -0.97 116.25 118.89 3a9t h VAL 42 Ca 0.22 -1.35 -0.04 0.00 0.82 0.00 0.00 66.70 66.35 3a9t h VAL 42 Cb 0.28 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3a9t h VAL 42 CO -0.01 0.46 0.01 0.00 0.02 0.00 0.00 177.57 178.05 3a9t h ALA 43 N 0.98 0.36 -0.78 1.67 0.00 -0.92 -1.65 119.26 118.92 3a9t h ALA 43 Ca 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3a9t h ALA 43 Cb 0.76 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 3a9t h ALA 43 CO 0.06 0.09 0.48 -0.22 0.00 0.00 0.00 179.25 179.66 3a9t h LYS 44 N 0.25 1.06 0.01 0.00 3.64 -1.11 -0.86 116.57 119.57 3a9t h LYS 44 Ca 0.08 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3a9t h LYS 44 Cb 0.41 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3a9t h LYS 44 CO 0.01 0.74 -0.01 1.25 -2.27 0.00 0.00 179.45 179.18 3a9t h LEU 45 N 1.07 -0.02 -0.71 5.20 5.85 -1.01 -2.89 115.31 122.79 3a9t h LEU 45 Ca 0.28 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 3a9t h LEU 45 Cb -0.05 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3a9t h LEU 45 CO -0.05 0.01 0.23 -0.07 -0.34 0.00 0.00 178.44 178.22 3a9t h LEU 46 N -0.04 1.03 -1.94 2.25 3.38 -1.05 -2.70 115.31 116.25 3a9t h LEU 46 Ca -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3a9t h LEU 46 Cb 0.04 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 3a9t h LEU 46 CO 0.00 0.96 -0.06 -0.33 0.09 0.00 0.00 178.44 179.11 3a9t h GLU 47 N 1.05 0.00 0.00 1.13 5.08 -1.11 0.63 114.58 121.35 3a9t h GLU 47 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3a9t h GLU 47 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3a9t h GLU 47 CO -0.01 0.06 -0.83 0.39 -1.00 0.00 0.00 179.01 177.62 3a9t n GLU 48 N -3.29 0.07 0.00 2.33 1.02 -1.06 -4.56 120.64 115.16 3a9t n GLU 48 Ca -0.01 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 3a9t n GLU 48 Cb 0.24 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 3a9t n GLU 48 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3a9t n ASN 49 N -1.62 4.01 -4.34 1.62 3.02 -0.89 -5.04 115.26 112.04 3a9t n ASN 49 Ca 0.04 -0.03 -0.33 0.00 -0.03 0.00 0.00 54.58 54.23 3a9t n ASN 49 Cb 0.36 0.86 -0.15 0.00 -0.61 0.00 0.00 39.78 40.24 3a9t n ASN 49 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3a9t s VAL 50 N -1.67 2.76 0.01 2.41 1.01 0.16 -5.08 120.40 120.01 3a9t s VAL 50 Ca 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.23 3a9t s VAL 50 Cb 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 3a9t s VAL 50 CO 0.00 0.54 -0.10 -0.36 0.00 0.00 0.00 175.10 175.19 3a9t s PHE 51 N 0.22 0.85 1.08 5.22 0.40 -1.26 -1.42 117.98 123.06 3a9t s PHE 51 Ca -0.11 -0.24 -0.12 0.00 -0.60 0.00 0.00 56.93 55.86 3a9t s PHE 51 Cb -0.16 -0.53 0.24 0.00 0.51 0.00 0.00 43.02 43.08 3a9t s PHE 51 CO 0.06 -0.01 1.06 0.71 0.70 0.00 0.00 175.22 177.74 3a9t s TYR 52 N -0.50 1.68 -1.76 0.36 4.12 0.64 -4.84 117.35 117.05 3a9t s TYR 52 Ca 0.01 1.15 0.09 0.00 0.02 0.00 0.00 57.07 58.34 3a9t s TYR 52 Cb -0.05 -3.17 0.53 0.00 -1.52 0.00 0.00 41.96 37.74 3a9t s TYR 52 CO 0.00 -3.40 1.08 2.48 0.02 0.00 0.00 175.55 175.73 3a9t n TYR 53 N -4.57 0.00 -0.13 2.71 4.11 -1.26 -1.61 117.16 116.41 3a9t n TYR 53 Ca 0.04 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 58.02 3a9t n TYR 53 Cb 0.55 -0.12 0.19 0.00 -0.00 0.00 0.00 39.34 39.96 3a9t n TYR 53 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 3a9t n ASN 54 N -1.12 3.12 0.00 9.48 6.94 -1.26 -4.84 115.26 127.58 3a9t n ASN 54 Ca 0.06 -1.95 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 3a9t n ASN 54 Cb 0.05 -0.27 0.00 0.00 -2.36 0.00 0.00 39.78 37.20 3a9t n ASN 54 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a9t n GLY 55 N 0.86 1.94 3.74 4.83 0.00 -0.63 -4.98 105.19 110.94 3a9t n GLY 55 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3a9t n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a9t s GLN 56 N -0.51 4.49 0.42 1.61 -0.21 -1.26 -4.75 119.66 119.45 3a9t s GLN 56 Ca 0.00 1.88 -0.26 0.00 0.02 0.00 0.00 55.36 57.00 3a9t s GLN 56 Cb 0.00 -3.24 -0.09 0.00 1.00 0.00 0.00 33.01 30.69 3a9t s GLN 56 CO 0.00 -0.09 1.34 -1.25 -2.12 0.00 0.00 175.29 173.17 3a9t s PRO 57 N -0.23 3.87 0.42 2.91 0.04 -1.26 -0.26 135.00 140.49 3a9t s PRO 57 Ca 0.53 2.23 -0.26 0.00 0.04 0.00 0.00 61.00 63.54 3a9t s PRO 57 Cb -0.33 -2.72 -0.10 0.00 0.04 0.00 0.00 34.50 31.40 3a9t s PRO 57 CO 0.37 -0.60 1.38 1.55 0.04 0.00 0.00 177.00 179.74 3a9t n VAL 58 N 0.01 2.53 -3.71 -0.36 3.14 -0.51 -4.75 118.33 114.68 3a9t n VAL 58 Ca 0.04 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.57 3a9t n VAL 58 Cb 0.43 -1.75 -0.08 0.00 -1.06 0.00 0.00 33.84 31.37 3a9t n VAL 58 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3a9t s GLU 59 N -2.27 4.17 0.22 1.45 2.02 -1.26 -4.53 118.70 118.49 3a9t s GLU 59 Ca 0.59 -0.22 0.06 0.00 0.02 0.00 0.00 54.97 55.42 3a9t s GLU 59 Cb -0.48 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.27 3a9t s GLU 59 CO 0.59 0.24 0.20 0.00 0.02 0.00 0.00 175.26 176.32 3a9t s VAL 61 N -1.98 0.57 -0.02 0.00 1.01 0.15 -4.92 120.40 115.22 3a9t s VAL 61 Ca 0.33 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.22 3a9t s VAL 61 Cb -0.09 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 3a9t s VAL 61 CO 0.25 0.25 0.01 -0.63 0.00 0.00 0.00 175.10 174.99 3a9t s ILE 62 N 1.24 4.26 0.56 2.22 1.01 -1.26 -0.12 121.20 129.11 3a9t s ILE 62 Ca -0.06 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 59.88 3a9t s ILE 62 Cb -0.14 -2.89 -0.06 0.00 0.01 0.00 0.00 42.46 39.39 3a9t s ILE 62 CO -0.02 0.42 1.07 0.00 0.00 0.00 0.00 174.94 176.41 3a9t n ALA 63 N 1.51 0.54 0.28 9.38 0.00 -0.91 -4.87 120.51 126.43 3a9t n ALA 63 Ca -0.15 0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.51 3a9t n ALA 63 Cb 0.53 -2.17 0.80 0.00 0.00 0.00 0.00 19.45 18.60 3a9t n ALA 63 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3a9t h ASP 64 N 0.89 0.00 -5.52 0.00 3.32 -1.93 -3.45 116.42 109.73 3a9t h ASP 64 Ca -0.48 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.35 3a9t h ASP 64 Cb 1.34 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.77 3a9t h ASP 64 CO 0.53 0.08 -0.42 0.42 -1.72 0.00 0.00 179.24 178.14 3a9t s THR 65 N -4.17 0.00 0.71 0.35 -4.23 -1.26 -5.15 115.64 101.89 3a9t s THR 65 Ca -0.03 -1.79 -0.12 0.00 -1.18 0.00 0.00 61.69 58.57 3a9t s THR 65 Cb 0.13 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.55 3a9t s THR 65 CO 0.56 0.00 1.08 0.00 -0.54 0.00 0.00 174.62 175.72 3a9t s ILE 67 N -2.80 3.48 -0.60 0.00 1.01 0.20 -4.90 121.20 117.58 3a9t s ILE 67 Ca 0.61 -1.64 0.05 0.00 0.00 0.00 0.00 60.65 59.67 3a9t s ILE 67 Cb -0.16 -3.18 0.06 0.00 0.01 0.00 0.00 42.46 39.18 3a9t s ILE 67 CO 0.51 -0.45 0.74 0.61 0.00 0.00 0.00 174.94 176.35 3a9t n GLY 68 N 4.70 -0.33 1.91 6.18 0.00 -1.26 -0.72 105.19 115.67 3a9t n GLY 68 Ca -0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 46.02 45.75 3a9t n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9t n GLY 69 N 0.23 1.46 0.23 -0.02 0.00 -1.26 -4.04 105.19 101.79 3a9t n GLY 69 Ca 0.03 -1.13 -0.08 0.00 0.00 0.00 0.00 46.02 44.84 3a9t n GLY 69 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3a9t h VAL 70 N 1.50 1.30 0.18 1.61 3.04 -1.75 -2.25 116.25 119.89 3a9t h VAL 70 Ca -0.17 -1.62 -0.01 0.00 -1.01 0.00 0.00 66.70 63.89 3a9t h VAL 70 Cb 0.63 1.59 -0.00 0.00 -2.01 0.00 0.00 31.29 31.49 3a9t h VAL 70 CO 0.22 0.51 -0.10 0.50 -1.01 0.00 0.00 177.57 177.69 3a9t h LYS 71 N 0.49 -0.25 -0.15 4.17 1.63 -1.97 0.22 116.57 120.71 3a9t h LYS 71 Ca 0.03 0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.79 3a9t h LYS 71 Cb 0.96 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.63 3a9t h LYS 71 CO 0.09 -0.16 -0.16 0.93 -3.45 0.00 0.00 179.45 176.69 3a9t h GLU 72 N -0.26 0.25 -0.43 1.90 5.08 -1.91 -0.99 114.58 118.23 3a9t h GLU 72 Ca -0.02 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 3a9t h GLU 72 Cb 0.20 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3a9t h GLU 72 CO 0.03 0.42 -0.05 0.00 -1.00 0.00 0.00 179.01 178.41 3a9t h ALA 73 N 1.60 0.59 -0.70 3.43 0.00 -0.84 -1.21 119.26 122.13 3a9t h ALA 73 Ca 0.05 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3a9t h ALA 73 Cb 0.43 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3a9t h ALA 73 CO 0.03 0.43 0.20 0.00 0.00 0.00 0.00 179.25 179.91 3a9t h ALA 74 N 0.88 0.92 -0.68 0.00 0.00 -0.11 -1.19 119.26 119.08 3a9t h ALA 74 Ca 0.12 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3a9t h ALA 74 Cb 0.57 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 3a9t h ALA 74 CO 0.03 0.61 0.41 0.93 0.00 0.00 0.00 179.25 181.23 3a9t h GLU 75 N 1.03 0.77 -0.12 0.00 4.39 -0.93 -0.40 114.58 119.32 3a9t h GLU 75 Ca 0.22 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 3a9t h GLU 75 Cb 0.32 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 3a9t h GLU 75 CO -0.00 0.51 0.04 0.00 -1.16 0.00 0.00 179.01 178.39 3a9t h ALA 76 N 1.31 0.16 -0.39 3.43 0.00 -0.79 -1.76 119.26 121.22 3a9t h ALA 76 Ca 0.29 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.15 3a9t h ALA 76 Cb 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 3a9t h ALA 76 CO -0.13 -0.24 0.06 0.00 0.00 0.00 0.00 179.25 178.94 3a9t h ALA 77 N 0.86 0.41 -0.29 0.00 0.00 -0.76 -0.19 119.26 119.29 3a9t h ALA 77 Ca 0.04 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.09 3a9t h ALA 77 Cb 0.20 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 3a9t h ALA 77 CO -0.00 -0.34 -0.00 1.49 0.00 0.00 0.00 179.25 180.39 3a9t h GLU 78 N 0.18 0.08 -0.14 0.00 4.57 -0.90 -0.71 114.58 117.65 3a9t h GLU 78 Ca 0.19 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.36 3a9t h GLU 78 Cb 0.24 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 3a9t h GLU 78 CO -0.27 0.05 0.05 -0.22 -1.18 0.00 0.00 179.01 177.44 3a9t h LYS 79 N 0.08 0.22 -0.80 1.92 3.64 -0.80 -2.46 116.57 118.37 3a9t h LYS 79 Ca 0.14 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 3a9t h LYS 79 Cb 0.18 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 3a9t h LYS 79 CO -0.23 0.34 0.51 0.74 -2.27 0.00 0.00 179.45 178.53 3a9t h PHE 80 N 0.06 0.95 -0.77 1.91 0.05 -0.85 0.69 116.94 118.98 3a9t h PHE 80 Ca 0.05 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.85 3a9t h PHE 80 Cb 0.21 -0.32 -0.04 0.00 2.00 0.00 0.00 35.95 37.81 3a9t h PHE 80 CO -0.00 0.55 0.44 0.00 -0.18 0.00 0.00 178.31 179.11 3a9t h ALA 81 N 1.34 0.98 0.00 2.45 0.00 -1.01 -0.67 119.26 122.34 3a9t h ALA 81 Ca 0.32 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3a9t h ALA 81 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3a9t h ALA 81 CO -0.12 0.47 -0.28 0.00 0.00 0.00 0.00 179.25 179.32 3a9t h ARG 82 N 1.05 0.00 -0.12 0.00 2.47 -0.91 -2.94 114.38 113.93 3a9t h ARG 82 Ca 0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.99 3a9t h ARG 82 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3a9t h ARG 82 CO -0.05 0.28 0.00 0.39 0.56 0.00 0.00 179.97 181.16 3a9t n GLU 83 N -3.27 1.71 -3.16 0.04 -0.58 0.18 -4.95 120.64 110.62 3a9t n GLU 83 Ca 0.01 -1.06 -0.15 0.00 -0.42 0.00 0.00 57.16 55.55 3a9t n GLU 83 Cb 0.56 -1.42 0.05 0.00 -0.57 0.00 0.00 31.44 30.06 3a9t n GLU 83 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3a9t n GLY 84 N 1.15 -0.04 3.76 0.62 0.00 -0.63 -4.78 105.19 105.27 3a9t n GLY 84 Ca 0.17 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3a9t n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a9t s VAL 85 N -3.21 4.21 0.00 1.61 1.01 -0.35 -2.33 120.40 121.34 3a9t s VAL 85 Ca 0.30 1.94 0.00 0.00 0.00 0.00 0.00 61.98 64.22 3a9t s VAL 85 Cb -0.13 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.99 3a9t s VAL 85 CO 0.48 0.50 0.48 0.61 0.00 0.00 0.00 175.10 177.16 3a9t n GLY 86 N 1.58 -0.10 3.21 4.51 0.00 -0.05 -4.82 105.19 109.53 3a9t n GLY 86 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 3a9t n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a9t s VAL 87 N -0.22 -0.02 0.03 1.61 1.01 -1.19 -3.91 120.40 117.71 3a9t s VAL 87 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.12 3a9t s VAL 87 Cb 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 3a9t s VAL 87 CO 0.00 0.03 -0.18 -0.94 0.00 0.00 0.00 175.10 174.01 3a9t s SER 88 N 0.99 2.14 -0.09 3.32 1.04 -0.46 -0.05 113.70 120.58 3a9t s SER 88 Ca -0.07 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 55.91 3a9t s SER 88 Cb -0.07 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.89 3a9t s SER 88 CO -0.08 0.13 -0.08 -0.63 0.98 0.00 0.00 173.24 173.57 3a9t s ILE 89 N -0.74 0.96 -0.10 -1.02 1.01 0.09 -1.40 121.20 120.00 3a9t s ILE 89 Ca 0.05 -0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.33 3a9t s ILE 89 Cb -0.08 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 3a9t s ILE 89 CO 0.01 0.34 0.20 -0.89 0.00 0.00 0.00 174.94 174.60 3a9t s THR 90 N 1.39 5.40 0.03 2.92 2.01 0.47 -0.58 115.64 127.28 3a9t s THR 90 Ca -0.01 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.37 3a9t s THR 90 Cb -0.13 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 3a9t s THR 90 CO -0.04 0.60 -0.11 0.68 -0.69 0.00 0.00 174.62 175.06 3a9t s VAL 91 N -0.96 0.81 -0.18 3.82 -7.23 0.28 0.18 120.40 117.12 3a9t s VAL 91 Ca 0.17 -0.91 -0.29 0.00 -1.81 0.00 0.00 61.98 59.14 3a9t s VAL 91 Cb -0.13 -0.77 0.12 0.00 0.56 0.00 0.00 36.38 36.16 3a9t s VAL 91 CO 0.06 -0.11 0.99 0.28 -0.31 0.00 0.00 175.10 176.01 3a9t s THR 92 N -0.91 0.00 -1.62 5.32 -1.32 -0.98 -1.35 115.64 114.78 3a9t s THR 92 Ca -0.02 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 60.59 3a9t s THR 92 Cb -0.08 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.02 3a9t s THR 92 CO 0.01 0.00 0.91 -0.81 -2.21 0.00 0.00 174.62 172.52 3a9t n PRO 93 N 1.00 0.82 -2.57 7.08 -0.04 -1.26 -0.50 135.00 139.53 3a9t n PRO 93 Ca -0.11 -1.28 -0.05 0.00 -0.04 0.00 0.00 63.50 62.02 3a9t n PRO 93 Cb 0.57 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.77 3a9t n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3a9t s TRP 95 N -2.63 3.70 0.18 0.00 -0.11 -1.25 -3.89 118.94 114.95 3a9t s TRP 95 Ca 0.11 1.63 -0.01 0.00 1.22 0.00 0.00 56.10 59.05 3a9t s TRP 95 Cb 0.00 -2.80 -0.04 0.00 -1.50 0.00 0.00 33.47 29.13 3a9t s TRP 95 CO 0.08 0.29 0.09 0.00 -4.62 0.00 0.00 176.95 172.79 3a9t n TYR 97 N -0.22 3.97 0.00 0.00 4.01 -1.26 -4.91 117.16 118.74 3a9t n TYR 97 Ca -0.01 -3.04 0.00 0.00 -0.16 0.00 0.00 57.90 54.69 3a9t n TYR 97 Cb 0.65 -2.17 0.00 0.00 -0.31 0.00 0.00 39.34 37.51 3a9t n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a9t n GLY 98 N 3.69 0.00 0.53 2.72 0.00 -1.26 -0.06 105.19 110.81 3a9t n GLY 98 Ca 0.41 0.00 0.34 0.00 0.00 0.00 0.00 46.02 46.77 3a9t n GLY 98 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3a9t h THR 99 N 0.00 0.35 0.00 2.61 1.35 -1.93 0.88 112.91 116.17 3a9t h THR 99 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.84 3a9t h THR 99 Cb 0.00 0.38 -0.00 0.00 -1.73 0.00 0.00 68.15 66.80 3a9t h THR 99 CO 0.00 0.00 -0.10 -0.33 -0.25 0.00 0.00 175.52 174.84 3a9t h GLU 100 N 0.00 0.00 -0.01 4.72 5.08 -0.85 -2.97 114.58 120.55 3a9t h GLU 100 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 3a9t h GLU 100 Cb 2.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.52 3a9t h GLU 100 CO -0.01 0.10 -0.15 0.25 -1.00 0.00 0.00 179.01 178.20 3a9t n THR 101 N -3.51 0.00 -1.70 1.13 -2.24 0.29 -1.89 114.28 106.35 3a9t n THR 101 Ca -0.02 -0.42 -0.37 0.00 -2.27 0.00 0.00 64.05 60.97 3a9t n THR 101 Cb 0.24 1.19 0.07 0.00 -2.10 0.00 0.00 70.33 69.73 3a9t n THR 101 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3a9t s MET 102 N -1.36 2.50 -0.44 -0.78 -1.94 -1.11 -4.95 119.30 111.22 3a9t s MET 102 Ca 0.12 2.02 -0.19 0.00 -1.71 0.00 0.00 55.69 55.93 3a9t s MET 102 Cb 0.10 -1.84 0.03 0.00 2.01 0.00 0.00 34.83 35.12 3a9t s MET 102 CO 0.25 -1.63 0.57 0.34 -0.01 0.00 0.00 175.02 174.54 3a9t s ASP 103 N -1.48 6.27 0.00 3.03 -1.08 -1.26 -4.93 116.67 117.22 3a9t s ASP 103 Ca 0.81 -0.51 0.24 0.00 -0.52 0.00 0.00 52.55 52.58 3a9t s ASP 103 Cb -0.36 -2.28 0.97 0.00 -1.46 0.00 0.00 42.92 39.78 3a9t s ASP 103 CO 0.40 -0.72 1.68 0.23 0.52 0.00 0.00 175.17 177.28 3a9t n MET 104 N 6.03 1.61 -2.08 4.34 2.81 -1.26 -4.88 117.12 123.68 3a9t n MET 104 Ca -0.04 -0.90 -0.43 0.00 -1.81 0.00 0.00 57.70 54.52 3a9t n MET 104 Cb 0.47 -1.43 -0.03 0.00 -0.71 0.00 0.00 33.22 31.53 3a9t n MET 104 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3a9t s ASP 105 N -1.77 6.62 0.39 7.83 -1.08 -1.26 -4.89 116.67 122.52 3a9t s ASP 105 Ca 0.35 2.01 0.21 0.00 -0.52 0.00 0.00 52.55 54.61 3a9t s ASP 105 Cb 0.19 -2.53 0.42 0.00 -1.46 0.00 0.00 42.92 39.54 3a9t s ASP 105 CO 0.30 -0.99 1.62 -0.65 0.52 0.00 0.00 175.17 175.96 3a9t h PRO 106 N 9.70 0.00 -0.99 4.34 0.11 -2.00 -3.33 132.00 139.83 3a9t h PRO 106 Ca -0.36 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.32 3a9t h PRO 106 Cb 1.16 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.01 3a9t h PRO 106 CO 0.97 0.21 0.55 0.72 -0.21 0.00 0.00 178.00 180.23 3a9t n HIS 107 N -3.19 2.63 -3.70 0.65 8.25 -1.26 -4.88 115.22 113.72 3a9t n HIS 107 Ca 0.02 -1.63 -0.18 0.00 -0.26 0.00 0.00 57.72 55.68 3a9t n HIS 107 Cb 0.57 -0.84 -0.17 0.00 1.12 0.00 0.00 29.99 30.67 3a9t n HIS 107 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 3a9t s ILE 108 N -2.84 -0.10 0.16 1.59 2.07 -1.25 -5.01 121.20 115.81 3a9t s ILE 108 Ca 0.49 0.35 -0.33 0.00 -1.41 0.00 0.00 60.65 59.76 3a9t s ILE 108 Cb 0.41 -0.14 -0.12 0.00 0.13 0.00 0.00 42.46 42.73 3a9t s ILE 108 CO 0.10 0.15 1.70 -2.65 -1.91 0.00 0.00 174.94 172.32 3a9t n PRO 109 N 4.92 2.51 -4.31 3.50 -0.02 -1.25 -4.79 135.00 135.56 3a9t n PRO 109 Ca -0.12 0.91 -0.18 0.00 -2.02 0.00 0.00 63.50 62.09 3a9t n PRO 109 Cb 0.50 -2.73 -0.13 0.00 -0.02 0.00 0.00 33.50 31.11 3a9t n PRO 109 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 3a9t s LYS 110 N 1.51 0.80 0.08 -0.52 -2.85 -1.26 -1.35 119.74 116.14 3a9t s LYS 110 Ca 0.79 -0.61 0.03 0.00 -1.00 0.00 0.00 55.97 55.17 3a9t s LYS 110 Cb -0.58 -0.76 -0.03 0.00 -2.06 0.00 0.00 37.83 34.40 3a9t s LYS 110 CO 0.36 0.19 -0.09 0.00 0.10 0.00 0.00 175.35 175.91 3a9t s ALA 111 N -0.72 0.91 -0.08 0.59 0.00 -0.49 -0.72 121.76 121.24 3a9t s ALA 111 Ca 0.00 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 50.91 3a9t s ALA 111 Cb -0.07 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3a9t s ALA 111 CO 0.01 -0.05 -0.08 0.08 0.00 0.00 0.00 175.76 175.71 3a9t s VAL 112 N -2.22 0.95 -0.28 0.00 1.01 0.20 -0.40 120.40 119.65 3a9t s VAL 112 Ca 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 3a9t s VAL 112 Cb -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.43 3a9t s VAL 112 CO -0.01 0.34 0.01 0.86 0.00 0.00 0.00 175.10 176.30 3a9t s TRP 113 N 1.27 3.14 -0.21 5.22 -0.00 0.13 -1.10 118.94 127.39 3a9t s TRP 113 Ca -0.04 -1.40 -0.11 0.00 -0.00 0.00 0.00 56.10 54.55 3a9t s TRP 113 Cb -0.14 -2.15 -0.05 0.00 -0.00 0.00 0.00 33.47 31.13 3a9t s TRP 113 CO -0.03 -0.69 0.17 0.20 -0.00 0.00 0.00 176.95 176.60 3a9t s GLY 114 N 1.38 2.04 0.30 5.86 0.00 -1.06 -2.32 107.32 113.52 3a9t s GLY 114 Ca -0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 44.72 43.69 3a9t s GLY 114 CO -0.01 0.30 1.47 -0.12 0.00 0.00 0.00 173.10 174.73 3a9t s PHE 115 N 0.68 2.86 -1.20 1.90 5.36 0.35 -4.47 117.98 123.46 3a9t s PHE 115 Ca 0.09 1.06 -0.09 0.00 -0.96 0.00 0.00 56.93 57.04 3a9t s PHE 115 Cb -0.12 -3.90 0.22 0.00 -0.34 0.00 0.00 43.02 38.87 3a9t s PHE 115 CO 0.01 -2.83 1.63 -1.71 -1.46 0.00 0.00 175.22 170.87 3a9t n ASN 116 N 1.61 5.51 -4.49 6.13 2.85 -1.26 -3.70 115.26 121.90 3a9t n ASN 116 Ca 0.05 -3.16 -0.25 0.00 -0.11 0.00 0.00 54.58 51.11 3a9t n ASN 116 Cb 0.40 -1.43 -0.10 0.00 1.24 0.00 0.00 39.78 39.89 3a9t n ASN 116 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 3a9t s GLY 117 N 0.51 1.81 -0.07 8.20 0.00 -1.26 -0.60 107.32 115.90 3a9t s GLY 117 Ca 0.37 -1.77 0.05 0.00 0.00 0.00 0.00 44.72 43.37 3a9t s GLY 117 CO 0.02 -1.84 0.54 -1.30 0.00 0.00 0.00 173.10 170.53 3a9t n THR 118 N -0.44 1.68 -0.22 0.90 -2.24 -1.26 -4.44 114.28 108.25 3a9t n THR 118 Ca -0.07 -0.74 0.03 0.00 -2.27 0.00 0.00 64.05 60.99 3a9t n THR 118 Cb 0.59 -1.30 0.14 0.00 -2.10 0.00 0.00 70.33 67.65 3a9t n THR 118 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3a9t h GLU 119 N 0.03 0.25 -5.83 -0.78 3.07 -1.93 -3.44 114.58 105.94 3a9t h GLU 119 Ca -0.34 -0.01 -0.56 0.00 -0.50 0.00 0.00 59.36 57.95 3a9t h GLU 119 Cb 2.03 -0.06 -0.14 0.00 -0.84 0.00 0.00 28.75 29.74 3a9t h GLU 119 CO 0.08 0.16 -0.71 1.03 -1.40 0.00 0.00 179.01 178.18 3a9t s ARG 120 N -6.09 1.63 0.00 2.33 1.81 -1.26 -5.05 118.95 112.33 3a9t s ARG 120 Ca -0.13 -1.80 -0.03 0.00 -1.72 0.00 0.00 55.73 52.05 3a9t s ARG 120 Cb 0.19 -1.48 -0.15 0.00 -0.45 0.00 0.00 34.95 33.06 3a9t s ARG 120 CO 0.75 0.17 2.69 -2.30 -0.68 0.00 0.00 175.30 175.92 3a9t n PRO 121 N -0.63 1.43 -0.06 3.54 -0.02 -1.26 -4.63 135.00 133.36 3a9t n PRO 121 Ca -0.06 -0.54 -0.07 0.00 -2.02 0.00 0.00 63.50 60.80 3a9t n PRO 121 Cb 0.62 -1.60 -0.02 0.00 -0.02 0.00 0.00 33.50 32.48 3a9t n PRO 121 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3a9t h GLY 122 N 4.36 0.17 2.00 -1.23 0.00 -1.67 -0.59 103.07 106.11 3a9t h GLY 122 Ca 0.10 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 3a9t h GLY 122 CO 0.16 -0.10 -0.12 0.00 0.00 0.00 0.00 176.54 176.48 3a9t h ALA 123 N 1.24 1.16 -0.05 3.60 0.00 -1.82 -1.99 119.26 121.40 3a9t h ALA 123 Ca 0.12 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 3a9t h ALA 123 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3a9t h ALA 123 CO -0.26 0.15 -0.77 0.28 0.00 0.00 0.00 179.25 178.64 3a9t h VAL 124 N 0.00 1.41 -0.31 0.00 2.07 -1.52 -2.69 116.25 115.21 3a9t h VAL 124 Ca -0.00 -2.26 -0.15 0.00 0.82 0.00 0.00 66.70 65.11 3a9t h VAL 124 Cb 0.42 2.21 -0.00 0.00 -1.52 0.00 0.00 31.29 32.40 3a9t h VAL 124 CO 0.02 0.67 -0.38 0.22 0.02 0.00 0.00 177.57 178.12 3a9t h TYR 125 N 0.22 0.97 0.10 1.57 3.20 -0.49 -1.85 116.97 120.69 3a9t h TYR 125 Ca -0.04 -0.31 0.02 0.00 3.14 0.00 0.00 58.73 61.54 3a9t h TYR 125 Cb 1.36 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 39.38 3a9t h TYR 125 CO 0.04 1.10 -0.47 1.25 -1.64 0.00 0.00 178.16 178.44 3a9t h LEU 126 N 0.56 -1.41 -0.86 2.82 5.85 -1.33 0.11 115.31 121.05 3a9t h LEU 126 Ca 0.04 0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 3a9t h LEU 126 Cb 0.97 0.53 -0.03 0.00 0.37 0.00 0.00 40.66 42.49 3a9t h LEU 126 CO 0.09 -0.52 0.24 0.00 -0.34 0.00 0.00 178.44 177.91 3a9t h ALA 127 N -0.31 1.08 -0.50 1.25 0.00 -1.52 -1.22 119.26 118.04 3a9t h ALA 127 Ca 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3a9t h ALA 127 Cb 0.72 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3a9t h ALA 127 CO -0.28 0.63 0.19 0.00 0.00 0.00 0.00 179.25 179.79 3a9t h ALA 128 N 1.21 0.65 0.00 0.00 0.00 -0.88 -1.52 119.26 118.73 3a9t h ALA 128 Ca 0.23 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 3a9t h ALA 128 Cb 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3a9t h ALA 128 CO -0.01 0.27 -0.93 -0.24 0.00 0.00 0.00 179.25 178.34 3a9t h VAL 129 N 0.67 1.66 -0.54 0.00 3.04 -0.71 -2.72 116.25 117.64 3a9t h VAL 129 Ca 0.17 -3.16 -0.12 0.00 -1.01 0.00 0.00 66.70 62.58 3a9t h VAL 129 Cb 0.22 2.71 -0.02 0.00 -2.01 0.00 0.00 31.29 32.19 3a9t h VAL 129 CO -0.01 0.90 -0.12 -0.07 -1.01 0.00 0.00 177.57 177.26 3a9t h LEU 130 N 0.00 1.05 -1.22 3.16 3.38 -1.14 0.40 115.31 120.94 3a9t h LEU 130 Ca -0.01 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.62 3a9t h LEU 130 Cb 1.64 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 3a9t h LEU 130 CO 0.12 1.16 0.53 0.00 0.09 0.00 0.00 178.44 180.34 3a9t h ALA 131 N 0.93 1.46 0.08 1.53 0.00 -1.23 0.15 119.26 122.17 3a9t h ALA 131 Ca 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3a9t h ALA 131 Cb 0.69 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3a9t h ALA 131 CO 0.05 0.49 -0.04 0.78 0.00 0.00 0.00 179.25 180.53 3a9t h GLY 132 N 1.06 -0.11 1.23 0.00 0.00 -0.99 0.35 103.07 104.61 3a9t h GLY 132 Ca 0.30 0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.71 3a9t h GLY 132 CO -0.07 -0.04 0.42 -0.97 0.00 0.00 0.00 176.54 175.88 3a9t h TYR 133 N -0.24 0.70 -0.11 5.60 -1.99 -0.17 0.24 116.97 121.00 3a9t h TYR 133 Ca -0.01 0.02 -0.14 0.00 2.00 0.00 0.00 58.73 60.60 3a9t h TYR 133 Cb 0.20 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 38.69 3a9t h TYR 133 CO -0.03 0.40 -0.54 -0.91 -0.00 0.00 0.00 178.16 177.08 3a9t h ASN 134 N 0.72 0.36 0.34 3.88 2.35 -0.34 0.18 115.58 123.07 3a9t h ASN 134 Ca 0.26 -0.19 -0.21 0.00 -0.55 0.00 0.00 56.30 55.61 3a9t h ASN 134 Cb 0.13 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 3a9t h ASN 134 CO -0.07 0.83 -0.89 -0.61 -1.65 0.00 0.00 177.43 175.03 3a9t h GLN 135 N 0.25 0.39 -0.00 0.81 4.15 0.08 -3.18 115.11 117.62 3a9t h GLN 135 Ca 0.01 -0.40 0.00 0.00 0.77 0.00 0.00 58.65 59.03 3a9t h GLN 135 Cb 1.03 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.82 3a9t h GLN 135 CO 0.09 1.06 -0.25 1.63 -1.93 0.00 0.00 178.83 179.43 3a9t n LYS 136 N -3.76 0.08 -2.23 1.69 5.02 -0.02 -4.95 118.16 114.00 3a9t n LYS 136 Ca -0.06 -0.03 -0.02 0.00 -2.02 0.00 0.00 58.31 56.18 3a9t n LYS 136 Cb 0.81 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.32 3a9t n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9t n GLY 137 N 1.48 0.50 3.02 0.72 0.00 -0.52 -5.03 105.19 105.35 3a9t n GLY 137 Ca 0.07 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 3a9t n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a9t s LEU 138 N -0.81 4.77 0.25 0.99 1.43 0.52 -5.03 118.68 120.79 3a9t s LEU 138 Ca 0.02 -2.36 -0.30 0.00 -1.03 0.00 0.00 54.13 50.46 3a9t s LEU 138 Cb -0.01 -1.67 -0.15 0.00 0.03 0.00 0.00 46.19 44.39 3a9t s LEU 138 CO 0.02 -0.37 1.07 -2.65 0.23 0.00 0.00 176.35 174.65 3a9t n PRO 139 N 4.02 1.31 -3.71 1.29 -0.02 -1.26 -4.48 135.00 132.15 3a9t n PRO 139 Ca 0.03 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 61.85 3a9t n PRO 139 Cb 0.40 -1.88 -0.10 0.00 -0.02 0.00 0.00 33.50 31.90 3a9t n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9t s ALA 140 N -0.73 -1.15 0.14 3.55 0.00 -1.26 -4.49 121.76 117.82 3a9t s ALA 140 Ca 0.64 1.36 -0.24 0.00 0.00 0.00 0.00 51.96 53.71 3a9t s ALA 140 Cb -0.75 -0.79 -0.08 0.00 0.00 0.00 0.00 23.12 21.50 3a9t s ALA 140 CO 0.57 -0.23 0.73 -0.06 0.00 0.00 0.00 175.76 176.78 3a9t s PHE 141 N 0.41 3.88 -0.16 0.00 0.40 0.10 -0.67 117.98 121.94 3a9t s PHE 141 Ca -0.01 1.56 -0.03 0.00 -0.60 0.00 0.00 56.93 57.84 3a9t s PHE 141 Cb -0.04 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.75 3a9t s PHE 141 CO -0.01 0.52 -0.05 0.20 0.70 0.00 0.00 175.22 176.58 3a9t s GLY 142 N -1.10 1.68 -0.24 4.36 0.00 -1.26 -0.63 107.32 110.13 3a9t s GLY 142 Ca 0.34 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 44.21 3a9t s GLY 142 CO 0.25 -0.01 -0.11 -0.42 0.00 0.00 0.00 173.10 172.81 3a9t s ILE 143 N 0.52 2.02 -0.11 0.90 1.01 -0.26 -4.96 121.20 120.32 3a9t s ILE 143 Ca -0.04 -1.46 0.02 0.00 0.00 0.00 0.00 60.65 59.17 3a9t s ILE 143 Cb -0.14 -2.12 0.02 0.00 0.01 0.00 0.00 42.46 40.22 3a9t s ILE 143 CO 0.03 0.02 -0.14 -0.47 0.00 0.00 0.00 174.94 174.38 3a9t s TYR 144 N 1.19 1.90 0.36 3.97 5.04 -1.26 -2.56 117.35 125.99 3a9t s TYR 144 Ca -0.07 -0.89 -0.26 0.00 -2.44 0.00 0.00 57.07 53.42 3a9t s TYR 144 Cb -0.19 -1.39 -0.09 0.00 0.35 0.00 0.00 41.96 40.64 3a9t s TYR 144 CO -0.06 -0.47 1.05 0.20 -1.34 0.00 0.00 175.55 174.93 3a9t s GLY 145 N 1.02 2.83 0.37 8.97 0.00 -1.26 -4.92 107.32 114.32 3a9t s GLY 145 Ca -0.06 0.73 0.20 0.00 0.00 0.00 0.00 44.72 45.59 3a9t s GLY 145 CO -0.02 1.21 1.52 0.07 0.00 0.00 0.00 173.10 175.88 3a9t h LYS 146 N 2.89 0.00 -5.19 2.90 2.10 -1.99 -3.45 116.57 113.83 3a9t h LYS 146 Ca -0.48 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 57.52 3a9t h LYS 146 Cb 1.21 0.00 -0.25 0.00 -0.90 0.00 0.00 32.23 32.29 3a9t h LYS 146 CO 0.64 0.20 -0.71 -0.51 -2.00 0.00 0.00 179.45 177.07 3a9t s ASP 147 N -6.29 4.46 0.20 7.07 1.01 -1.26 -5.08 116.67 116.79 3a9t s ASP 147 Ca 0.06 -0.26 -0.33 0.00 0.71 0.00 0.00 52.55 52.73 3a9t s ASP 147 Cb 0.06 -1.73 -0.13 0.00 1.01 0.00 0.00 42.92 42.13 3a9t s ASP 147 CO 0.70 0.10 1.66 0.52 0.21 0.00 0.00 175.17 178.37 3a9t n VAL 148 N 4.00 0.08 -4.18 -1.27 0.31 -1.26 -4.86 118.33 111.14 3a9t n VAL 148 Ca -0.18 -0.02 -0.29 0.00 -0.01 0.00 0.00 64.34 63.84 3a9t n VAL 148 Cb 0.52 -1.83 -0.09 0.00 -0.91 0.00 0.00 33.84 31.54 3a9t n VAL 148 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3a9t s GLN 149 N 0.95 2.35 0.31 5.55 -0.21 0.23 -5.03 119.66 123.81 3a9t s GLN 149 Ca 0.75 -0.96 -0.28 0.00 0.02 0.00 0.00 55.36 54.90 3a9t s GLN 149 Cb -0.56 -2.42 -0.09 0.00 1.00 0.00 0.00 33.01 30.94 3a9t s GLN 149 CO 0.35 0.51 1.07 -0.51 -2.12 0.00 0.00 175.29 174.60 3a9t s ASP 150 N -2.36 7.18 0.12 5.90 1.01 -1.26 -4.37 116.67 122.90 3a9t s ASP 150 Ca 0.24 2.18 -0.35 0.00 0.71 0.00 0.00 52.55 55.33 3a9t s ASP 150 Cb -0.11 -2.61 -0.17 0.00 1.01 0.00 0.00 42.92 41.04 3a9t s ASP 150 CO 0.16 -0.19 1.20 0.00 0.21 0.00 0.00 175.17 176.55 3a9t n ALA 151 N 0.91 -1.18 0.00 5.23 0.00 -1.26 -1.38 120.51 122.83 3a9t n ALA 151 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3a9t n ALA 151 Cb 0.46 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.90 3a9t n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a9t n GLY 152 N 2.17 3.34 3.67 0.00 0.00 -1.26 -5.02 105.19 108.09 3a9t n GLY 152 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 3a9t n GLY 152 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3a9t n ASP 153 N 0.02 3.98 -0.93 1.61 -0.08 -0.48 -4.84 116.55 115.83 3a9t n ASP 153 Ca 0.00 0.92 0.11 0.00 -1.51 0.00 0.00 54.79 54.31 3a9t n ASP 153 Cb 0.00 -1.49 0.11 0.00 2.34 0.00 0.00 41.12 42.08 3a9t n ASP 153 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3a9t n THR 154 N 5.45 0.05 -2.31 5.18 -2.24 -1.26 -4.88 114.28 114.27 3a9t n THR 154 Ca 0.21 -0.53 -0.43 0.00 -2.27 0.00 0.00 64.05 61.03 3a9t n THR 154 Cb 0.38 1.42 -0.02 0.00 -2.10 0.00 0.00 70.33 70.01 3a9t n THR 154 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3a9t s ASN 155 N -1.85 6.40 -0.21 3.42 0.01 -1.26 -4.93 114.94 116.51 3a9t s ASN 155 Ca 0.28 1.08 -0.29 0.00 -0.71 0.00 0.00 52.86 53.22 3a9t s ASN 155 Cb 0.19 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 39.31 3a9t s ASN 155 CO 0.29 -1.33 1.24 -0.63 -1.51 0.00 0.00 177.10 175.16 3a9t s ILE 156 N 5.22 4.29 0.93 0.60 1.01 -1.26 -4.99 121.20 127.01 3a9t s ILE 156 Ca 0.63 1.54 -0.13 0.00 0.00 0.00 0.00 60.65 62.69 3a9t s ILE 156 Cb -0.17 -4.08 0.04 0.00 0.01 0.00 0.00 42.46 38.26 3a9t s ILE 156 CO 0.30 -0.24 0.51 -2.65 0.00 0.00 0.00 174.94 172.86 3a9t n PRO 157 N 6.77 -0.27 -0.17 2.79 -0.02 -1.26 -4.70 135.00 138.14 3a9t n PRO 157 Ca 0.14 -0.03 -0.08 0.00 -2.02 0.00 0.00 63.50 61.50 3a9t n PRO 157 Cb 0.45 -1.92 0.01 0.00 -0.02 0.00 0.00 33.50 32.02 3a9t n PRO 157 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9t h GLU 158 N -1.52 0.75 0.00 -0.52 4.57 -1.99 -1.33 114.58 114.53 3a9t h GLU 158 Ca -0.44 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 57.54 3a9t h GLU 158 Cb 1.28 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 3a9t h GLU 158 CO 0.36 0.67 -0.30 0.38 -1.18 0.00 0.00 179.01 178.94 3a9t h ASP 159 N 0.66 0.00 0.11 1.04 -0.00 -2.00 -2.39 116.42 113.84 3a9t h ASP 159 Ca 0.16 0.00 -0.29 0.00 -0.00 0.00 0.00 57.03 56.90 3a9t h ASP 159 Cb 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 39.33 39.57 3a9t h ASP 159 CO -0.01 0.30 -1.19 0.58 -0.00 0.00 0.00 179.24 178.91 3a9t h VAL 160 N 0.00 1.28 -0.42 4.15 2.07 -1.87 -3.21 116.25 118.25 3a9t h VAL 160 Ca -0.00 -2.41 0.05 0.00 0.82 0.00 0.00 66.70 65.15 3a9t h VAL 160 Cb 0.56 2.61 -0.05 0.00 -1.52 0.00 0.00 31.29 32.90 3a9t h VAL 160 CO 0.04 0.74 0.16 0.11 0.02 0.00 0.00 177.57 178.63 3a9t h LYS 161 N 0.31 0.32 -0.17 1.57 1.57 -0.91 -0.55 116.57 118.70 3a9t h LYS 161 Ca -0.17 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.63 3a9t h LYS 161 Cb 1.86 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 34.05 3a9t h LYS 161 CO 0.23 0.21 -0.13 1.49 -0.57 0.00 0.00 179.45 180.68 3a9t h GLU 162 N 0.33 -0.13 -0.43 3.15 4.81 -1.51 0.03 114.58 120.84 3a9t h GLU 162 Ca 0.19 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 3a9t h GLU 162 Cb 0.17 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3a9t h GLU 162 CO -0.19 -0.08 0.07 0.87 -0.73 0.00 0.00 179.01 178.95 3a9t h LYS 163 N -0.13 0.71 -0.29 1.92 1.57 -1.50 0.20 116.57 119.05 3a9t h LYS 163 Ca 0.10 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3a9t h LYS 163 Cb 0.29 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 3a9t h LYS 163 CO -0.25 0.74 0.10 -0.07 -0.57 0.00 0.00 179.45 179.40 3a9t h LEU 164 N 0.57 0.11 -0.37 2.94 3.38 -0.79 0.16 115.31 121.31 3a9t h LEU 164 Ca 0.13 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 3a9t h LEU 164 Cb 0.38 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3a9t h LEU 164 CO 0.01 0.10 -0.08 0.40 0.09 0.00 0.00 178.44 178.96 3a9t h ILE 165 N 0.23 1.27 -0.36 1.22 2.04 -0.85 -0.32 117.51 120.75 3a9t h ILE 165 Ca 0.13 -1.14 0.01 0.00 1.00 0.00 0.00 64.86 64.86 3a9t h ILE 165 Cb 0.10 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3a9t h ILE 165 CO -0.13 0.38 0.22 -0.09 0.00 0.00 0.00 178.15 178.53 3a9t h ARG 166 N 0.51 0.44 -0.16 2.37 2.43 -0.31 0.14 114.38 119.79 3a9t h ARG 166 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3a9t h ARG 166 Cb 0.58 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 3a9t h ARG 166 CO 0.03 0.29 0.09 0.35 -1.51 0.00 0.00 179.97 179.22 3a9t h PHE 167 N 0.45 0.23 -0.60 2.20 3.57 -0.60 -1.98 116.94 120.22 3a9t h PHE 167 Ca 0.14 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.69 3a9t h PHE 167 Cb -0.02 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 3a9t h PHE 167 CO -0.06 0.24 0.31 0.00 -2.23 0.00 0.00 178.31 176.56 3a9t h ALA 168 N 0.97 0.79 -0.29 2.41 0.00 -0.73 0.10 119.26 122.51 3a9t h ALA 168 Ca 0.06 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3a9t h ALA 168 Cb 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3a9t h ALA 168 CO -0.01 -0.04 -0.05 0.87 0.00 0.00 0.00 179.25 180.02 3a9t h LYS 169 N 0.57 0.54 -0.36 0.00 1.57 -0.84 -0.31 116.57 117.73 3a9t h LYS 169 Ca 0.27 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 3a9t h LYS 169 Cb 0.20 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3a9t h LYS 169 CO -0.19 0.72 0.08 0.00 -0.57 0.00 0.00 179.45 179.49 3a9t h ALA 170 N 0.80 0.48 -0.74 3.86 0.00 -1.14 -1.29 119.26 121.23 3a9t h ALA 170 Ca 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3a9t h ALA 170 Cb 0.51 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3a9t h ALA 170 CO 0.02 0.16 0.45 0.78 0.00 0.00 0.00 179.25 180.66 3a9t h GLY 171 N 0.44 1.07 0.94 0.00 0.00 -0.75 -1.10 103.07 103.67 3a9t h GLY 171 Ca 0.11 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 3a9t h GLY 171 CO 0.00 0.43 0.16 -2.00 0.00 0.00 0.00 176.54 175.13 3a9t h LEU 172 N 1.01 0.46 -0.80 3.11 5.85 -0.83 0.19 115.31 124.30 3a9t h LEU 172 Ca 0.27 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.88 3a9t h LEU 172 Cb -0.04 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 3a9t h LEU 172 CO -0.05 0.47 0.50 0.00 -0.34 0.00 0.00 178.44 179.02 3a9t h ALA 173 N 1.01 1.06 -0.19 1.25 0.00 -0.92 0.21 119.26 121.67 3a9t h ALA 173 Ca 0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3a9t h ALA 173 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3a9t h ALA 173 CO -0.01 0.30 0.05 0.28 0.00 0.00 0.00 179.25 179.87 3a9t h VAL 174 N 0.97 1.20 0.00 0.00 2.07 -0.82 -2.78 116.25 116.89 3a9t h VAL 174 Ca 0.32 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 3a9t h VAL 174 Cb 0.04 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 3a9t h VAL 174 CO -0.12 0.20 -0.21 0.00 0.02 0.00 0.00 177.57 177.46 3a9t h ALA 175 N 0.86 1.47 -0.43 1.67 0.00 -0.40 -2.94 119.26 119.49 3a9t h ALA 175 Ca 0.06 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 3a9t h ALA 175 Cb 0.26 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3a9t h ALA 175 CO -0.00 0.26 0.02 0.52 0.00 0.00 0.00 179.25 180.05 3a9t h MET 176 N 0.00 0.69 -0.03 0.00 2.86 -0.33 -3.24 114.93 114.88 3a9t h MET 176 Ca -0.00 -0.16 -0.24 0.00 -2.06 0.00 0.00 59.70 57.24 3a9t h MET 176 Cb 0.42 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 32.00 3a9t h MET 176 CO 0.03 0.69 -0.93 0.52 1.06 0.00 0.00 176.91 178.28 3a9t h MET 177 N 0.65 0.58 -6.36 1.72 2.86 -1.45 -3.44 114.93 109.49 3a9t h MET 177 Ca 0.14 -0.58 -0.64 0.00 -2.06 0.00 0.00 59.70 56.55 3a9t h MET 177 Cb 0.38 0.15 0.07 0.00 0.06 0.00 0.00 31.60 32.26 3a9t h MET 177 CO 0.01 1.20 0.47 1.63 1.06 0.00 0.00 176.91 181.28 3a9t n LYS 178 N -3.82 1.41 0.00 1.72 5.02 -1.23 -1.18 118.16 120.08 3a9t n LYS 178 Ca -0.08 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 3a9t n LYS 178 Cb 0.83 -2.13 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 3a9t n LYS 178 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9t n GLY 179 N 2.46 3.16 3.87 0.72 0.00 -0.10 -4.99 105.19 110.30 3a9t n GLY 179 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3a9t n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9t s LYS 180 N -0.35 3.19 0.19 1.61 -0.14 -0.33 -4.69 119.74 119.23 3a9t s LYS 180 Ca 0.00 0.63 0.07 0.00 -1.36 0.00 0.00 55.97 55.31 3a9t s LYS 180 Cb 0.00 -2.04 -0.04 0.00 -1.68 0.00 0.00 37.83 34.07 3a9t s LYS 180 CO 0.00 -0.84 0.06 -1.12 -0.76 0.00 0.00 175.35 172.69 3a9t s SER 181 N -4.23 5.01 -0.24 2.83 0.01 -0.25 -0.92 113.70 115.91 3a9t s SER 181 Ca 0.57 -0.35 -0.04 0.00 1.31 0.00 0.00 55.95 57.44 3a9t s SER 181 Cb -0.11 -1.14 -0.00 0.00 0.21 0.00 0.00 66.02 64.97 3a9t s SER 181 CO 0.53 0.06 -0.02 -0.47 0.41 0.00 0.00 173.24 173.75 3a9t s TYR 182 N -1.86 3.01 -0.21 2.43 5.04 -0.26 -2.23 117.35 123.27 3a9t s TYR 182 Ca 0.29 -1.02 -0.17 0.00 -2.44 0.00 0.00 57.07 53.73 3a9t s TYR 182 Cb -0.09 -2.13 -0.04 0.00 0.35 0.00 0.00 41.96 40.06 3a9t s TYR 182 CO 0.21 -0.57 0.45 -1.17 -1.34 0.00 0.00 175.55 173.12 3a9t s LEU 183 N 1.46 4.13 -0.37 6.97 2.96 -0.60 -1.51 118.68 131.73 3a9t s LEU 183 Ca 0.04 0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 54.40 3a9t s LEU 183 Cb -0.15 -2.59 0.02 0.00 0.50 0.00 0.00 46.19 43.96 3a9t s LEU 183 CO -0.02 -0.15 0.21 -0.55 -1.32 0.00 0.00 176.35 174.52 3a9t s SER 184 N 1.18 5.75 -0.33 3.68 0.15 0.07 -1.55 113.70 122.65 3a9t s SER 184 Ca 0.21 -0.89 -0.11 0.00 0.70 0.00 0.00 55.95 55.86 3a9t s SER 184 Cb -0.15 -2.04 -0.00 0.00 -1.71 0.00 0.00 66.02 62.12 3a9t s SER 184 CO 0.09 -0.35 0.19 -0.63 1.20 0.00 0.00 173.24 173.74 3a9t s ILE 185 N 1.58 4.82 0.00 6.45 1.01 -0.73 -0.83 121.20 133.50 3a9t s ILE 185 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 60.65 60.24 3a9t s ILE 185 Cb -0.19 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.78 3a9t s ILE 185 CO 0.07 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.60 3a9t n GLY 186 N 5.03 -2.50 0.00 6.18 0.00 -0.15 -1.33 105.19 112.42 3a9t n GLY 186 Ca -0.13 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.13 3a9t n GLY 186 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3a9t n SER 187 N 0.07 0.00 -4.77 1.61 2.88 -1.26 -4.81 113.62 107.34 3a9t n SER 187 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 3a9t n SER 187 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 3a9t n SER 187 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3a9t s VAL 188 N 3.35 2.34 -0.24 2.46 1.01 -1.26 -4.63 120.40 123.43 3a9t s VAL 188 Ca 0.00 0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.26 3a9t s VAL 188 Cb 0.00 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 3a9t s VAL 188 CO 0.00 0.08 -0.01 -0.55 0.00 0.00 0.00 175.10 174.61 3a9t s SER 189 N -0.19 4.51 -1.61 3.32 0.15 -1.26 -4.73 113.70 113.89 3a9t s SER 189 Ca 0.52 -0.44 -0.06 0.00 0.70 0.00 0.00 55.95 56.68 3a9t s SER 189 Cb -0.44 -1.78 0.06 0.00 -1.71 0.00 0.00 66.02 62.15 3a9t s SER 189 CO 0.57 -0.05 0.20 0.23 1.20 0.00 0.00 173.24 175.39 3a9t n MET 190 N 4.81 -1.22 -1.77 5.44 2.81 -1.26 -0.99 117.12 124.94 3a9t n MET 190 Ca -0.17 0.14 -0.19 0.00 -1.81 0.00 0.00 57.70 55.67 3a9t n MET 190 Cb 0.50 -3.97 -0.06 0.00 -0.71 0.00 0.00 33.22 28.98 3a9t n MET 190 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a9t n GLY 191 N -2.17 1.19 3.64 3.03 0.00 -1.26 -4.94 105.19 104.68 3a9t n GLY 191 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 3a9t n GLY 191 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a9t s ILE 192 N -2.69 4.28 0.31 -0.61 1.01 -0.16 -4.91 121.20 118.43 3a9t s ILE 192 Ca 0.00 1.48 0.08 0.00 0.00 0.00 0.00 60.65 62.21 3a9t s ILE 192 Cb 0.00 -4.17 0.31 0.00 0.01 0.00 0.00 42.46 38.62 3a9t s ILE 192 CO 0.00 -0.37 1.67 0.00 0.00 0.00 0.00 174.94 176.24 3a9t h ALA 193 N 8.68 1.62 0.00 9.38 0.00 -1.92 0.49 119.26 137.51 3a9t h ALA 193 Ca -0.25 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3a9t h ALA 193 Cb 1.09 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3a9t h ALA 193 CO 1.01 -0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.21 3a9t n GLY 194 N -1.33 -0.93 0.47 0.00 0.00 -1.26 -2.23 105.19 99.91 3a9t n GLY 194 Ca 0.26 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.35 3a9t n GLY 194 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a9t n SER 195 N -1.40 1.58 -4.75 1.61 3.41 0.16 -1.59 113.62 112.64 3a9t n SER 195 Ca 0.06 -1.40 -0.40 0.00 -0.26 0.00 0.00 58.87 56.87 3a9t n SER 195 Cb 0.16 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.11 3a9t n SER 195 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3a9t s VAL 196 N -2.16 4.76 -0.27 -3.33 1.01 -0.95 -4.25 120.40 115.21 3a9t s VAL 196 Ca 0.32 1.54 -0.13 0.00 0.00 0.00 0.00 61.98 63.71 3a9t s VAL 196 Cb 0.20 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3a9t s VAL 196 CO 0.39 0.38 0.30 -0.69 0.00 0.00 0.00 175.10 175.49 3a9t s VAL 197 N -0.13 5.23 -0.79 2.92 1.01 -1.26 -4.88 120.40 122.49 3a9t s VAL 197 Ca 0.37 0.41 -0.08 0.00 0.00 0.00 0.00 61.98 62.68 3a9t s VAL 197 Cb -0.20 -3.63 0.20 0.00 0.00 0.00 0.00 36.38 32.75 3a9t s VAL 197 CO 0.22 0.19 0.68 -1.10 0.00 0.00 0.00 175.10 175.09 3a9t s GLN 198 N 1.94 3.24 0.39 2.72 -0.21 -1.26 -4.93 119.66 121.56 3a9t s GLN 198 Ca 0.12 -2.66 0.19 0.00 0.02 0.00 0.00 55.36 53.03 3a9t s GLN 198 Cb -0.16 -4.13 1.15 0.00 1.00 0.00 0.00 33.01 30.87 3a9t s GLN 198 CO 0.10 -1.24 1.72 0.93 -2.12 0.00 0.00 175.29 174.68 3a9t h GLU 199 N 7.18 0.33 -0.69 2.91 5.08 -2.00 0.05 114.58 127.44 3a9t h GLU 199 Ca 0.08 -0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.56 3a9t h GLU 199 Cb 0.97 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 30.04 3a9t h GLU 199 CO 0.77 0.22 0.14 0.22 -1.00 0.00 0.00 179.01 179.36 3a9t h ASP 200 N 0.34 -0.03 0.49 1.42 1.82 -1.99 -0.18 116.42 118.28 3a9t h ASP 200 Ca 0.67 0.14 -0.02 0.00 -0.39 0.00 0.00 57.03 57.42 3a9t h ASP 200 Cb 1.73 0.20 0.00 0.00 0.68 0.00 0.00 39.33 41.94 3a9t h ASP 200 CO -0.39 -0.03 -0.23 0.15 -1.61 0.00 0.00 179.24 177.13 3a9t h PHE 201 N 0.25 -0.61 -0.54 0.28 3.57 -1.40 -0.30 116.94 118.20 3a9t h PHE 201 Ca 0.38 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.91 3a9t h PHE 201 Cb 0.62 0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.51 3a9t h PHE 201 CO -0.27 -0.37 0.27 0.74 -2.23 0.00 0.00 178.31 176.45 3a9t h PHE 202 N -0.67 0.49 -0.03 0.41 0.04 -1.42 -0.02 116.94 115.76 3a9t h PHE 202 Ca -0.07 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 3a9t h PHE 202 Cb 0.51 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.52 3a9t h PHE 202 CO -0.04 0.23 -0.04 0.37 -0.60 0.00 0.00 178.31 178.23 3a9t h GLN 203 N 0.52 0.07 0.04 1.51 4.15 -1.03 0.35 115.11 120.72 3a9t h GLN 203 Ca 0.24 -0.04 -0.25 0.00 0.77 0.00 0.00 58.65 59.36 3a9t h GLN 203 Cb 0.16 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 3a9t h GLN 203 CO -0.17 0.59 -1.29 -0.91 -1.93 0.00 0.00 178.83 175.12 3a9t h ASN 204 N -0.43 0.13 0.04 -0.69 2.35 -1.01 -2.73 115.58 113.23 3a9t h ASN 204 Ca 0.00 -0.17 -0.34 0.00 -0.55 0.00 0.00 56.30 55.24 3a9t h ASN 204 Cb 0.58 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.87 3a9t h ASN 204 CO 0.01 1.14 -1.92 -1.22 -1.65 0.00 0.00 177.43 173.79 3a9t n TYR 205 N -3.33 0.76 0.74 1.19 4.02 -0.03 -4.61 117.16 115.91 3a9t n TYR 205 Ca -0.08 0.24 0.10 0.00 -0.01 0.00 0.00 57.90 58.15 3a9t n TYR 205 Cb 0.99 -1.09 -0.13 0.00 -0.02 0.00 0.00 39.34 39.10 3a9t n TYR 205 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3a9t n LEU 206 N -3.91 0.74 -2.44 7.72 4.77 -1.17 -4.93 117.00 117.78 3a9t n LEU 206 Ca -0.38 -0.39 -0.18 0.00 -0.03 0.00 0.00 56.01 55.03 3a9t n LEU 206 Cb 0.89 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.01 3a9t n LEU 206 CO 0.25 0.18 0.01 0.61 -1.33 0.00 0.00 177.39 177.11 3a9t n GLY 207 N 1.44 -0.26 3.86 -0.72 0.00 0.14 -3.48 105.19 106.17 3a9t n GLY 207 Ca 0.02 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 3a9t n GLY 207 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a9t s MET 208 N -5.47 2.82 0.22 1.61 1.00 0.99 -0.93 119.30 119.54 3a9t s MET 208 Ca 0.25 -1.21 0.04 0.00 0.00 0.00 0.00 55.69 54.78 3a9t s MET 208 Cb -0.11 -2.54 -0.03 0.00 0.00 0.00 0.00 34.83 32.15 3a9t s MET 208 CO 0.31 0.16 0.34 1.03 0.00 0.00 0.00 175.02 176.86 3a9t s ARG 209 N -3.99 3.44 -0.23 2.03 0.52 -0.10 -3.59 118.95 117.04 3a9t s ARG 209 Ca 0.40 -0.72 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 3a9t s ARG 209 Cb -0.07 -2.91 0.03 0.00 0.52 0.00 0.00 34.95 32.53 3a9t s ARG 209 CO 0.27 0.45 -0.12 -0.80 0.02 0.00 0.00 175.30 175.11 3a9t s ASN 210 N -3.81 3.94 0.07 0.23 0.01 -1.26 -1.10 114.94 113.02 3a9t s ASN 210 Ca 0.34 -0.96 0.05 0.00 -0.71 0.00 0.00 52.86 51.59 3a9t s ASN 210 Cb -0.09 -1.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.96 3a9t s ASN 210 CO 0.29 -0.10 -0.06 -1.61 -1.51 0.00 0.00 177.10 174.11 3a9t s GLU 211 N 1.24 2.37 0.01 -0.60 0.41 -0.57 -4.96 118.70 116.62 3a9t s GLU 211 Ca -0.01 -0.88 0.02 0.00 -0.41 0.00 0.00 54.97 53.69 3a9t s GLU 211 Cb -0.16 -2.43 -0.01 0.00 -1.78 0.00 0.00 34.13 29.74 3a9t s GLU 211 CO -0.08 0.55 -0.07 0.71 -0.49 0.00 0.00 175.26 175.88 3a9t s TYR 212 N -1.18 0.63 -0.22 1.61 1.51 -1.26 -0.75 117.35 117.69 3a9t s TYR 212 Ca 0.21 -0.25 -0.09 0.00 -1.01 0.00 0.00 57.07 55.93 3a9t s TYR 212 Cb -0.11 -0.39 0.09 0.00 -0.11 0.00 0.00 41.96 41.43 3a9t s TYR 212 CO 0.13 -0.03 0.49 0.54 -1.11 0.00 0.00 175.55 175.57 3a9t s VAL 213 N -0.60 -0.50 0.46 0.71 0.11 -0.01 -4.94 120.40 115.63 3a9t s VAL 213 Ca -0.02 0.10 -0.24 0.00 -2.93 0.00 0.00 61.98 58.89 3a9t s VAL 213 Cb -0.05 -0.75 -0.07 0.00 -1.53 0.00 0.00 36.38 33.97 3a9t s VAL 213 CO 0.00 0.04 1.31 -0.62 -3.33 0.00 0.00 175.10 172.50 3a9t s ASP 214 N 2.29 5.96 0.61 3.54 -1.08 -1.26 -0.98 116.67 125.74 3a9t s ASP 214 Ca -0.05 2.65 0.41 0.00 -0.52 0.00 0.00 52.55 55.04 3a9t s ASP 214 Cb -0.10 -2.63 2.20 0.00 -1.46 0.00 0.00 42.92 40.92 3a9t s ASP 214 CO -0.15 -1.09 2.25 0.24 0.52 0.00 0.00 175.17 176.94 3a9t h MET 215 N 2.20 0.00 0.00 4.34 2.86 -1.90 -1.11 114.93 121.32 3a9t h MET 215 Ca -0.50 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 3a9t h MET 215 Cb 1.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.92 3a9t h MET 215 CO 0.61 0.00 0.01 0.66 1.06 0.00 0.00 176.91 179.25 3a9t h SER 216 N 0.00 0.00 -0.52 1.22 4.64 -2.01 0.15 113.55 117.02 3a9t h SER 216 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3a9t h SER 216 Cb 0.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 3a9t h SER 216 CO 0.00 0.00 0.18 -0.08 -0.87 0.00 0.00 176.83 176.06 3a9t h GLU 217 N 0.00 0.85 -0.29 4.77 4.57 -1.56 -1.69 114.58 121.23 3a9t h GLU 217 Ca 0.00 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 57.98 3a9t h GLU 217 Cb 0.02 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 3a9t h GLU 217 CO 0.00 0.74 -0.01 0.74 -1.18 0.00 0.00 179.01 179.30 3a9t h PHE 218 N 0.83 0.44 0.05 0.92 -1.00 -1.17 -1.43 116.94 115.59 3a9t h PHE 218 Ca 0.19 -0.04 -0.00 0.00 2.81 0.00 0.00 57.97 60.93 3a9t h PHE 218 Cb 0.24 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.67 3a9t h PHE 218 CO 0.01 0.45 -0.03 0.28 -1.61 0.00 0.00 178.31 177.42 3a9t h VAL 219 N 0.42 1.13 -0.02 -0.55 2.07 -1.40 -0.39 116.25 117.51 3a9t h VAL 219 Ca 0.09 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.02 3a9t h VAL 219 Cb 0.29 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 3a9t h VAL 219 CO 0.01 0.16 -0.29 -0.09 0.02 0.00 0.00 177.57 177.37 3a9t h ARG 220 N -0.35 -0.42 -0.42 1.57 2.43 -1.04 0.15 114.38 116.30 3a9t h ARG 220 Ca -0.01 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 3a9t h ARG 220 Cb 0.31 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 3a9t h ARG 220 CO 0.01 -0.28 0.10 0.00 -1.51 0.00 0.00 179.97 178.30 3a9t h ARG 221 N -0.43 0.62 0.06 0.20 3.08 -1.26 0.18 114.38 116.83 3a9t h ARG 221 Ca 0.07 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 3a9t h ARG 221 Cb 0.53 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3a9t h ARG 221 CO -0.26 0.56 -0.03 0.82 -1.07 0.00 0.00 179.97 179.99 3a9t h ILE 222 N 0.60 1.24 -0.50 2.04 2.04 -0.61 0.20 117.51 122.53 3a9t h ILE 222 Ca 0.14 -1.17 0.03 0.00 1.00 0.00 0.00 64.86 64.85 3a9t h ILE 222 Cb 0.23 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.26 3a9t h ILE 222 CO -0.00 0.29 0.29 -0.33 0.00 0.00 0.00 178.15 178.39 3a9t h GLU 223 N -0.62 0.56 -0.57 2.37 4.39 -0.52 -2.54 114.58 117.64 3a9t h GLU 223 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.66 3a9t h GLU 223 Cb 0.53 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 3a9t h GLU 223 CO 0.01 0.37 0.00 1.28 -1.16 0.00 0.00 179.01 179.51 3a9t n LEU 224 N -4.82 2.92 -4.05 1.33 4.77 0.62 -4.94 117.00 112.84 3a9t n LEU 224 Ca 0.03 -1.47 -0.31 0.00 -0.03 0.00 0.00 56.01 54.23 3a9t n LEU 224 Cb 0.08 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 3a9t n LEU 224 CO 0.32 0.53 -0.06 0.61 -1.33 0.00 0.00 177.39 177.46 3a9t n GLY 225 N 0.83 -0.38 3.47 -0.72 0.00 -0.54 -4.86 105.19 102.99 3a9t n GLY 225 Ca 0.15 0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.89 3a9t n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a9t s ILE 226 N -3.51 4.84 0.00 -0.61 1.01 0.59 -4.84 121.20 118.68 3a9t s ILE 226 Ca 0.47 -2.20 0.00 0.00 0.00 0.00 0.00 60.65 58.93 3a9t s ILE 226 Cb -0.25 -4.89 0.00 0.00 0.01 0.00 0.00 42.46 37.32 3a9t s ILE 226 CO 0.89 -1.62 0.00 0.00 0.00 0.00 0.00 174.94 174.20 3a9t n TYR 227 N 6.22 0.00 -1.89 3.97 0.18 -1.26 -4.82 117.16 119.55 3a9t n TYR 227 Ca 0.33 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.79 3a9t n TYR 227 Cb 0.45 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.37 3a9t n TYR 227 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 3a9t s ASP 228 N 0.00 4.91 0.51 9.48 -1.08 -1.26 -4.84 116.67 124.39 3a9t s ASP 228 Ca 0.00 0.18 0.16 0.00 -0.52 0.00 0.00 52.55 52.37 3a9t s ASP 228 Cb 0.00 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.17 3a9t s ASP 228 CO 0.00 -2.75 2.14 0.11 0.52 0.00 0.00 175.17 175.18 3a9t h LYS 229 N 14.65 0.04 -0.09 4.34 1.57 -1.99 0.01 116.57 135.11 3a9t h LYS 229 Ca -0.13 -0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.47 3a9t h LYS 229 Cb 1.12 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 3a9t h LYS 229 CO 1.18 0.03 -0.69 0.93 -0.57 0.00 0.00 179.45 180.33 3a9t h GLU 230 N 0.04 0.38 -0.19 3.15 5.08 -2.01 -2.71 114.58 118.33 3a9t h GLU 230 Ca 0.02 -0.29 -0.21 0.00 -1.00 0.00 0.00 59.36 57.88 3a9t h GLU 230 Cb 0.05 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.36 3a9t h GLU 230 CO -0.00 0.93 -0.70 1.49 -1.00 0.00 0.00 179.01 179.72 3a9t h GLU 231 N 0.27 0.79 -0.41 2.33 4.81 -1.73 -2.89 114.58 117.74 3a9t h GLU 231 Ca -0.02 -0.59 0.08 0.00 -0.13 0.00 0.00 59.36 58.69 3a9t h GLU 231 Cb 1.25 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.67 3a9t h GLU 231 CO 0.12 1.21 -0.00 -0.92 -0.73 0.00 0.00 179.01 178.68 3a9t h TYR 232 N 0.56 -0.03 0.25 0.92 5.03 -0.96 0.35 116.97 123.10 3a9t h TYR 232 Ca -0.03 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 3a9t h TYR 232 Cb 1.32 0.08 -0.00 0.00 1.55 0.00 0.00 36.73 39.67 3a9t h TYR 232 CO 0.08 -0.09 -0.14 0.93 -1.32 0.00 0.00 178.16 177.62 3a9t h GLU 233 N 0.10 -0.36 -0.71 1.82 4.39 -1.47 0.11 114.58 118.46 3a9t h GLU 233 Ca 0.20 0.02 0.08 0.00 0.34 0.00 0.00 59.36 60.01 3a9t h GLU 233 Cb 0.29 0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 28.96 3a9t h GLU 233 CO -0.34 -0.24 0.38 0.00 -1.16 0.00 0.00 179.01 177.64 3a9t h ARG 234 N -0.38 0.64 -0.77 2.33 3.08 -1.21 -0.42 114.38 117.65 3a9t h ARG 234 Ca -0.03 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3a9t h ARG 234 Cb 0.31 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 3a9t h ARG 234 CO 0.03 0.42 0.48 0.00 -1.07 0.00 0.00 179.97 179.83 3a9t h ALA 235 N 1.41 0.98 -0.51 0.04 0.00 0.14 0.53 119.26 121.86 3a9t h ALA 235 Ca 0.34 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 3a9t h ALA 235 Cb 0.31 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3a9t h ALA 235 CO -0.24 0.44 -0.07 1.25 0.00 0.00 0.00 179.25 180.62 3a9t h LEU 236 N 1.05 0.90 -0.60 0.00 5.85 0.14 -1.15 115.31 121.51 3a9t h LEU 236 Ca 0.28 -0.27 -0.14 0.00 0.84 0.00 0.00 57.88 58.59 3a9t h LEU 236 Cb -0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 3a9t h LEU 236 CO -0.05 1.00 -0.42 0.50 -0.34 0.00 0.00 178.44 179.13 3a9t h LYS 237 N 0.83 0.63 -0.32 1.25 3.64 -0.68 -2.54 116.57 119.39 3a9t h LYS 237 Ca 0.14 -0.33 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 3a9t h LYS 237 Cb 0.59 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 3a9t h LYS 237 CO 0.04 0.93 -0.08 2.35 -2.27 0.00 0.00 179.45 180.42 3a9t h TRP 238 N 0.51 0.69 -0.45 1.91 7.01 -0.65 -2.68 115.95 122.29 3a9t h TRP 238 Ca 0.04 -0.15 0.03 0.00 2.11 0.00 0.00 58.89 60.92 3a9t h TRP 238 Cb 0.95 -0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 27.80 3a9t h TRP 238 CO 0.04 0.80 0.23 0.28 -2.79 0.00 0.00 178.44 177.00 3a9t h VAL 239 N 0.39 0.98 -0.12 2.65 2.07 -1.12 -1.35 116.25 119.75 3a9t h VAL 239 Ca 0.08 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 3a9t h VAL 239 Cb 0.58 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3a9t h VAL 239 CO 0.03 0.08 -0.09 0.11 0.02 0.00 0.00 177.57 177.72 3a9t h LYS 240 N 0.46 0.18 0.00 1.57 1.79 -1.38 0.36 116.57 119.54 3a9t h LYS 240 Ca 0.19 -0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.58 3a9t h LYS 240 Cb 0.09 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 3a9t h LYS 240 CO -0.13 0.28 -0.83 0.93 -1.08 0.00 0.00 179.45 178.62 3a9t h GLU 241 N 0.17 0.00 0.00 3.15 5.08 -1.11 -3.40 114.58 118.47 3a9t h GLU 241 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3a9t h GLU 241 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3a9t h GLU 241 CO 0.02 0.11 -0.14 0.09 -1.00 0.00 0.00 179.01 178.09 3a9t n ASN 242 N -2.86 0.70 -4.37 1.42 3.02 -0.55 -4.97 115.26 107.65 3a9t n ASN 242 Ca -0.01 -0.36 -0.41 0.00 -0.03 0.00 0.00 54.58 53.77 3a9t n ASN 242 Cb 0.63 0.86 -0.11 0.00 -0.61 0.00 0.00 39.78 40.55 3a9t n ASN 242 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a9t s LYS 244 N 1.55 4.69 -0.30 0.00 1.02 -1.26 -4.76 119.74 120.67 3a9t s LYS 244 Ca 0.02 1.43 -0.15 0.00 0.02 0.00 0.00 55.97 57.29 3a9t s LYS 244 Cb -0.19 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 3a9t s LYS 244 CO 0.07 0.22 0.35 0.08 -0.92 0.00 0.00 175.35 175.14 3a9t s VAL 245 N -0.01 5.19 0.80 3.17 1.01 -1.26 -0.39 120.40 128.91 3a9t s VAL 245 Ca 0.46 0.30 -0.10 0.00 0.00 0.00 0.00 61.98 62.64 3a9t s VAL 245 Cb -0.23 -3.73 0.18 0.00 0.00 0.00 0.00 36.38 32.59 3a9t s VAL 245 CO 0.29 0.06 1.09 0.61 0.00 0.00 0.00 175.10 177.15 3a9t n GLY 246 N 4.85 -0.82 3.69 4.51 0.00 0.05 -4.88 105.19 112.59 3a9t n GLY 246 Ca -0.09 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 3a9t n GLY 246 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a9t n PRO 247 N -3.24 1.43 -3.12 1.61 -0.02 -1.26 -4.64 135.00 125.77 3a9t n PRO 247 Ca 0.15 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3a9t n PRO 247 Cb 0.52 -2.37 -0.07 0.00 -0.02 0.00 0.00 33.50 31.56 3a9t n PRO 247 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3a9t s ASP 248 N -0.96 6.51 0.00 2.55 -1.08 -1.26 -4.52 116.67 117.91 3a9t s ASP 248 Ca 0.71 0.48 0.26 0.00 -0.52 0.00 0.00 52.55 53.48 3a9t s ASP 248 Cb -0.44 -2.33 0.72 0.00 -1.46 0.00 0.00 42.92 39.41 3a9t s ASP 248 CO 0.50 -0.45 1.56 0.59 0.52 0.00 0.00 175.17 177.89 3a9t n ASN 249 N 5.84 0.59 -4.73 -0.34 4.13 -1.26 -4.87 115.26 114.60 3a9t n ASN 249 Ca -0.01 -0.38 -0.41 0.00 1.68 0.00 0.00 54.58 55.45 3a9t n ASN 249 Cb 0.49 0.11 -0.03 0.00 -1.54 0.00 0.00 39.78 38.81 3a9t n ASN 249 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3a9t s ASN 250 N -2.81 6.84 -0.53 6.41 0.01 -1.26 -4.95 114.94 118.65 3a9t s ASN 250 Ca 0.17 2.43 -0.24 0.00 -0.71 0.00 0.00 52.86 54.51 3a9t s ASN 250 Cb 0.18 -2.61 0.04 0.00 0.41 0.00 0.00 41.25 39.28 3a9t s ASN 250 CO 0.61 -0.58 0.90 -0.13 -1.51 0.00 0.00 177.10 176.39 3a9t s ARG 251 N 0.09 3.34 0.00 -0.60 0.52 -1.26 -4.53 118.95 116.51 3a9t s ARG 251 Ca 0.59 -0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.55 3a9t s ARG 251 Cb -0.38 -4.03 0.00 0.00 0.52 0.00 0.00 34.95 31.06 3a9t s ARG 251 CO 0.37 -1.40 0.00 -0.25 0.02 0.00 0.00 175.30 174.04 3a9t n ASP 252 N 7.26 0.00 0.06 0.23 8.00 -1.26 -0.99 116.55 129.86 3a9t n ASP 252 Ca 0.02 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.56 3a9t n ASP 252 Cb 0.47 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.78 3a9t n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a9t n GLY 253 N 0.00 -0.61 0.00 0.44 0.00 -1.26 -2.03 105.19 101.74 3a9t n GLY 253 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3a9t n GLY 253 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3a9t n PHE 254 N -1.76 0.00 -2.79 1.61 3.01 -0.16 -5.06 117.46 112.32 3a9t n PHE 254 Ca -0.01 -0.27 -0.40 0.00 1.01 0.00 0.00 57.45 57.78 3a9t n PHE 254 Cb 0.05 -0.03 -0.06 0.00 -0.01 0.00 0.00 39.48 39.43 3a9t n PHE 254 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3a9t s LYS 255 N -0.55 4.79 0.17 -1.08 1.02 -0.86 -4.57 119.74 118.67 3a9t s LYS 255 Ca 0.00 1.43 -0.15 0.00 0.02 0.00 0.00 55.97 57.27 3a9t s LYS 255 Cb 0.00 -3.29 -0.07 0.00 -0.52 0.00 0.00 37.83 33.95 3a9t s LYS 255 CO 0.00 0.50 0.58 1.03 -0.92 0.00 0.00 175.35 176.54 3a9t s ARG 256 N -1.05 4.00 1.40 1.68 0.52 -1.26 -5.01 118.95 119.23 3a9t s ARG 256 Ca 0.41 0.53 -0.22 0.00 -0.52 0.00 0.00 55.73 55.93 3a9t s ARG 256 Cb -0.25 -2.87 0.36 0.00 0.52 0.00 0.00 34.95 32.71 3a9t s ARG 256 CO 0.31 0.43 0.95 0.95 0.02 0.00 0.00 175.30 177.96 3a9t s THR 257 N -1.53 1.25 0.15 0.02 -4.23 -1.26 -4.78 115.64 105.25 3a9t s THR 257 Ca 0.40 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.84 3a9t s THR 257 Cb -0.15 -2.12 -0.12 0.00 1.34 0.00 0.00 72.50 71.46 3a9t s THR 257 CO 0.20 0.00 1.39 -0.08 -0.54 0.00 0.00 174.62 175.59 3a9t h GLU 258 N -3.33 0.62 -0.24 3.99 4.81 -1.99 -2.66 114.58 115.78 3a9t h GLU 258 Ca -0.44 -0.48 -0.00 0.00 -0.13 0.00 0.00 59.36 58.31 3a9t h GLU 258 Cb 1.33 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.79 3a9t h GLU 258 CO 0.29 1.10 0.13 1.49 -0.73 0.00 0.00 179.01 181.29 3a9t h GLU 259 N 0.43 0.33 -0.07 1.92 4.81 -2.00 -2.26 114.58 117.74 3a9t h GLU 259 Ca -0.03 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3a9t h GLU 259 Cb 1.31 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 3a9t h GLU 259 CO 0.14 0.30 0.01 1.96 -0.73 0.00 0.00 179.01 180.68 3a9t h GLN 260 N 0.27 0.03 -0.70 1.92 4.20 -1.91 -1.62 115.11 117.31 3a9t h GLN 260 Ca 0.08 -0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.91 3a9t h GLN 260 Cb 0.07 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 3a9t h GLN 260 CO -0.01 0.02 0.47 0.87 -0.67 0.00 0.00 178.83 179.50 3a9t h LYS 261 N 0.03 0.43 -0.12 1.46 1.57 -1.32 0.46 116.57 119.08 3a9t h LYS 261 Ca 0.03 -0.03 -0.22 0.00 -1.87 0.00 0.00 60.65 58.57 3a9t h LYS 261 Cb 0.03 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.25 3a9t h LYS 261 CO -0.05 0.29 -0.80 1.49 -0.57 0.00 0.00 179.45 179.81 3a9t h GLU 262 N 0.45 0.70 -0.41 3.15 4.57 -0.89 -2.75 114.58 119.40 3a9t h GLU 262 Ca 0.33 -0.59 -0.11 0.00 -1.18 0.00 0.00 59.36 57.81 3a9t h GLU 262 Cb 0.69 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.39 3a9t h GLU 262 CO -0.10 1.20 -0.19 -0.22 -1.18 0.00 0.00 179.01 178.51 3a9t h LYS 263 N 0.47 0.79 -0.86 1.92 3.64 -0.17 -2.42 116.57 119.93 3a9t h LYS 263 Ca -0.06 -0.30 0.10 0.00 -1.27 0.00 0.00 60.65 59.12 3a9t h LYS 263 Cb 1.42 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 33.12 3a9t h LYS 263 CO 0.16 0.92 0.51 -0.44 -2.27 0.00 0.00 179.45 178.32 3a9t h ASP 264 N 0.69 0.74 -0.18 4.20 5.19 -0.07 -0.40 116.42 126.58 3a9t h ASP 264 Ca 0.10 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.54 3a9t h ASP 264 Cb 0.70 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 3a9t h ASP 264 CO 0.05 0.42 0.04 -0.50 -3.12 0.00 0.00 179.24 176.13 3a9t h TRP 265 N 0.85 0.32 0.33 4.55 -0.00 -1.17 -0.82 115.95 120.00 3a9t h TRP 265 Ca 0.42 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.89 59.27 3a9t h TRP 265 Cb 0.37 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 29.42 3a9t h TRP 265 CO -0.05 0.44 -0.34 0.93 -0.00 0.00 0.00 178.44 179.42 3a9t h GLU 266 N 0.10 -0.68 -0.48 0.49 5.08 -0.88 -1.20 114.58 117.02 3a9t h GLU 266 Ca 0.06 0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3a9t h GLU 266 Cb 0.28 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 3a9t h GLU 266 CO 0.00 -0.45 0.21 0.82 -1.00 0.00 0.00 179.01 178.59 3a9t h ILE 267 N -0.70 1.17 -0.77 3.13 2.04 -1.13 -1.39 117.51 119.86 3a9t h ILE 267 Ca -0.02 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3a9t h ILE 267 Cb 0.64 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 3a9t h ILE 267 CO -0.07 0.20 0.31 0.28 0.00 0.00 0.00 178.15 178.88 3a9t h SER 268 N 0.68 1.05 -0.22 1.72 0.02 -0.75 0.19 113.55 116.24 3a9t h SER 268 Ca 0.17 -0.17 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 3a9t h SER 268 Cb 0.10 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 3a9t h SER 268 CO -0.02 0.93 -0.43 0.58 -1.14 0.00 0.00 176.83 176.75 3a9t h VAL 269 N 1.11 1.29 -0.45 2.27 2.07 -0.70 -2.51 116.25 119.32 3a9t h VAL 269 Ca 0.26 -1.62 -0.10 0.00 0.82 0.00 0.00 66.70 66.06 3a9t h VAL 269 Cb 0.20 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3a9t h VAL 269 CO -0.02 0.53 -0.11 0.11 0.02 0.00 0.00 177.57 178.10 3a9t h LYS 270 N 0.63 0.87 -0.89 1.57 1.57 -0.94 -2.55 116.57 116.83 3a9t h LYS 270 Ca 0.04 -0.33 0.09 0.00 -1.87 0.00 0.00 60.65 58.58 3a9t h LYS 270 Cb 1.00 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 33.18 3a9t h LYS 270 CO 0.10 0.97 0.53 0.52 -0.57 0.00 0.00 179.45 181.00 3a9t h MET 271 N 0.71 0.87 -0.26 3.15 2.86 -0.52 0.47 114.93 122.22 3a9t h MET 271 Ca 0.12 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3a9t h MET 271 Cb 0.65 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 3a9t h MET 271 CO 0.04 0.58 0.16 0.00 1.06 0.00 0.00 176.91 178.75 3a9t h ALA 272 N 1.47 0.33 -0.33 6.32 0.00 -1.07 -0.82 119.26 125.15 3a9t h ALA 272 Ca 0.42 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 3a9t h ALA 272 Cb 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3a9t h ALA 272 CO -0.23 -0.16 0.13 -0.07 0.00 0.00 0.00 179.25 178.91 3a9t h LEU 273 N 0.32 0.46 -0.52 0.00 3.38 -0.96 -1.92 115.31 116.09 3a9t h LEU 273 Ca 0.09 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3a9t h LEU 273 Cb 0.02 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3a9t h LEU 273 CO -0.02 0.51 0.22 0.40 0.09 0.00 0.00 178.44 179.64 3a9t h ILE 274 N 0.39 1.21 -0.18 1.22 2.04 -0.82 0.13 117.51 121.49 3a9t h ILE 274 Ca 0.11 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.33 3a9t h ILE 274 Cb 0.20 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3a9t h ILE 274 CO -0.01 0.24 0.11 0.00 0.00 0.00 0.00 178.15 178.50 3a9t h ALA 275 N 1.06 0.23 -0.72 1.87 0.00 -1.07 -1.21 119.26 119.42 3a9t h ALA 275 Ca 0.17 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3a9t h ALA 275 Cb 0.18 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3a9t h ALA 275 CO -0.02 -0.28 0.19 -0.09 0.00 0.00 0.00 179.25 179.06 3a9t h ARG 276 N 0.23 1.14 -0.19 0.00 2.43 -1.13 -2.24 114.38 114.62 3a9t h ARG 276 Ca 0.07 -0.26 -0.03 0.00 -0.81 0.00 0.00 59.98 58.94 3a9t h ARG 276 Cb -0.00 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 3a9t h ARG 276 CO -0.01 0.99 -0.02 -0.44 -1.51 0.00 0.00 179.97 178.98 3a9t h ASP 277 N 1.08 0.25 -0.19 -3.80 3.32 -0.41 -2.06 116.42 114.61 3a9t h ASP 277 Ca 0.23 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.09 3a9t h ASP 277 Cb 0.35 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3a9t h ASP 277 CO -0.00 0.32 -0.43 -0.07 -1.72 0.00 0.00 179.24 177.34 3a9t h LEU 278 N 0.27 0.80 -0.11 1.55 3.38 -0.70 0.28 115.31 120.78 3a9t h LEU 278 Ca 0.06 -0.38 -0.13 0.00 0.09 0.00 0.00 57.88 57.52 3a9t h LEU 278 Cb 0.22 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.75 3a9t h LEU 278 CO 0.01 1.12 -0.46 0.24 0.09 0.00 0.00 178.44 179.44 3a9t h MET 279 N 0.60 0.50 0.00 1.13 2.86 -0.85 -0.23 114.93 118.94 3a9t h MET 279 Ca 0.04 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3a9t h MET 279 Cb 0.99 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.72 3a9t h MET 279 CO 0.09 1.02 -0.03 1.33 1.06 0.00 0.00 176.91 180.38 3a9t n VAL 280 N -4.27 0.83 -2.34 -2.22 0.24 -0.83 -0.98 118.33 108.77 3a9t n VAL 280 Ca -0.08 -0.88 0.04 0.00 -2.04 0.00 0.00 64.34 61.38 3a9t n VAL 280 Cb 0.57 0.51 -0.01 0.00 -1.47 0.00 0.00 33.84 33.44 3a9t n VAL 280 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3a9t n GLY 281 N -0.49 -1.90 3.15 7.63 0.00 0.99 -4.71 105.19 109.87 3a9t n GLY 281 Ca 0.02 -1.33 0.05 0.00 0.00 0.00 0.00 46.02 44.76 3a9t n GLY 281 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3a9t s ASN 282 N -4.03 -1.07 0.57 1.61 3.84 0.18 -4.50 114.94 111.54 3a9t s ASN 282 Ca 0.00 0.49 0.30 0.00 0.21 0.00 0.00 52.86 53.86 3a9t s ASN 282 Cb 0.00 1.83 1.46 0.00 -0.55 0.00 0.00 41.25 43.99 3a9t s ASN 282 CO 0.00 -0.20 1.88 0.50 -2.79 0.00 0.00 177.10 176.50 3a9t h LYS 283 N 7.92 0.00 -0.24 0.43 1.63 -1.93 0.13 116.57 124.51 3a9t h LYS 283 Ca -0.15 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.61 3a9t h LYS 283 Cb 1.17 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 3a9t h LYS 283 CO 0.10 0.00 -0.02 -0.22 -3.45 0.00 0.00 179.45 175.86 3a9t h LYS 284 N 0.00 0.37 -0.43 1.90 1.63 -1.95 -2.43 116.57 115.66 3a9t h LYS 284 Ca 0.31 -0.07 -0.05 0.00 -0.85 0.00 0.00 60.65 59.98 3a9t h LYS 284 Cb 1.42 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.97 3a9t h LYS 284 CO -0.00 0.41 0.04 -0.07 -3.45 0.00 0.00 179.45 176.38 3a9t h LEU 285 N 0.36 0.63 -0.26 5.20 3.38 -1.06 -2.67 115.31 120.90 3a9t h LEU 285 Ca 0.08 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3a9t h LEU 285 Cb 0.28 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3a9t h LEU 285 CO 0.01 0.68 0.13 -0.08 0.09 0.00 0.00 178.44 179.27 3a9t h GLU 286 N 0.64 0.36 -0.69 1.13 4.81 -1.51 -0.35 114.58 118.97 3a9t h GLU 286 Ca 0.14 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.39 3a9t h GLU 286 Cb 0.34 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 3a9t h GLU 286 CO 0.01 0.34 0.46 0.93 -0.73 0.00 0.00 179.01 180.01 3a9t h GLU 287 N 0.29 0.65 0.00 1.92 5.08 -1.48 0.46 114.58 121.51 3a9t h GLU 287 Ca 0.09 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3a9t h GLU 287 Cb 0.09 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3a9t h GLU 287 CO -0.01 0.43 0.00 -1.33 -1.00 0.00 0.00 179.01 177.10 3a9t n MET 288 N -4.48 0.70 -0.22 2.33 2.81 -0.87 -4.87 117.12 112.53 3a9t n MET 288 Ca 0.10 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 3a9t n MET 288 Cb 0.26 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 3a9t n MET 288 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a9t n GLY 289 N 0.62 0.89 2.73 3.03 0.00 0.15 -5.01 105.19 107.61 3a9t n GLY 289 Ca 0.17 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 3a9t n GLY 289 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a9t n TYR 290 N -2.22 3.64 -0.27 1.61 4.02 -0.20 -4.92 117.16 118.83 3a9t n TYR 290 Ca 0.00 -3.79 0.06 0.00 -0.01 0.00 0.00 57.90 54.17 3a9t n TYR 290 Cb 0.00 -0.65 0.29 0.00 -0.02 0.00 0.00 39.34 38.96 3a9t n TYR 290 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3a9t h GLY 291 N 3.72 1.22 0.76 2.72 0.00 -1.79 -0.83 103.07 108.87 3a9t h GLY 291 Ca 0.20 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 3a9t h GLY 291 CO 0.91 0.24 -0.02 -2.09 0.00 0.00 0.00 176.54 175.58 3a9t h GLU 292 N 0.90 0.26 -0.46 4.80 4.81 -1.95 -2.93 114.58 120.00 3a9t h GLU 292 Ca 0.38 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.54 3a9t h GLU 292 Cb 0.31 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3a9t h GLU 292 CO -0.15 0.52 0.31 0.93 -0.73 0.00 0.00 179.01 179.89 3a9t h GLU 293 N -0.04 0.56 -0.94 1.92 3.07 -1.86 -2.68 114.58 114.61 3a9t h GLU 293 Ca 0.04 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.93 3a9t h GLU 293 Cb 0.42 -0.13 -0.06 0.00 -0.84 0.00 0.00 28.75 28.14 3a9t h GLU 293 CO 0.01 0.37 0.61 0.00 -1.40 0.00 0.00 179.01 178.60 3a9t h ALA 294 N 1.72 1.48 -0.79 3.43 0.00 -0.97 -3.15 119.26 120.98 3a9t h ALA 294 Ca 0.18 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.17 3a9t h ALA 294 Cb 0.01 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 17.44 3a9t h ALA 294 CO -0.04 0.38 0.43 -0.07 0.00 0.00 0.00 179.25 179.95 3a9t h LEU 295 N 1.08 0.59 0.00 0.00 3.38 -1.46 0.53 115.31 119.44 3a9t h LEU 295 Ca 0.41 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.43 3a9t h LEU 295 Cb 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3a9t h LEU 295 CO -0.16 0.33 0.00 0.61 0.09 0.00 0.00 178.44 179.31 3a9t n GLY 296 N -1.32 -0.81 0.73 0.83 0.00 -1.19 -4.10 105.19 99.34 3a9t n GLY 296 Ca 0.13 -1.70 0.08 0.00 0.00 0.00 0.00 46.02 44.53 3a9t n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9t n ARG 297 N -0.82 2.80 -4.23 1.61 5.12 -0.10 -4.80 116.66 116.24 3a9t n ARG 297 Ca 0.00 -2.56 -0.32 0.00 -1.93 0.00 0.00 57.85 53.04 3a9t n ARG 297 Cb 0.00 -1.63 -0.06 0.00 -1.16 0.00 0.00 32.46 29.60 3a9t n ARG 297 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3a9t n ASN 298 N -0.29 -0.38 -4.65 0.55 5.15 -1.07 -4.51 115.26 110.06 3a9t n ASN 298 Ca 0.18 -1.16 -0.36 0.00 -0.60 0.00 0.00 54.58 52.64 3a9t n ASN 298 Cb 0.72 -2.18 -0.10 0.00 -0.53 0.00 0.00 39.78 37.69 3a9t n ASN 298 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3a9t s ALA 299 N -3.96 3.55 -2.66 5.20 0.00 -0.15 -1.09 121.76 122.65 3a9t s ALA 299 Ca 0.22 -0.86 0.24 0.00 0.00 0.00 0.00 51.96 51.56 3a9t s ALA 299 Cb -0.12 -2.21 0.53 0.00 0.00 0.00 0.00 23.12 21.32 3a9t s ALA 299 CO 0.96 -0.10 1.45 1.51 0.00 0.00 0.00 175.76 179.58 3a9t n ILE 300 N 4.10 0.14 -3.64 0.00 3.06 -0.95 -4.64 119.36 117.44 3a9t n ILE 300 Ca -0.15 -0.47 -0.10 0.00 -2.50 0.00 0.00 62.75 59.52 3a9t n ILE 300 Cb 0.52 0.97 -0.07 0.00 0.54 0.00 0.00 39.64 41.60 3a9t n ILE 300 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 3a9t s VAL 301 N -1.86 0.00 0.35 9.51 0.11 -1.24 -4.40 120.40 122.87 3a9t s VAL 301 Ca 0.33 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.38 3a9t s VAL 301 Cb 0.20 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 34.05 3a9t s VAL 301 CO 0.31 0.00 0.44 0.00 -3.33 0.00 0.00 175.10 172.52 3a9t s ALA 302 N 0.39 1.03 0.06 1.54 0.00 -0.91 -1.56 121.76 122.30 3a9t s ALA 302 Ca 0.01 -1.65 -0.12 0.00 0.00 0.00 0.00 51.96 50.20 3a9t s ALA 302 Cb -0.05 1.22 0.01 0.00 0.00 0.00 0.00 23.12 24.30 3a9t s ALA 302 CO -0.05 -0.77 0.26 0.20 0.00 0.00 0.00 175.76 175.41 3a9t s GLY 303 N -3.27 -0.05 -0.19 0.00 0.00 -0.59 0.16 107.32 103.38 3a9t s GLY 303 Ca 0.33 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.82 3a9t s GLY 303 CO 0.22 -0.42 -0.03 -0.12 0.00 0.00 0.00 173.10 172.76 3a9t s PHE 304 N -2.98 1.67 0.01 1.90 5.36 -0.13 -1.78 117.98 122.03 3a9t s PHE 304 Ca -0.02 -1.17 -0.03 0.00 -0.96 0.00 0.00 56.93 54.76 3a9t s PHE 304 Cb 0.01 -1.29 -0.01 0.00 -0.34 0.00 0.00 43.02 41.39 3a9t s PHE 304 CO -0.06 -0.65 1.04 0.37 -1.46 0.00 0.00 175.22 174.47 3a9t h GLN 305 N 8.12 -0.04 0.00 10.12 4.15 -1.45 -1.03 115.11 134.98 3a9t h GLN 305 Ca -0.20 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.22 3a9t h GLN 305 Cb 1.10 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.80 3a9t h GLN 305 CO 0.38 -0.02 0.00 0.41 -1.93 0.00 0.00 178.83 177.67 3a9t n GLY 306 N -1.03 1.77 3.77 2.39 0.00 -1.26 -3.58 105.19 107.25 3a9t n GLY 306 Ca -0.00 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 3a9t n GLY 306 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a9t s GLN 307 N 0.00 3.83 -0.21 1.61 -0.21 -1.26 -1.71 119.66 121.71 3a9t s GLN 307 Ca 0.00 1.72 -0.04 0.00 0.02 0.00 0.00 55.36 57.06 3a9t s GLN 307 Cb 0.00 -2.42 -0.20 0.00 1.00 0.00 0.00 33.01 31.39 3a9t s GLN 307 CO 0.00 -0.48 -0.01 0.54 -2.12 0.00 0.00 175.29 173.22 3a9t n ARG 308 N -0.43 0.68 -0.30 2.91 5.12 -1.26 -4.19 116.66 119.19 3a9t n ARG 308 Ca 0.07 0.22 -0.08 0.00 -1.93 0.00 0.00 57.85 56.13 3a9t n ARG 308 Cb 0.48 -1.60 -0.07 0.00 -1.16 0.00 0.00 32.46 30.12 3a9t n ARG 308 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3a9t n GLN 309 N -3.48 -0.31 -0.02 5.56 3.00 -1.25 -1.54 117.38 119.35 3a9t n GLN 309 Ca -0.41 1.19 -0.13 0.00 -0.01 0.00 0.00 57.00 57.64 3a9t n GLN 309 Cb 0.99 -1.76 -0.09 0.00 0.00 0.00 0.00 30.24 29.38 3a9t n GLN 309 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.06 179.41 3a9t h TRP 310 N 0.00 0.08 0.00 1.08 2.91 -1.66 -3.20 115.95 115.17 3a9t h TRP 310 Ca 0.11 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.11 3a9t h TRP 310 Cb 0.29 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 28.92 3a9t h TRP 310 CO -0.85 0.49 0.00 1.79 -1.03 0.00 0.00 178.44 178.84 3a9t h THR 311 N -0.35 0.00 0.00 2.65 1.35 -1.39 0.24 112.91 115.41 3a9t h THR 311 Ca 0.01 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 3a9t h THR 311 Cb 0.47 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 3a9t h THR 311 CO 0.01 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.75 3a9t n ASP 312 N -2.70 0.00 0.00 5.36 8.00 -0.59 -0.97 116.55 125.66 3a9t n ASP 312 Ca -0.00 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.33 3a9t n ASP 312 Cb 0.19 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 3a9t n ASP 312 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a9t n TYR 313 N -1.21 0.00 -3.55 1.24 4.19 -0.89 -4.46 117.16 112.47 3a9t n TYR 313 Ca 0.11 0.00 -0.21 0.00 3.31 0.00 0.00 57.90 61.12 3a9t n TYR 313 Cb 0.14 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 39.94 3a9t n TYR 313 CO 0.00 0.00 0.00 -0.06 0.91 0.00 0.00 176.86 177.71 3a9t s PHE 314 N -1.00 2.74 0.30 2.98 0.08 0.02 -4.45 117.98 118.65 3a9t s PHE 314 Ca 0.00 -0.47 -0.29 0.00 0.12 0.00 0.00 56.93 56.29 3a9t s PHE 314 Cb 0.00 -2.15 -0.11 0.00 -0.57 0.00 0.00 43.02 40.19 3a9t s PHE 314 CO 0.00 -0.11 1.44 -2.14 -0.10 0.00 0.00 175.22 174.31 3a9t s PRO 315 N -4.13 4.23 1.20 0.24 0.02 -0.94 -3.79 135.00 131.83 3a9t s PRO 315 Ca 0.48 2.38 -0.15 0.00 0.02 0.00 0.00 61.00 63.73 3a9t s PRO 315 Cb -0.04 -3.06 0.29 0.00 0.02 0.00 0.00 34.50 31.71 3a9t s PRO 315 CO 0.28 -0.42 1.03 0.54 -0.33 0.00 0.00 177.00 178.09 3a9t s ASN 316 N 0.08 0.80 -0.08 2.53 2.20 -0.38 -4.86 114.94 115.23 3a9t s ASN 316 Ca 0.56 1.20 0.09 0.00 -0.94 0.00 0.00 52.86 53.77 3a9t s ASN 316 Cb -0.43 -1.83 0.41 0.00 -2.00 0.00 0.00 41.25 37.40 3a9t s ASN 316 CO 0.50 -4.27 1.22 0.61 -2.94 0.00 0.00 177.10 172.22 3a9t n GLY 317 N 0.36 1.80 0.36 0.45 0.00 -1.26 -4.56 105.19 102.35 3a9t n GLY 317 Ca 0.06 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 3a9t n GLY 317 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3a9t h ASP 318 N 2.22 -1.05 -0.41 1.61 3.32 -1.87 0.30 116.42 120.53 3a9t h ASP 318 Ca 0.00 0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.21 3a9t h ASP 318 Cb 1.03 0.41 -0.03 0.00 0.22 0.00 0.00 39.33 40.96 3a9t h ASP 318 CO 0.17 -0.42 0.22 0.15 -1.72 0.00 0.00 179.24 177.64 3a9t h PHE 319 N -0.53 0.40 -0.02 4.55 3.04 -1.80 0.23 116.94 122.81 3a9t h PHE 319 Ca 0.05 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.04 3a9t h PHE 319 Cb 0.60 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.96 3a9t h PHE 319 CO -0.35 0.22 -0.10 1.98 -2.02 0.00 0.00 178.31 178.04 3a9t h MET 320 N 0.44 -0.15 0.00 1.11 4.05 -1.67 0.20 114.93 118.90 3a9t h MET 320 Ca 0.17 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.54 3a9t h MET 320 Cb 0.06 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.89 3a9t h MET 320 CO -0.11 -0.10 -0.29 0.93 0.23 0.00 0.00 176.91 177.57 3a9t h GLU 321 N -0.16 0.00 0.03 0.39 5.08 -0.12 -1.64 114.58 118.15 3a9t h GLU 321 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3a9t h GLU 321 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3a9t h GLU 321 CO -0.12 0.29 -0.01 1.15 -1.00 0.00 0.00 179.01 179.32 3a9t h THR 322 N 0.00 1.44 -0.43 1.13 2.02 -0.03 -3.22 112.91 113.81 3a9t h THR 322 Ca -0.00 -1.74 -0.10 0.00 0.77 0.00 0.00 66.41 65.33 3a9t h THR 322 Cb 0.51 2.56 -0.01 0.00 -1.74 0.00 0.00 68.15 69.47 3a9t h THR 322 CO 0.04 0.43 -0.14 -0.29 0.37 0.00 0.00 175.52 175.93 3a9t h ILE 323 N -0.83 1.27 -0.64 3.11 6.09 -0.61 -2.75 117.51 123.16 3a9t h ILE 323 Ca -0.00 -1.26 0.01 0.00 -1.37 0.00 0.00 64.86 62.24 3a9t h ILE 323 Cb 0.73 1.19 -0.03 0.00 0.47 0.00 0.00 36.82 39.17 3a9t h ILE 323 CO 0.01 0.43 0.42 -0.07 -3.07 0.00 0.00 178.15 175.86 3a9t h LEU 324 N 0.68 0.71 -0.89 2.19 4.07 -1.45 -2.22 115.31 118.39 3a9t h LEU 324 Ca 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.05 3a9t h LEU 324 Cb 0.68 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 42.25 3a9t h LEU 324 CO 0.05 0.51 0.00 0.78 -1.08 0.00 0.00 178.44 178.70 3a9t h ASN 325 N 0.84 0.00 -4.15 -0.43 2.35 -1.56 -0.65 115.58 111.98 3a9t h ASN 325 Ca 0.24 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.50 3a9t h ASN 325 Cb -0.07 0.00 0.14 0.00 0.05 0.00 0.00 38.32 38.44 3a9t h ASN 325 CO -0.06 0.00 0.28 -0.44 -1.65 0.00 0.00 177.43 175.55 3a9t s SER 326 N -5.46 3.81 -0.30 5.81 0.01 -0.84 -4.54 113.70 112.20 3a9t s SER 326 Ca 0.04 1.52 0.06 0.00 1.31 0.00 0.00 55.95 58.87 3a9t s SER 326 Cb 0.08 -2.21 0.57 0.00 0.21 0.00 0.00 66.02 64.67 3a9t s SER 326 CO 0.55 -2.43 1.65 -1.54 0.41 0.00 0.00 173.24 171.89 3a9t n SER 327 N -3.75 3.96 0.00 2.44 3.41 -1.26 -4.24 113.62 114.18 3a9t n SER 327 Ca 0.07 -3.11 0.00 0.00 -0.26 0.00 0.00 58.87 55.58 3a9t n SER 327 Cb 0.55 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 3a9t n SER 327 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3a9t n PHE 328 N -0.40 0.00 -2.52 7.33 1.16 -1.26 -2.54 117.46 119.24 3a9t n PHE 328 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.98 3a9t n PHE 328 Cb 1.30 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 39.17 3a9t n PHE 328 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 3a9t n ASP 329 N 0.00 0.00 0.07 5.98 5.68 -0.75 -4.97 116.55 122.56 3a9t n ASP 329 Ca 0.00 -0.36 0.03 0.00 -0.50 0.00 0.00 54.79 53.96 3a9t n ASP 329 Cb 0.00 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.16 3a9t n ASP 329 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 3a9t n TRP 330 N 0.00 0.23 -0.49 2.11 2.14 -1.26 0.45 117.44 120.62 3a9t n TRP 330 Ca 0.00 0.12 0.09 0.00 2.07 0.00 0.00 57.50 59.78 3a9t n TRP 330 Cb 0.00 -0.55 0.29 0.00 -0.81 0.00 0.00 31.31 30.24 3a9t n TRP 330 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 3a9t n ASN 331 N -1.68 4.01 0.00 -0.67 3.02 -1.26 -4.95 115.26 113.72 3a9t n ASN 331 Ca -0.00 -2.30 0.00 0.00 -0.03 0.00 0.00 54.58 52.25 3a9t n ASN 331 Cb 0.19 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 3a9t n ASN 331 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a9t n GLY 332 N 0.89 -1.84 3.77 7.41 0.00 0.17 -4.91 105.19 110.68 3a9t n GLY 332 Ca 0.21 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 3a9t n GLY 332 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a9t s LYS 333 N 0.00 4.37 0.18 1.61 -2.85 -1.26 -1.82 119.74 119.98 3a9t s LYS 333 Ca 0.00 1.98 -0.23 0.00 -1.00 0.00 0.00 55.97 56.71 3a9t s LYS 333 Cb 0.00 -3.00 0.05 0.00 -2.06 0.00 0.00 37.83 32.82 3a9t s LYS 333 CO 0.00 -0.09 0.72 -0.98 0.10 0.00 0.00 175.35 175.10 3a9t s ARG 334 N -1.82 1.41 0.76 1.78 1.70 -1.05 -4.94 118.95 116.78 3a9t s ARG 334 Ca 0.50 -0.67 -0.14 0.00 -0.47 0.00 0.00 55.73 54.95 3a9t s ARG 334 Cb -0.35 0.55 0.05 0.00 -0.57 0.00 0.00 34.95 34.64 3a9t s ARG 334 CO 0.45 -0.63 1.18 0.00 -1.08 0.00 0.00 175.30 175.22 3a9t s ALA 335 N -3.68 2.05 0.92 7.88 0.00 -1.26 -4.23 121.76 123.43 3a9t s ALA 335 Ca 0.07 0.77 -0.15 0.00 0.00 0.00 0.00 51.96 52.65 3a9t s ALA 335 Cb -0.03 -3.44 0.16 0.00 0.00 0.00 0.00 23.12 19.81 3a9t s ALA 335 CO -0.03 -1.97 1.27 -2.14 0.00 0.00 0.00 175.76 172.89 3a9t s PRO 336 N -4.10 1.03 -0.31 0.00 0.02 -1.26 -4.86 135.00 125.51 3a9t s PRO 336 Ca 0.72 -0.23 0.02 0.00 0.02 0.00 0.00 61.00 61.53 3a9t s PRO 336 Cb -0.27 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.47 3a9t s PRO 336 CO 0.48 -2.18 0.04 0.71 -0.33 0.00 0.00 177.00 175.71 3a9t s TYR 337 N -3.76 2.85 -0.23 6.54 2.02 -0.25 -5.01 117.35 119.51 3a9t s TYR 337 Ca 0.70 -2.36 -0.31 0.00 -0.37 0.00 0.00 57.07 54.73 3a9t s TYR 337 Cb -0.06 -2.27 -0.08 0.00 -0.40 0.00 0.00 41.96 39.15 3a9t s TYR 337 CO 0.52 -0.89 2.16 -0.89 -1.57 0.00 0.00 175.55 174.87 3a9t n ILE 338 N 4.52 0.35 -4.23 2.71 2.08 -1.26 -3.64 119.36 119.90 3a9t n ILE 338 Ca -0.01 -0.34 -0.26 0.00 0.56 0.00 0.00 62.75 62.69 3a9t n ILE 338 Cb 0.42 -2.19 -0.17 0.00 -0.75 0.00 0.00 39.64 36.95 3a9t n ILE 338 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 3a9t s PHE 339 N 7.27 1.55 -0.15 1.39 2.19 -1.26 -2.15 117.98 126.82 3a9t s PHE 339 Ca 1.02 -0.70 -0.18 0.00 0.33 0.00 0.00 56.93 57.40 3a9t s PHE 339 Cb -0.54 -1.20 -0.04 0.00 -1.31 0.00 0.00 43.02 39.93 3a9t s PHE 339 CO 0.42 -0.43 0.48 0.00 1.83 0.00 0.00 175.22 177.52 3a9t s ALA 340 N 1.22 3.51 0.44 11.12 0.00 0.12 -4.93 121.76 133.24 3a9t s ALA 340 Ca -0.04 -0.29 -0.23 0.00 0.00 0.00 0.00 51.96 51.40 3a9t s ALA 340 Cb -0.14 -2.69 -0.08 0.00 0.00 0.00 0.00 23.12 20.22 3a9t s ALA 340 CO -0.03 -0.15 1.15 0.99 0.00 0.00 0.00 175.76 177.72 3a9t s THR 341 N 0.98 3.19 -1.31 0.00 2.01 -1.26 -0.96 115.64 118.29 3a9t s THR 341 Ca 0.24 0.91 0.00 0.00 0.31 0.00 0.00 61.69 63.15 3a9t s THR 341 Cb -0.15 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 68.89 3a9t s THR 341 CO 0.10 0.00 0.00 -0.62 -0.69 0.00 0.00 174.62 173.41 3a9t n GLU 342 N -0.37 -1.90 -2.86 4.92 1.02 -0.50 -2.01 120.64 118.94 3a9t n GLU 342 Ca 0.07 0.74 -0.17 0.00 -0.02 0.00 0.00 57.16 57.77 3a9t n GLU 342 Cb 0.48 -5.27 -0.00 0.00 -0.02 0.00 0.00 31.44 26.63 3a9t n GLU 342 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3a9t n ASN 343 N -1.56 -3.87 -4.57 1.62 5.15 -0.58 -4.35 115.26 107.11 3a9t n ASN 343 Ca -0.17 -0.07 -0.41 0.00 -0.60 0.00 0.00 54.58 53.33 3a9t n ASN 343 Cb 0.59 -3.24 -0.02 0.00 -0.53 0.00 0.00 39.78 36.58 3a9t n ASN 343 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3a9t s ASP 344 N -2.36 6.58 0.50 1.20 -1.08 -0.85 -4.11 116.67 116.54 3a9t s ASP 344 Ca 0.18 -1.72 0.15 0.00 -0.52 0.00 0.00 52.55 50.65 3a9t s ASP 344 Cb -0.10 -2.57 1.19 0.00 -1.46 0.00 0.00 42.92 39.99 3a9t s ASP 344 CO 0.23 -1.43 2.11 -0.55 0.52 0.00 0.00 175.17 176.05 3a9t h ASN 345 N 9.19 0.01 -0.03 -0.34 7.08 -1.62 -1.59 115.58 128.29 3a9t h ASN 345 Ca 0.27 -0.00 -0.11 0.00 -3.08 0.00 0.00 56.30 53.38 3a9t h ASN 345 Cb 0.97 -0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.19 3a9t h ASN 345 CO 1.44 0.05 -0.30 -0.07 -2.08 0.00 0.00 177.43 176.47 3a9t h LEU 346 N 0.02 0.49 -0.31 6.14 3.38 -1.87 -0.56 115.31 122.59 3a9t h LEU 346 Ca 0.00 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.63 3a9t h LEU 346 Cb 0.08 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3a9t h LEU 346 CO 0.00 0.77 -0.75 -1.13 0.09 0.00 0.00 178.44 177.42 3a9t h ASN 347 N 0.42 0.00 -0.42 -0.43 -1.24 -1.68 -1.84 115.58 110.39 3a9t h ASN 347 Ca 0.05 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.05 3a9t h ASN 347 Cb 0.74 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.77 3a9t h ASN 347 CO 0.06 0.75 0.20 1.23 -1.29 0.00 0.00 177.43 178.38 3a9t h GLY 348 N 2.66 0.65 1.52 1.57 0.00 -0.67 0.21 103.07 109.01 3a9t h GLY 348 Ca -0.01 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 3a9t h GLY 348 CO 0.10 0.31 -0.25 -2.22 0.00 0.00 0.00 176.54 174.47 3a9t h ILE 349 N 0.53 1.27 -0.19 2.60 1.08 -1.04 0.93 117.51 122.70 3a9t h ILE 349 Ca 0.14 -1.31 0.01 0.00 -0.39 0.00 0.00 64.86 63.32 3a9t h ILE 349 Cb 0.13 1.33 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 3a9t h ILE 349 CO -0.02 0.42 0.10 0.28 -0.69 0.00 0.00 178.15 178.24 3a9t h SER 350 N 0.49 0.16 -0.34 1.72 0.02 -0.75 0.16 113.55 114.99 3a9t h SER 350 Ca 0.07 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 3a9t h SER 350 Cb 0.70 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 3a9t h SER 350 CO 0.05 0.12 0.09 0.24 -1.14 0.00 0.00 176.83 176.20 3a9t h MET 351 N 0.21 0.54 -0.75 3.45 2.86 -0.72 -2.81 114.93 117.72 3a9t h MET 351 Ca 0.07 -0.12 0.05 0.00 -2.06 0.00 0.00 59.70 57.64 3a9t h MET 351 Cb 0.01 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 3a9t h MET 351 CO -0.04 0.59 0.49 1.25 1.06 0.00 0.00 176.91 180.26 3a9t h LEU 352 N 0.40 0.74 0.51 1.22 5.85 -0.32 0.42 115.31 124.14 3a9t h LEU 352 Ca 0.11 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3a9t h LEU 352 Cb 0.28 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 3a9t h LEU 352 CO -0.00 0.50 -0.31 -0.26 -0.34 0.00 0.00 178.44 178.02 3a9t h PHE 353 N 0.86 -0.84 -0.24 1.25 0.05 -0.45 -0.82 116.94 116.75 3a9t h PHE 353 Ca 0.31 -0.01 0.05 0.00 3.82 0.00 0.00 57.97 62.15 3a9t h PHE 353 Cb 0.15 0.30 -0.01 0.00 2.00 0.00 0.00 35.95 38.39 3a9t h PHE 353 CO -0.00 -0.47 0.17 0.78 -0.18 0.00 0.00 178.31 178.61 3a9t h GLY 354 N -0.77 0.09 0.95 -1.45 0.00 -1.34 -2.22 103.07 98.33 3a9t h GLY 354 Ca -0.07 -0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 3a9t h GLY 354 CO 0.07 0.02 -0.22 -1.82 0.00 0.00 0.00 176.54 174.60 3a9t h TYR 355 N 0.08 0.79 0.00 5.60 5.03 -0.69 -2.15 116.97 125.64 3a9t h TYR 355 Ca 0.11 -0.22 0.00 0.00 2.58 0.00 0.00 58.73 61.20 3a9t h TYR 355 Cb 0.35 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.45 3a9t h TYR 355 CO -0.00 0.94 0.00 1.28 -1.32 0.00 0.00 178.16 179.06 3a9t n LEU 356 N -4.32 0.55 0.01 2.82 4.77 -0.33 0.82 117.00 121.31 3a9t n LEU 356 Ca -0.03 0.62 0.11 0.00 -0.03 0.00 0.00 56.01 56.67 3a9t n LEU 356 Cb 0.43 -0.52 -0.07 0.00 -2.33 0.00 0.00 43.42 40.93 3a9t n LEU 356 CO 0.43 -0.42 -0.17 0.18 -1.33 0.00 0.00 177.39 176.08 3a9t n LEU 357 N -2.08 0.62 0.00 2.23 4.77 -0.96 -4.51 117.00 117.06 3a9t n LEU 357 Ca 0.03 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 3a9t n LEU 357 Cb 0.26 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3a9t n LEU 357 CO 0.21 0.12 -0.15 0.35 -1.33 0.00 0.00 177.39 176.59 3a9t n THR 358 N -1.84 0.00 -1.47 -5.08 -2.24 -0.82 -5.02 114.28 97.81 3a9t n THR 358 Ca 0.02 -0.04 -0.13 0.00 -2.27 0.00 0.00 64.05 61.62 3a9t n THR 358 Cb 0.42 0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 3a9t n THR 358 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3a9t n ASN 359 N -0.53 -4.50 -4.50 3.42 3.02 0.24 -4.75 115.26 107.67 3a9t n ASN 359 Ca 0.00 0.28 -0.26 0.00 -0.03 0.00 0.00 54.58 54.58 3a9t n ASN 359 Cb 0.00 -3.20 -0.10 0.00 -0.61 0.00 0.00 39.78 35.87 3a9t n ASN 359 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3a9t s THR 360 N -2.50 2.71 0.46 3.41 -4.23 -1.25 -4.18 115.64 110.06 3a9t s THR 360 Ca 0.00 -2.04 -0.25 0.00 -1.18 0.00 0.00 61.69 58.23 3a9t s THR 360 Cb 0.00 -2.37 -0.08 0.00 1.34 0.00 0.00 72.50 71.39 3a9t s THR 360 CO 0.00 -0.22 1.33 0.00 -0.54 0.00 0.00 174.62 175.19 3a9t n ALA 361 N -0.17 1.57 -2.56 3.99 0.00 -1.26 -4.52 120.51 117.56 3a9t n ALA 361 Ca -0.09 0.23 -0.32 0.00 0.00 0.00 0.00 53.44 53.26 3a9t n ALA 361 Cb 0.57 -2.32 -0.11 0.00 0.00 0.00 0.00 19.45 17.59 3a9t n ALA 361 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3a9t s GLN 362 N -2.42 2.40 -0.28 0.00 -1.52 -1.26 -4.71 119.66 111.87 3a9t s GLN 362 Ca 0.63 -0.81 -0.11 0.00 -1.95 0.00 0.00 55.36 53.12 3a9t s GLN 362 Cb -0.47 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 29.87 3a9t s GLN 362 CO 0.56 0.58 0.19 0.42 -0.25 0.00 0.00 175.29 176.79 3a9t s ILE 363 N -0.99 5.31 0.01 1.08 -1.09 -0.15 -4.57 121.20 120.80 3a9t s ILE 363 Ca 0.17 0.17 -0.25 0.00 -2.23 0.00 0.00 60.65 58.51 3a9t s ILE 363 Cb -0.11 -3.52 -0.05 0.00 -1.58 0.00 0.00 42.46 37.20 3a9t s ILE 363 CO 0.07 0.26 0.75 0.12 -1.23 0.00 0.00 174.94 174.92 3a9t s PHE 364 N 1.68 3.69 0.13 3.97 2.19 -1.26 -0.60 117.98 127.78 3a9t s PHE 364 Ca 0.07 1.42 -0.24 0.00 0.33 0.00 0.00 56.93 58.51 3a9t s PHE 364 Cb -0.16 -2.82 0.07 0.00 -1.31 0.00 0.00 43.02 38.81 3a9t s PHE 364 CO 0.10 0.22 0.66 0.00 1.83 0.00 0.00 175.22 178.04 3a9t s ALA 365 N 0.18 -1.63 0.10 11.12 0.00 -1.08 -4.30 121.76 126.16 3a9t s ALA 365 Ca 0.39 0.56 -0.09 0.00 0.00 0.00 0.00 51.96 52.82 3a9t s ALA 365 Cb -0.20 0.79 -0.06 0.00 0.00 0.00 0.00 23.12 23.66 3a9t s ALA 365 CO 0.22 -0.77 0.40 -0.51 0.00 0.00 0.00 175.76 175.10 3a9t s ASP 366 N -2.70 6.61 -0.97 0.00 -0.00 -1.22 -1.74 116.67 116.64 3a9t s ASP 366 Ca 0.02 0.76 -0.15 0.00 -0.00 0.00 0.00 52.55 53.18 3a9t s ASP 366 Cb -0.01 -2.16 0.19 0.00 -0.00 0.00 0.00 42.92 40.93 3a9t s ASP 366 CO -0.11 0.14 1.07 -0.69 -0.00 0.00 0.00 175.17 175.58 3a9t s VAL 367 N -1.46 5.24 -0.09 -1.27 1.01 -0.28 -1.35 120.40 122.19 3a9t s VAL 367 Ca 0.35 -2.30 -0.23 0.00 0.00 0.00 0.00 61.98 59.80 3a9t s VAL 367 Cb -0.13 -4.68 -0.19 0.00 0.00 0.00 0.00 36.38 31.37 3a9t s VAL 367 CO 0.19 -1.34 0.80 -0.09 0.00 0.00 0.00 175.10 174.67 3a9t h ARG 368 N 7.91 -0.06 -3.22 2.72 9.65 -1.43 -3.49 114.38 126.46 3a9t h ARG 368 Ca 0.17 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.90 3a9t h ARG 368 Cb 0.98 0.01 -0.24 0.00 -1.39 0.00 0.00 29.97 29.33 3a9t h ARG 368 CO 1.01 0.59 -0.44 0.99 2.80 0.00 0.00 179.97 184.93 3a9t s THR 369 N -2.82 0.02 -0.27 0.20 2.01 -1.19 -4.98 115.64 108.62 3a9t s THR 369 Ca -0.15 -0.19 -0.09 0.00 0.31 0.00 0.00 61.69 61.58 3a9t s THR 369 Cb -0.01 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 3a9t s THR 369 CO 0.56 -0.10 0.12 -0.47 -0.69 0.00 0.00 174.62 174.04 3a9t s TYR 370 N -0.33 3.14 -0.37 4.92 5.04 -1.26 0.24 117.35 128.73 3a9t s TYR 370 Ca -0.04 -0.22 -0.11 0.00 -2.44 0.00 0.00 57.07 54.26 3a9t s TYR 370 Cb -0.03 -2.30 0.03 0.00 0.35 0.00 0.00 41.96 40.00 3a9t s TYR 370 CO 0.01 -0.29 0.20 -1.58 -1.34 0.00 0.00 175.55 172.56 3a9t s TRP 371 N 1.67 3.24 0.64 4.97 0.52 0.59 -5.01 118.94 125.56 3a9t s TRP 371 Ca 0.07 -0.94 -0.11 0.00 0.02 0.00 0.00 56.10 55.14 3a9t s TRP 371 Cb -0.16 -2.43 -0.02 0.00 -1.15 0.00 0.00 33.47 29.71 3a9t s TRP 371 CO 0.07 -0.63 1.03 -1.54 0.02 0.00 0.00 176.95 175.90 3a9t s SER 372 N 1.56 5.97 0.30 2.95 1.04 -1.26 -1.61 113.70 122.64 3a9t s SER 372 Ca 0.02 1.28 0.00 0.00 0.48 0.00 0.00 55.95 57.74 3a9t s SER 372 Cb -0.19 -2.27 0.46 0.00 0.10 0.00 0.00 66.02 64.12 3a9t s SER 372 CO 0.07 -1.00 1.84 -0.65 0.98 0.00 0.00 173.24 174.47 3a9t h PRO 373 N -0.39 0.73 -0.84 4.02 0.11 -1.86 -1.63 132.00 132.14 3a9t h PRO 373 Ca -0.44 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 65.48 3a9t h PRO 373 Cb 1.21 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 3a9t h PRO 373 CO 0.62 0.69 0.39 1.49 -0.21 0.00 0.00 178.00 180.98 3a9t h GLU 374 N 0.70 1.23 -0.25 1.05 4.22 -1.97 -0.79 114.58 118.78 3a9t h GLU 374 Ca 0.15 -0.19 -0.05 0.00 0.08 0.00 0.00 59.36 59.35 3a9t h GLU 374 Cb 0.32 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3a9t h GLU 374 CO 0.00 0.95 -0.05 0.00 -2.18 0.00 0.00 179.01 177.74 3a9t h ALA 375 N 1.21 0.34 -0.18 2.92 0.00 -1.82 -1.83 119.26 119.91 3a9t h ALA 375 Ca 0.29 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3a9t h ALA 375 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3a9t h ALA 375 CO -0.03 0.13 -0.26 0.28 0.00 0.00 0.00 179.25 179.37 3a9t h VAL 376 N 0.22 1.25 -0.32 0.00 2.07 -1.15 -1.05 116.25 117.28 3a9t h VAL 376 Ca 0.06 -1.20 -0.13 0.00 0.82 0.00 0.00 66.70 66.26 3a9t h VAL 376 Cb 0.51 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 3a9t h VAL 376 CO 0.02 0.37 -0.34 0.50 0.02 0.00 0.00 177.57 178.15 3a9t h LYS 377 N 0.30 0.70 0.01 1.57 1.63 -1.01 0.51 116.57 120.27 3a9t h LYS 377 Ca 0.05 -0.33 -0.00 0.00 -0.85 0.00 0.00 60.65 59.52 3a9t h LYS 377 Cb 0.62 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.24 3a9t h LYS 377 CO 0.04 0.93 -0.01 -0.09 -3.45 0.00 0.00 179.45 176.88 3a9t h ARG 378 N 0.59 -0.02 0.00 1.90 2.43 -0.96 0.18 114.38 118.50 3a9t h ARG 378 Ca 0.06 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 3a9t h ARG 378 Cb 0.85 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 3a9t h ARG 378 CO 0.07 0.48 -0.42 0.28 -1.51 0.00 0.00 179.97 178.88 3a9t h VAL 379 N -0.53 0.99 0.00 0.20 2.07 -1.19 -3.37 116.25 114.42 3a9t h VAL 379 Ca -0.00 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.88 3a9t h VAL 379 Cb 0.51 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 3a9t h VAL 379 CO 0.00 0.41 -0.77 0.35 0.02 0.00 0.00 177.57 177.59 3a9t n THR 380 N -3.58 0.00 -0.99 2.57 -2.24 0.16 -5.00 114.28 105.20 3a9t n THR 380 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3a9t n THR 380 Cb 0.53 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 3a9t n THR 380 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a9t n GLY 381 N 1.93 0.72 3.82 3.38 0.00 0.63 -5.01 105.19 110.67 3a9t n GLY 381 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3a9t n GLY 381 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3a9t s TYR 382 N -2.88 3.50 -0.25 1.61 6.14 -1.26 -4.96 117.35 119.25 3a9t s TYR 382 Ca 0.00 0.44 -0.15 0.00 0.64 0.00 0.00 57.07 58.00 3a9t s TYR 382 Cb 0.00 -1.94 -0.04 0.00 0.42 0.00 0.00 41.96 40.40 3a9t s TYR 382 CO 0.00 0.63 0.35 0.99 0.64 0.00 0.00 175.55 178.17 3a9t s THR 383 N -0.82 5.20 0.21 4.34 2.01 -1.26 -3.60 115.64 121.72 3a9t s THR 383 Ca 0.14 0.56 -0.31 0.00 0.31 0.00 0.00 61.69 62.38 3a9t s THR 383 Cb -0.12 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.60 3a9t s THR 383 CO 0.03 0.20 1.61 -0.76 -0.69 0.00 0.00 174.62 175.01 3a9t s LEU 384 N 1.79 4.37 0.00 4.42 1.43 -1.26 -5.01 118.68 124.41 3a9t s LEU 384 Ca 0.15 2.77 0.01 0.00 -1.03 0.00 0.00 54.13 56.03 3a9t s LEU 384 Cb -0.15 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.47 3a9t s LEU 384 CO 0.09 -0.88 0.08 -0.62 0.23 0.00 0.00 176.35 175.26 3a9t n GLU 385 N 3.42 0.75 0.00 1.70 1.02 -1.26 -3.98 120.64 122.29 3a9t n GLU 385 Ca 0.13 -3.65 0.00 0.00 -0.02 0.00 0.00 57.16 53.62 3a9t n GLU 385 Cb 0.37 0.86 0.00 0.00 -0.02 0.00 0.00 31.44 32.66 3a9t n GLU 385 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3a9t n GLY 386 N -1.18 1.70 0.33 0.62 0.00 -1.26 -1.33 105.19 104.08 3a9t n GLY 386 Ca -0.17 -0.43 0.21 0.00 0.00 0.00 0.00 46.02 45.63 3a9t n GLY 386 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3a9t h ARG 387 N 0.00 0.00 0.00 1.61 3.08 -1.99 -0.41 114.38 116.67 3a9t h ARG 387 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3a9t h ARG 387 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3a9t h ARG 387 CO 0.00 0.00 -0.27 0.00 -1.07 0.00 0.00 179.97 178.63 3a9t n ALA 388 N -2.03 2.90 -0.01 0.04 0.00 -0.44 -4.26 120.51 116.71 3a9t n ALA 388 Ca -0.03 -0.22 0.23 0.00 0.00 0.00 0.00 53.44 53.42 3a9t n ALA 388 Cb 0.13 -1.29 0.72 0.00 0.00 0.00 0.00 19.45 19.01 3a9t n ALA 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a9t h ALA 389 N 2.92 2.44 -0.67 0.00 0.00 -0.35 -0.01 119.26 123.58 3a9t h ALA 389 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3a9t h ALA 389 Cb 0.54 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3a9t h ALA 389 CO 0.00 -0.77 0.00 0.09 0.00 0.00 0.00 179.25 178.57 3a9t n ASN 390 N -4.08 3.82 0.00 0.00 3.02 -1.26 -4.78 115.26 111.98 3a9t n ASN 390 Ca 0.11 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 3a9t n ASN 390 Cb 0.71 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3a9t n ASN 390 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a9t n GLY 391 N 1.63 2.90 3.17 7.41 0.00 -0.02 -4.49 105.19 115.79 3a9t n GLY 391 Ca 0.24 -1.91 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 3a9t n GLY 391 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3a9t s ILE 392 N -2.78 0.74 -0.12 -0.61 -4.36 -0.63 -4.73 121.20 108.71 3a9t s ILE 392 Ca 0.00 -1.85 0.02 0.00 -0.26 0.00 0.00 60.65 58.56 3a9t s ILE 392 Cb 0.00 -1.58 -0.00 0.00 1.25 0.00 0.00 42.46 42.12 3a9t s ILE 392 CO 0.00 -0.80 -0.20 -0.63 0.24 0.00 0.00 174.94 173.55 3a9t s ILE 393 N -3.32 2.42 -0.47 8.37 1.01 0.04 -0.30 121.20 128.95 3a9t s ILE 393 Ca 0.10 -0.88 -0.26 0.00 0.00 0.00 0.00 60.65 59.61 3a9t s ILE 393 Cb 0.03 -1.97 0.03 0.00 0.01 0.00 0.00 42.46 40.56 3a9t s ILE 393 CO -0.03 0.54 0.96 -2.28 0.00 0.00 0.00 174.94 174.13 3a9t s HIS 394 N 0.42 2.89 -0.34 3.97 5.65 0.14 -1.52 115.29 126.50 3a9t s HIS 394 Ca -0.14 0.40 -0.10 0.00 0.25 0.00 0.00 55.06 55.46 3a9t s HIS 394 Cb -0.17 -4.05 0.01 0.00 -1.18 0.00 0.00 32.58 27.19 3a9t s HIS 394 CO 0.06 -1.15 0.18 -0.51 -0.65 0.00 0.00 174.74 172.68 3a9t s LEU 395 N 3.88 4.37 -0.28 8.88 1.43 -0.79 -1.13 118.68 135.04 3a9t s LEU 395 Ca 0.38 -0.69 -0.00 0.00 -1.03 0.00 0.00 54.13 52.79 3a9t s LEU 395 Cb -0.10 -2.02 0.17 0.00 0.03 0.00 0.00 46.19 44.27 3a9t s LEU 395 CO 0.27 -0.27 0.49 -0.51 0.23 0.00 0.00 176.35 176.56 3a9t s ILE 396 N 1.60 -0.80 0.67 -0.59 2.07 -0.46 -1.70 121.20 121.99 3a9t s ILE 396 Ca 0.04 -0.07 -0.15 0.00 -1.41 0.00 0.00 60.65 59.05 3a9t s ILE 396 Cb -0.18 -0.93 0.01 0.00 0.13 0.00 0.00 42.46 41.49 3a9t s ILE 396 CO 0.07 -0.09 1.14 0.21 -1.91 0.00 0.00 174.94 174.36 3a9t s ASN 397 N 2.69 4.89 0.00 4.50 2.47 -1.26 -3.45 114.94 124.79 3a9t s ASN 397 Ca 0.15 2.13 0.00 0.00 0.42 0.00 0.00 52.86 55.55 3a9t s ASN 397 Cb -0.14 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.09 3a9t s ASN 397 CO -0.21 -1.78 0.03 -1.54 -3.72 0.00 0.00 177.10 169.88 3a9t n SER 398 N -2.40 0.09 0.00 -4.21 3.41 -1.26 -4.34 113.62 104.91 3a9t n SER 398 Ca 0.11 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3a9t n SER 398 Cb 0.51 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3a9t n SER 398 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a9t n GLY 399 N 0.78 1.03 3.24 5.00 0.00 -1.26 -5.03 105.19 108.95 3a9t n GLY 399 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3a9t n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9t s ALA 400 N -0.74 1.68 -0.29 4.61 0.00 -1.26 -0.20 121.76 125.56 3a9t s ALA 400 Ca 0.00 -1.03 -0.21 0.00 0.00 0.00 0.00 51.96 50.72 3a9t s ALA 400 Cb 0.00 -0.32 0.18 0.00 0.00 0.00 0.00 23.12 22.98 3a9t s ALA 400 CO 0.00 0.37 1.24 0.00 0.00 0.00 0.00 175.76 177.37 3a9t s ALA 401 N -0.82 -2.31 0.30 0.00 0.00 -1.26 -4.64 121.76 113.03 3a9t s ALA 401 Ca 0.07 1.88 -0.28 0.00 0.00 0.00 0.00 51.96 53.63 3a9t s ALA 401 Cb -0.09 -1.76 -0.14 0.00 0.00 0.00 0.00 23.12 21.13 3a9t s ALA 401 CO 0.02 -0.22 1.09 0.00 0.00 0.00 0.00 175.76 176.64 3a9t n ALA 402 N 2.45 0.13 0.26 0.00 0.00 -1.26 -4.69 120.51 117.40 3a9t n ALA 402 Ca -0.14 0.39 0.15 0.00 0.00 0.00 0.00 53.44 53.83 3a9t n ALA 402 Cb 0.57 -2.08 0.73 0.00 0.00 0.00 0.00 19.45 18.66 3a9t n ALA 402 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3a9t h LEU 403 N 2.22 0.00 -1.99 0.00 3.38 -1.91 0.11 115.31 117.12 3a9t h LEU 403 Ca -0.41 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 3a9t h LEU 403 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 3a9t h LEU 403 CO 0.62 0.00 -0.07 0.44 0.09 0.00 0.00 178.44 179.52 3a9t h ASP 404 N 0.00 0.00 0.00 -0.43 5.19 -1.93 -2.32 116.42 116.93 3a9t h ASP 404 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3a9t h ASP 404 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 3a9t h ASP 404 CO 0.00 0.07 0.03 0.61 -3.12 0.00 0.00 179.24 176.83 3a9t n GLY 405 N -1.23 -0.28 0.22 2.75 0.00 0.37 -1.93 105.19 105.09 3a9t n GLY 405 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 3a9t n GLY 405 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3a9t h THR 406 N 0.00 1.31 0.00 2.61 1.35 -1.63 -3.35 112.91 113.20 3a9t h THR 406 Ca 0.00 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 3a9t h THR 406 Cb 0.05 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 3a9t h THR 406 CO 0.00 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 3a9t n GLY 407 N 0.15 0.65 0.16 5.82 0.00 -0.81 -1.28 105.19 109.87 3a9t n GLY 407 Ca -0.03 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.05 3a9t n GLY 407 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3a9t h GLU 408 N 1.72 0.00 -6.91 1.61 4.39 -1.83 -3.37 114.58 110.19 3a9t h GLU 408 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 3a9t h GLU 408 Cb 0.00 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 28.69 3a9t h GLU 408 CO 0.00 0.00 0.49 -0.65 -1.16 0.00 0.00 179.01 177.69 3a9t s GLN 409 N -3.31 4.21 0.06 2.33 -0.21 -1.25 -4.85 119.66 116.64 3a9t s GLN 409 Ca 0.06 1.81 0.04 0.00 0.02 0.00 0.00 55.36 57.28 3a9t s GLN 409 Cb 0.10 -2.79 -0.03 0.00 1.00 0.00 0.00 33.01 31.29 3a9t s GLN 409 CO 0.50 -0.17 -0.11 0.99 -2.12 0.00 0.00 175.29 174.38 3a9t s THR 410 N -1.38 0.85 -0.18 -0.19 2.01 -1.26 -1.54 115.64 113.94 3a9t s THR 410 Ca 0.54 -1.28 -0.05 0.00 0.31 0.00 0.00 61.69 61.20 3a9t s THR 410 Cb -0.30 -0.94 0.09 0.00 0.01 0.00 0.00 72.50 71.35 3a9t s THR 410 CO 0.38 -0.35 0.35 -0.75 -0.69 0.00 0.00 174.62 173.57 3a9t s LYS 411 N -1.89 0.26 -1.41 4.92 2.20 -0.78 -4.88 119.74 118.16 3a9t s LYS 411 Ca -0.04 0.84 -0.10 0.00 -0.36 0.00 0.00 55.97 56.31 3a9t s LYS 411 Cb -0.09 0.04 0.03 0.00 -1.51 0.00 0.00 37.83 36.30 3a9t s LYS 411 CO 0.01 -0.34 1.13 -0.25 -0.36 0.00 0.00 175.35 175.55 3a9t n ASP 412 N 5.37 -5.97 -1.28 1.43 8.00 -1.26 -1.70 116.55 121.14 3a9t n ASP 412 Ca -0.07 -0.61 -0.16 0.00 0.71 0.00 0.00 54.79 54.67 3a9t n ASP 412 Cb 0.50 -4.71 -0.06 0.00 -0.02 0.00 0.00 41.12 36.83 3a9t n ASP 412 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a9t n GLY 413 N -1.93 1.34 3.34 0.44 0.00 -1.26 -5.00 105.19 102.12 3a9t n GLY 413 Ca 0.02 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 3a9t n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a9t s LYS 414 N -3.53 1.27 0.11 1.61 1.02 -0.69 -5.11 119.74 114.42 3a9t s LYS 414 Ca 0.00 -1.26 -0.30 0.00 0.02 0.00 0.00 55.97 54.43 3a9t s LYS 414 Cb 0.00 -1.66 -0.06 0.00 -0.52 0.00 0.00 37.83 35.59 3a9t s LYS 414 CO 0.00 0.39 1.06 -1.25 -0.92 0.00 0.00 175.35 174.63 3a9t s PRO 415 N -1.99 4.59 0.33 -1.68 0.04 -1.26 -1.87 135.00 133.16 3a9t s PRO 415 Ca 0.10 1.60 -0.10 0.00 0.04 0.00 0.00 61.00 62.65 3a9t s PRO 415 Cb -0.10 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.11 3a9t s PRO 415 CO 0.05 0.05 0.58 0.14 0.04 0.00 0.00 177.00 177.86 3a9t s VAL 416 N 0.22 0.00 -0.14 -0.36 -7.23 -0.59 -4.70 120.40 107.59 3a9t s VAL 416 Ca 0.51 -1.35 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 3a9t s VAL 416 Cb -0.26 -2.56 0.02 0.00 0.56 0.00 0.00 36.38 34.14 3a9t s VAL 416 CO 0.31 0.00 -0.14 -0.63 -0.31 0.00 0.00 175.10 174.33 3a9t s ILE 417 N -3.13 1.55 0.35 -0.62 1.01 -1.26 -3.95 121.20 115.15 3a9t s ILE 417 Ca 0.23 -0.62 0.07 0.00 0.00 0.00 0.00 60.65 60.33 3a9t s ILE 417 Cb -0.02 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.97 3a9t s ILE 417 CO 0.14 0.46 0.31 -0.54 0.00 0.00 0.00 174.94 175.31 3a9t s LYS 418 N 1.45 2.69 0.37 2.79 1.02 -1.26 -4.92 119.74 121.88 3a9t s LYS 418 Ca 0.04 -1.34 -0.27 0.00 0.02 0.00 0.00 55.97 54.42 3a9t s LYS 418 Cb -0.13 -2.46 -0.09 0.00 -0.52 0.00 0.00 37.83 34.63 3a9t s LYS 418 CO -0.10 0.04 1.24 -2.14 -0.92 0.00 0.00 175.35 173.46 3a9t s PRO 419 N -4.02 4.15 0.42 -1.68 0.02 -1.26 -4.62 135.00 128.00 3a9t s PRO 419 Ca 0.42 2.02 0.24 0.00 0.02 0.00 0.00 61.00 63.71 3a9t s PRO 419 Cb -0.05 -2.84 1.26 0.00 0.02 0.00 0.00 34.50 32.89 3a9t s PRO 419 CO 0.27 -0.29 1.71 0.10 -0.33 0.00 0.00 177.00 178.45 3a9t h TYR 420 N 2.93 0.57 0.00 6.54 -0.00 -1.85 0.11 116.97 125.27 3a9t h TYR 420 Ca -0.49 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.26 3a9t h TYR 420 Cb 1.23 -0.16 0.00 0.00 -0.00 0.00 0.00 36.73 37.81 3a9t h TYR 420 CO 0.55 -0.06 0.00 2.48 -0.00 0.00 0.00 178.16 181.13 3a9t n TYR 421 N -4.64 0.00 0.61 0.10 4.11 -1.26 -2.27 117.16 113.81 3a9t n TYR 421 Ca 0.31 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 58.28 3a9t n TYR 421 Cb 1.13 -0.34 0.07 0.00 -0.00 0.00 0.00 39.34 40.21 3a9t n TYR 421 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 3a9t n GLU 422 N -1.34 1.30 -2.18 -3.48 1.02 0.37 -5.01 120.64 111.31 3a9t n GLU 422 Ca 0.06 -1.49 -0.41 0.00 -0.02 0.00 0.00 57.16 55.30 3a9t n GLU 422 Cb 0.14 -1.31 -0.03 0.00 -0.02 0.00 0.00 31.44 30.22 3a9t n GLU 422 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3a9t s LEU 423 N -1.30 4.44 0.28 -4.62 1.43 -0.96 -4.99 118.68 112.95 3a9t s LEU 423 Ca 0.19 2.56 0.06 0.00 -1.03 0.00 0.00 54.13 55.92 3a9t s LEU 423 Cb 0.13 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 3a9t s LEU 423 CO 0.20 -0.49 0.33 0.42 0.23 0.00 0.00 176.35 177.04 3a9t s THR 424 N -0.79 4.52 0.46 5.49 -4.23 -1.26 -5.00 115.64 114.83 3a9t s THR 424 Ca 0.51 -1.16 0.12 0.00 -1.18 0.00 0.00 61.69 59.98 3a9t s THR 424 Cb -0.38 -3.54 0.23 0.00 1.34 0.00 0.00 72.50 70.15 3a9t s THR 424 CO 0.47 -0.27 2.05 0.44 -0.54 0.00 0.00 174.62 176.77 3a9t h ASP 425 N 1.21 0.15 -0.11 3.99 3.32 -2.00 -2.26 116.42 120.71 3a9t h ASP 425 Ca -0.49 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.54 3a9t h ASP 425 Cb 1.24 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 3a9t h ASP 425 CO 0.59 0.19 0.04 -0.08 -1.72 0.00 0.00 179.24 178.25 3a9t h GLU 426 N 0.17 0.17 -0.50 3.56 4.81 -1.99 -1.23 114.58 119.57 3a9t h GLU 426 Ca 0.04 -0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 3a9t h GLU 426 Cb 0.12 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 29.37 3a9t h GLU 426 CO 0.00 0.30 -0.29 -0.44 -0.73 0.00 0.00 179.01 177.85 3a9t h ASP 427 N 0.00 -1.00 0.46 1.04 3.32 -1.75 -0.17 116.42 118.32 3a9t h ASP 427 Ca 0.04 0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 3a9t h ASP 427 Cb 0.20 0.50 0.00 0.00 0.22 0.00 0.00 39.33 40.25 3a9t h ASP 427 CO -0.00 -0.29 -0.24 0.40 -1.72 0.00 0.00 179.24 177.39 3a9t h ILE 428 N -0.17 0.51 -0.66 0.35 2.04 -1.40 -2.20 117.51 115.97 3a9t h ILE 428 Ca 0.22 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.22 3a9t h ILE 428 Cb 0.52 0.51 -0.11 0.00 -0.74 0.00 0.00 36.82 37.00 3a9t h ILE 428 CO -0.60 0.00 0.03 0.50 0.00 0.00 0.00 178.15 178.08 3a9t h LYS 429 N -0.64 0.13 0.00 2.37 3.64 -0.58 -1.40 116.57 120.09 3a9t h LYS 429 Ca -0.06 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 3a9t h LYS 429 Cb 0.51 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3a9t h LYS 429 CO 0.08 0.09 -0.50 0.87 -2.27 0.00 0.00 179.45 177.73 3a9t h LYS 430 N 0.14 0.00 -0.54 1.90 1.57 -0.96 -1.32 116.57 117.36 3a9t h LYS 430 Ca 0.35 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.07 3a9t h LYS 430 Cb 0.58 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 3a9t h LYS 430 CO -0.55 0.50 0.09 0.00 -0.57 0.00 0.00 179.45 178.92 3a9t h LEU 432 N 0.78 0.92 -0.83 0.00 3.38 -1.25 -3.12 115.31 115.19 3a9t h LEU 432 Ca 0.16 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.76 3a9t h LEU 432 Cb 0.41 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3a9t h LEU 432 CO 0.01 1.11 0.54 -0.33 0.09 0.00 0.00 178.44 179.86 3a9t h GLU 433 N 0.73 1.05 0.00 1.13 5.08 -1.00 -2.07 114.58 119.50 3a9t h GLU 433 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3a9t h GLU 433 Cb 0.75 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3a9t h GLU 433 CO 0.06 0.70 0.00 0.00 -1.00 0.00 0.00 179.01 178.77 3a9t n ALA 434 N -2.33 2.61 -2.61 3.43 0.00 -0.55 -4.82 120.51 116.23 3a9t n ALA 434 Ca 0.09 -0.19 -0.32 0.00 0.00 0.00 0.00 53.44 53.02 3a9t n ALA 434 Cb 0.04 -1.48 -0.10 0.00 0.00 0.00 0.00 19.45 17.91 3a9t n ALA 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3a9t s THR 435 N -2.00 3.75 -0.06 0.00 2.01 -0.78 -4.53 115.64 114.02 3a9t s THR 435 Ca 0.45 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.72 3a9t s THR 435 Cb 0.21 -2.64 0.01 0.00 0.01 0.00 0.00 72.50 70.08 3a9t s THR 435 CO 0.34 0.38 -0.14 -1.10 -0.69 0.00 0.00 174.62 173.42 3a9t s GLN 436 N -1.48 1.75 -0.34 4.92 -0.21 -0.22 -4.53 119.66 119.55 3a9t s GLN 436 Ca 0.18 -0.48 -0.15 0.00 0.02 0.00 0.00 55.36 54.94 3a9t s GLN 436 Cb -0.11 -1.46 -0.02 0.00 1.00 0.00 0.00 33.01 32.43 3a9t s GLN 436 CO 0.08 0.09 0.34 -0.06 -2.12 0.00 0.00 175.29 173.62 3a9t s PHE 437 N 0.48 3.22 -0.10 0.91 0.40 0.48 -0.43 117.98 122.94 3a9t s PHE 437 Ca -0.12 -0.03 -0.03 0.00 -0.60 0.00 0.00 56.93 56.15 3a9t s PHE 437 Cb -0.15 -2.62 -0.03 0.00 0.51 0.00 0.00 43.02 40.73 3a9t s PHE 437 CO 0.04 -0.40 0.04 1.03 0.70 0.00 0.00 175.22 176.62 3a9t s ARG 438 N 1.96 3.11 0.19 0.44 1.81 -0.70 -0.77 118.95 125.00 3a9t s ARG 438 Ca 0.11 -0.33 -0.33 0.00 -1.72 0.00 0.00 55.73 53.46 3a9t s ARG 438 Cb -0.17 -2.90 -0.14 0.00 -0.45 0.00 0.00 34.95 31.30 3a9t s ARG 438 CO 0.11 0.72 1.54 -2.30 -0.68 0.00 0.00 175.30 174.69 3a9t n PRO 439 N 2.11 2.18 -1.63 3.54 -0.02 -1.26 -0.98 135.00 138.94 3a9t n PRO 439 Ca -0.19 0.78 -0.39 0.00 -2.02 0.00 0.00 63.50 61.68 3a9t n PRO 439 Cb 0.54 -2.53 0.04 0.00 -0.02 0.00 0.00 33.50 31.53 3a9t n PRO 439 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9t n ALA 440 N 2.98 0.37 -2.27 3.55 0.00 0.00 -4.72 120.51 120.42 3a9t n ALA 440 Ca 0.15 0.11 -0.42 0.00 0.00 0.00 0.00 53.44 53.28 3a9t n ALA 440 Cb 0.30 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 3a9t n ALA 440 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3a9t s SER 441 N -0.99 6.06 0.59 0.00 0.01 -1.26 -4.83 113.70 113.27 3a9t s SER 441 Ca 0.70 0.64 0.29 0.00 1.31 0.00 0.00 55.95 58.89 3a9t s SER 441 Cb -0.47 -2.54 1.79 0.00 0.21 0.00 0.00 66.02 65.01 3a9t s SER 441 CO 0.51 -1.69 2.24 0.71 0.41 0.00 0.00 173.24 175.43 3a9t h THR 442 N 6.54 0.55 0.00 1.44 1.35 -1.81 0.23 112.91 121.21 3a9t h THR 442 Ca -0.28 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.54 3a9t h THR 442 Cb 1.12 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 3a9t h THR 442 CO 1.13 0.00 -0.17 1.05 -0.25 0.00 0.00 175.52 177.27 3a9t h GLU 443 N 0.00 0.00 0.00 4.72 4.11 -1.89 -2.72 114.58 118.80 3a9t h GLU 443 Ca 0.01 0.00 -0.45 0.00 0.07 0.00 0.00 59.36 58.99 3a9t h GLU 443 Cb 0.03 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.21 3a9t h GLU 443 CO -0.00 0.17 -2.48 0.66 0.07 0.00 0.00 179.01 177.43 3a9t n TYR 444 N -4.15 0.06 -3.79 2.06 4.01 -0.60 -4.80 117.16 109.95 3a9t n TYR 444 Ca -0.02 0.02 -0.33 0.00 -0.16 0.00 0.00 57.90 57.41 3a9t n TYR 444 Cb 0.25 -1.01 -0.10 0.00 -0.31 0.00 0.00 39.34 38.17 3a9t n TYR 444 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3a9t s PHE 445 N -2.50 3.57 0.48 -0.72 0.08 0.72 -4.89 117.98 114.71 3a9t s PHE 445 Ca -0.38 -3.08 0.19 0.00 0.12 0.00 0.00 56.93 53.78 3a9t s PHE 445 Cb 0.14 -3.01 1.21 0.00 -0.57 0.00 0.00 43.02 40.79 3a9t s PHE 445 CO 0.51 -0.70 1.99 0.00 -0.10 0.00 0.00 175.22 176.92 3a9t h ARG 446 N 6.14 0.19 -0.04 0.44 3.08 -1.40 -2.54 114.38 120.25 3a9t h ARG 446 Ca 0.08 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3a9t h ARG 446 Cb 0.84 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.85 3a9t h ARG 446 CO 0.75 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 180.19 3a9t n GLY 447 N -1.57 -0.80 5.38 0.04 0.00 -0.14 -4.88 105.19 103.22 3a9t n GLY 447 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3a9t n GLY 447 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9t n GLY 448 N 0.59 -1.79 0.00 -0.02 0.00 -0.95 -2.20 105.19 100.82 3a9t n GLY 448 Ca 0.02 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.53 3a9t n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a9t n GLY 449 N 0.00 0.77 2.60 -0.02 0.00 -1.26 -1.25 105.19 106.03 3a9t n GLY 449 Ca 0.00 -2.14 -0.26 0.00 0.00 0.00 0.00 46.02 43.61 3a9t n GLY 449 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a9t s TYR 450 N -0.95 0.19 0.64 1.61 2.02 -1.26 -0.82 117.35 118.78 3a9t s TYR 450 Ca 0.00 -0.42 -0.12 0.00 -0.37 0.00 0.00 57.07 56.15 3a9t s TYR 450 Cb 0.00 -0.72 -0.02 0.00 -0.40 0.00 0.00 41.96 40.82 3a9t s TYR 450 CO 0.00 -0.60 1.04 -1.54 -1.57 0.00 0.00 175.55 172.89 3a9t s SER 451 N 2.14 5.80 -0.20 2.29 1.04 -0.15 -3.50 113.70 121.11 3a9t s SER 451 Ca 0.04 1.59 -0.15 0.00 0.48 0.00 0.00 55.95 57.91 3a9t s SER 451 Cb -0.16 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.42 3a9t s SER 451 CO -0.16 -1.16 0.35 -0.89 0.98 0.00 0.00 173.24 172.36 3a9t s THR 452 N -2.96 5.24 -0.27 2.02 2.01 0.73 -1.71 115.64 120.69 3a9t s THR 452 Ca 0.58 0.60 0.03 0.00 0.31 0.00 0.00 61.69 63.21 3a9t s THR 452 Cb -0.13 -3.68 0.07 0.00 0.01 0.00 0.00 72.50 68.77 3a9t s THR 452 CO 0.50 0.28 -0.07 -0.62 -0.69 0.00 0.00 174.62 174.01 3a9t s ASP 453 N 1.00 4.45 0.26 3.53 2.15 0.43 -1.33 116.67 127.15 3a9t s ASP 453 Ca 0.17 -1.52 -0.06 0.00 0.43 0.00 0.00 52.55 51.57 3a9t s ASP 453 Cb -0.14 -1.52 -0.01 0.00 -0.30 0.00 0.00 42.92 40.94 3a9t s ASP 453 CO 0.07 -0.23 0.37 0.72 -0.17 0.00 0.00 175.17 175.93 3a9t s PHE 454 N 1.10 0.82 -0.25 -5.34 -0.12 -1.26 -1.06 117.98 111.86 3a9t s PHE 454 Ca -0.05 -1.09 -0.01 0.00 -0.05 0.00 0.00 56.93 55.73 3a9t s PHE 454 Cb -0.20 -0.12 0.07 0.00 -0.63 0.00 0.00 43.02 42.14 3a9t s PHE 454 CO -0.06 -0.92 0.03 -1.17 -0.05 0.00 0.00 175.22 173.05 3a9t s LEU 455 N -3.13 2.02 0.26 -1.99 2.96 -1.26 -1.24 118.68 116.31 3a9t s LEU 455 Ca 0.30 -1.22 -0.31 0.00 -0.22 0.00 0.00 54.13 52.68 3a9t s LEU 455 Cb 0.02 -0.88 -0.12 0.00 0.50 0.00 0.00 46.19 45.71 3a9t s LEU 455 CO 0.13 -0.32 1.55 0.41 -1.32 0.00 0.00 176.35 176.80 3a9t n THR 456 N 4.85 0.86 -2.23 3.68 -1.04 -0.54 -4.87 114.28 114.99 3a9t n THR 456 Ca -0.07 -0.21 -0.37 0.00 -2.04 0.00 0.00 64.05 61.36 3a9t n THR 456 Cb 0.44 -1.78 -0.00 0.00 -1.82 0.00 0.00 70.33 67.17 3a9t n THR 456 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3a9t s LYS 457 N -0.25 3.66 0.88 -2.82 1.02 -0.41 -4.76 119.74 117.06 3a9t s LYS 457 Ca 0.67 1.77 -0.11 0.00 0.02 0.00 0.00 55.97 58.32 3a9t s LYS 457 Cb -0.56 -2.33 0.17 0.00 -0.52 0.00 0.00 37.83 34.59 3a9t s LYS 457 CO 0.47 -0.64 1.21 0.20 -0.92 0.00 0.00 175.35 175.68 3a9t s GLY 458 N -1.41 1.76 0.00 -3.33 0.00 -1.26 -4.36 107.32 98.73 3a9t s GLY 458 Ca 0.66 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 44.07 3a9t s GLY 458 CO 0.34 -0.62 0.00 0.61 0.00 0.00 0.00 173.10 173.43 3a9t n GLY 459 N -3.45 0.59 3.62 0.20 0.00 0.18 -4.83 105.19 101.49 3a9t n GLY 459 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3a9t n GLY 459 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3a9t s MET 460 N -0.33 4.06 0.27 1.61 0.00 -1.25 -4.87 119.30 118.79 3a9t s MET 460 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 55.69 55.55 3a9t s MET 460 Cb 0.00 -3.64 -0.10 0.00 0.00 0.00 0.00 34.83 31.09 3a9t s MET 460 CO 0.00 -0.26 1.47 -1.25 0.00 0.00 0.00 175.02 174.98 3a9t s PRO 461 N 2.02 4.23 0.19 4.11 0.04 -1.26 -2.01 135.00 142.32 3a9t s PRO 461 Ca 0.18 2.37 -0.07 0.00 0.04 0.00 0.00 61.00 63.51 3a9t s PRO 461 Cb -0.16 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 3a9t s PRO 461 CO 0.09 -0.46 0.28 0.14 0.04 0.00 0.00 177.00 177.09 3a9t s VAL 462 N -0.13 0.04 -0.04 -0.36 -7.23 -0.49 0.62 120.40 112.81 3a9t s VAL 462 Ca 0.59 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 59.17 3a9t s VAL 462 Cb -0.43 -2.11 0.03 0.00 0.56 0.00 0.00 36.38 34.43 3a9t s VAL 462 CO 0.46 -0.16 0.03 -0.89 -0.31 0.00 0.00 175.10 174.23 3a9t s THR 463 N -4.03 0.06 0.01 5.32 2.01 0.12 -0.63 115.64 118.50 3a9t s THR 463 Ca 0.24 0.28 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 3a9t s THR 463 Cb 0.03 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.26 3a9t s THR 463 CO 0.05 0.18 0.11 0.27 -0.69 0.00 0.00 174.62 174.54 3a9t s ILE 464 N 1.81 4.88 0.07 1.82 -4.36 -0.28 -1.23 121.20 123.91 3a9t s ILE 464 Ca 0.01 -0.42 -0.10 0.00 -0.26 0.00 0.00 60.65 59.88 3a9t s ILE 464 Cb -0.12 -3.27 0.01 0.00 1.25 0.00 0.00 42.46 40.32 3a9t s ILE 464 CO -0.03 0.30 0.23 -0.94 0.24 0.00 0.00 174.94 174.73 3a9t s SER 465 N -1.93 0.03 -0.11 4.36 1.04 -0.22 -1.11 113.70 115.75 3a9t s SER 465 Ca 0.26 -0.46 -0.07 0.00 0.48 0.00 0.00 55.95 56.15 3a9t s SER 465 Cb -0.12 0.34 0.04 0.00 0.10 0.00 0.00 66.02 66.38 3a9t s SER 465 CO 0.17 -0.66 0.28 -0.60 0.98 0.00 0.00 173.24 173.41 3a9t s ARG 466 N -3.23 0.27 -0.16 4.02 6.06 -0.62 -1.13 118.95 124.16 3a9t s ARG 466 Ca -0.00 0.53 -0.06 0.00 -2.50 0.00 0.00 55.73 53.69 3a9t s ARG 466 Cb 0.02 -0.02 -0.04 0.00 0.06 0.00 0.00 34.95 34.97 3a9t s ARG 466 CO -0.08 -0.12 0.06 -1.17 -2.50 0.00 0.00 175.30 171.49 3a9t s LEU 467 N 0.95 3.83 0.12 -0.88 2.96 -1.26 -1.32 118.68 123.07 3a9t s LEU 467 Ca -0.07 0.13 0.04 0.00 -0.22 0.00 0.00 54.13 54.02 3a9t s LEU 467 Cb -0.08 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 3a9t s LEU 467 CO -0.07 0.23 -0.11 0.20 -1.32 0.00 0.00 176.35 175.29 3a9t s ASN 468 N 0.01 1.65 -0.22 3.68 0.01 0.05 -4.73 114.94 115.40 3a9t s ASN 468 Ca 0.06 -0.89 0.02 0.00 -0.71 0.00 0.00 52.86 51.33 3a9t s ASN 468 Cb -0.12 -0.01 0.04 0.00 0.41 0.00 0.00 41.25 41.57 3a9t s ASN 468 CO 0.01 -0.28 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.56 3a9t s ILE 469 N -2.77 1.99 -0.14 0.60 1.01 -1.26 -0.11 121.20 120.52 3a9t s ILE 469 Ca 0.10 -1.26 -0.02 0.00 0.00 0.00 0.00 60.65 59.47 3a9t s ILE 469 Cb -0.01 -2.00 -0.02 0.00 0.01 0.00 0.00 42.46 40.44 3a9t s ILE 469 CO 0.00 0.19 -0.06 -0.69 0.00 0.00 0.00 174.94 174.39 3a9t s VAL 470 N 1.24 3.68 0.13 2.92 1.01 -0.37 -4.94 120.40 124.07 3a9t s VAL 470 Ca -0.03 -0.44 -0.32 0.00 0.00 0.00 0.00 61.98 61.19 3a9t s VAL 470 Cb -0.17 -2.59 -0.12 0.00 0.00 0.00 0.00 36.38 33.51 3a9t s VAL 470 CO -0.08 0.51 1.78 1.17 0.00 0.00 0.00 175.10 178.48 3a9t n LYS 471 N 3.39 2.66 -0.26 2.72 3.00 -1.26 -0.59 118.16 127.82 3a9t n LYS 471 Ca -0.18 0.96 0.00 0.00 -0.00 0.00 0.00 58.31 59.10 3a9t n LYS 471 Cb 0.53 -2.83 0.00 0.00 0.00 0.00 0.00 35.03 32.73 3a9t n LYS 471 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3a9t n GLY 472 N 4.08 0.64 0.53 3.14 0.00 -1.26 -4.82 105.19 107.49 3a9t n GLY 472 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3a9t n GLY 472 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3a9t n LEU 473 N 0.00 0.30 0.00 0.99 7.94 -0.34 -5.16 117.00 120.72 3a9t n LEU 473 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3a9t n LEU 473 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3a9t n LEU 473 CO 0.00 -0.07 0.00 0.61 -1.11 0.00 0.00 177.39 176.82 3a9t n GLY 474 N 1.76 0.52 3.76 -3.96 0.00 0.24 -4.95 105.19 102.56 3a9t n GLY 474 Ca 0.00 -1.66 -0.40 0.00 0.00 0.00 0.00 46.02 43.96 3a9t n GLY 474 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a9t s PRO 475 N 0.00 4.59 -0.09 1.61 0.04 -1.26 -1.23 135.00 138.66 3a9t s PRO 475 Ca 0.00 1.73 -0.06 0.00 0.04 0.00 0.00 61.00 62.71 3a9t s PRO 475 Cb 0.00 -3.10 0.03 0.00 0.04 0.00 0.00 34.50 31.47 3a9t s PRO 475 CO 0.00 0.19 0.21 0.54 0.04 0.00 0.00 177.00 177.98 3a9t s VAL 476 N -1.24 -0.02 0.02 -0.36 0.11 0.85 -4.15 120.40 115.61 3a9t s VAL 476 Ca 0.46 0.08 0.03 0.00 -2.93 0.00 0.00 61.98 59.62 3a9t s VAL 476 Cb -0.30 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 3a9t s VAL 476 CO 0.38 0.03 -0.04 -0.22 -3.33 0.00 0.00 175.10 171.92 3a9t s LEU 477 N 0.68 3.28 -0.02 2.54 2.96 -0.40 -0.77 118.68 126.96 3a9t s LEU 477 Ca -0.05 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 3a9t s LEU 477 Cb -0.06 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.70 3a9t s LEU 477 CO -0.04 0.26 -0.13 0.00 -1.32 0.00 0.00 176.35 175.12 3a9t s GLN 478 N -1.66 1.23 0.07 1.98 -2.07 -0.44 -1.81 119.66 116.96 3a9t s GLN 478 Ca 0.19 -0.47 0.06 0.00 -1.82 0.00 0.00 55.36 53.33 3a9t s GLN 478 Cb -0.11 -1.14 -0.03 0.00 -1.09 0.00 0.00 33.01 30.64 3a9t s GLN 478 CO 0.10 0.23 -0.16 0.42 -1.32 0.00 0.00 175.29 174.56 3a9t s ILE 479 N -0.09 1.32 -0.27 3.63 1.01 0.22 -1.58 121.20 125.44 3a9t s ILE 479 Ca 0.01 -1.27 -0.00 0.00 0.00 0.00 0.00 60.65 59.39 3a9t s ILE 479 Cb -0.08 -1.21 0.14 0.00 0.01 0.00 0.00 42.46 41.32 3a9t s ILE 479 CO 0.00 -0.07 0.36 0.00 0.00 0.00 0.00 174.94 175.23 3a9t s ALA 480 N -1.08 -0.91 0.41 9.38 0.00 -0.27 -3.69 121.76 125.60 3a9t s ALA 480 Ca 0.02 0.29 -0.18 0.00 0.00 0.00 0.00 51.96 52.09 3a9t s ALA 480 Cb -0.09 -1.84 -0.10 0.00 0.00 0.00 0.00 23.12 21.09 3a9t s ALA 480 CO 0.02 -1.56 0.89 -1.21 0.00 0.00 0.00 175.76 173.90 3a9t s GLU 481 N 2.48 4.10 0.00 0.00 2.02 -1.26 -1.12 118.70 124.92 3a9t s GLU 481 Ca 0.10 0.94 0.00 0.00 0.02 0.00 0.00 54.97 56.03 3a9t s GLU 481 Cb -0.14 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.84 3a9t s GLU 481 CO -0.25 -0.02 0.00 0.41 0.02 0.00 0.00 175.26 175.42 3a9t n GLY 482 N -0.74 1.34 3.12 -1.39 0.00 0.20 -0.79 105.19 106.93 3a9t n GLY 482 Ca 0.06 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 3a9t n GLY 482 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a9t s TYR 483 N -1.14 0.25 0.23 1.61 1.51 0.05 -1.39 117.35 118.47 3a9t s TYR 483 Ca 0.00 -0.62 -0.10 0.00 -1.01 0.00 0.00 57.07 55.34 3a9t s TYR 483 Cb 0.00 -0.18 -0.07 0.00 -0.11 0.00 0.00 41.96 41.60 3a9t s TYR 483 CO 0.00 -0.39 0.56 0.95 -1.11 0.00 0.00 175.55 175.56 3a9t s THR 484 N -2.97 4.91 0.20 -0.71 -4.23 -0.85 -0.71 115.64 111.28 3a9t s THR 484 Ca -0.02 0.52 0.06 0.00 -1.18 0.00 0.00 61.69 61.07 3a9t s THR 484 Cb 0.01 -3.62 -0.05 0.00 1.34 0.00 0.00 72.50 70.18 3a9t s THR 484 CO -0.06 -0.06 -0.11 0.68 -0.54 0.00 0.00 174.62 174.53 3a9t s VAL 485 N -1.80 1.53 -0.08 2.29 -7.23 -0.19 0.49 120.40 115.41 3a9t s VAL 485 Ca 0.47 -2.15 -0.03 0.00 -1.81 0.00 0.00 61.98 58.46 3a9t s VAL 485 Cb -0.11 -2.08 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 3a9t s VAL 485 CO 0.21 -0.57 0.06 -1.81 -0.31 0.00 0.00 175.10 172.68 3a9t s ASP 486 N -3.30 5.64 0.16 4.85 1.01 -1.26 -4.19 116.67 119.58 3a9t s ASP 486 Ca 0.23 0.23 0.10 0.00 0.71 0.00 0.00 52.55 53.82 3a9t s ASP 486 Cb 0.01 -1.66 -0.04 0.00 1.01 0.00 0.00 42.92 42.24 3a9t s ASP 486 CO 0.06 0.36 -0.21 -0.76 0.21 0.00 0.00 175.17 174.83 3a9t s LEU 487 N -1.12 2.55 0.37 1.23 1.43 -1.26 -5.03 118.68 116.85 3a9t s LEU 487 Ca 0.16 -0.73 -0.25 0.00 -1.03 0.00 0.00 54.13 52.27 3a9t s LEU 487 Cb -0.12 -1.33 -0.12 0.00 0.03 0.00 0.00 46.19 44.65 3a9t s LEU 487 CO 0.05 0.14 0.85 -2.65 0.23 0.00 0.00 176.35 174.98 3a9t n PRO 488 N 0.48 1.06 -0.23 1.29 -0.02 -1.26 -4.64 135.00 131.68 3a9t n PRO 488 Ca -0.14 0.38 0.03 0.00 -2.02 0.00 0.00 63.50 61.75 3a9t n PRO 488 Cb 0.55 -1.78 0.15 0.00 -0.02 0.00 0.00 33.50 32.40 3a9t n PRO 488 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9t h GLU 489 N 1.43 0.26 -0.02 -0.52 4.81 -2.00 -0.40 114.58 118.14 3a9t h GLU 489 Ca -0.41 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 58.67 3a9t h GLU 489 Cb 1.36 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.67 3a9t h GLU 489 CO 0.56 0.17 -0.61 1.49 -0.73 0.00 0.00 179.01 179.89 3a9t h GLU 490 N 0.27 0.08 -0.23 1.92 4.22 -2.01 -2.44 114.58 116.39 3a9t h GLU 490 Ca 0.37 -0.06 -0.06 0.00 0.08 0.00 0.00 59.36 59.70 3a9t h GLU 490 Cb 0.60 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 3a9t h GLU 490 CO -0.47 0.67 -0.08 0.28 -2.18 0.00 0.00 179.01 177.22 3a9t h VAL 491 N 0.06 1.29 -0.24 0.32 2.07 -1.56 -3.03 116.25 115.15 3a9t h VAL 491 Ca -0.01 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 66.42 3a9t h VAL 491 Cb 1.09 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 3a9t h VAL 491 CO 0.08 0.35 0.07 -0.74 0.02 0.00 0.00 177.57 177.36 3a9t h HIS 492 N 0.20 0.13 -0.51 1.57 -0.00 -1.06 -2.66 115.15 112.83 3a9t h HIS 492 Ca 0.06 0.01 0.09 0.00 -0.00 0.00 0.00 60.37 60.53 3a9t h HIS 492 Cb 0.57 -0.02 -0.08 0.00 -0.00 0.00 0.00 27.41 27.87 3a9t h HIS 492 CO 0.06 0.06 0.06 -0.44 -0.00 0.00 0.00 177.93 177.66 3a9t h ASP 493 N 0.18 -0.10 0.18 3.26 3.32 -1.41 0.27 116.42 122.11 3a9t h ASP 493 Ca 0.11 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 3a9t h ASP 493 Cb 0.08 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3a9t h ASP 493 CO -0.12 -0.02 -0.08 0.58 -1.72 0.00 0.00 179.24 177.87 3a9t h VAL 494 N 0.18 0.85 -0.90 -1.35 2.07 -1.40 0.17 116.25 115.87 3a9t h VAL 494 Ca 0.26 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.69 3a9t h VAL 494 Cb 0.37 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3a9t h VAL 494 CO -0.38 0.03 0.59 -0.07 0.02 0.00 0.00 177.57 177.76 3a9t h LEU 495 N -0.29 1.01 -0.11 2.57 3.38 -1.11 -3.05 115.31 117.71 3a9t h LEU 495 Ca -0.02 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3a9t h LEU 495 Cb 0.22 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3a9t h LEU 495 CO 0.04 0.72 -0.19 -0.78 0.09 0.00 0.00 178.44 178.33 3a9t h ASP 496 N 1.19 0.36 -0.60 -0.43 3.58 -0.23 -3.30 116.42 116.99 3a9t h ASP 496 Ca 0.34 -0.54 0.04 0.00 0.42 0.00 0.00 57.03 57.29 3a9t h ASP 496 Cb -0.10 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 40.82 3a9t h ASP 496 CO -0.08 0.83 0.40 0.11 -2.88 0.00 0.00 179.24 177.62 3a9t h LYS 497 N -0.10 0.66 -0.21 0.28 1.79 -0.56 -1.81 116.57 116.60 3a9t h LYS 497 Ca 0.01 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 3a9t h LYS 497 Cb 0.76 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 3a9t h LYS 497 CO 0.04 0.44 0.00 2.89 -1.08 0.00 0.00 179.45 181.74 3a9t n ARG 498 N -4.47 1.62 0.00 3.15 1.85 -1.17 -4.53 116.66 113.12 3a9t n ARG 498 Ca 0.08 -0.95 0.00 0.00 -1.00 0.00 0.00 57.85 55.97 3a9t n ARG 498 Cb 0.16 -1.29 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 3a9t n ARG 498 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 3a9t n THR 499 N 0.22 0.00 -2.77 8.89 -1.04 -0.70 -5.06 114.28 113.81 3a9t n THR 499 Ca 0.12 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.11 3a9t n THR 499 Cb 0.26 -0.58 0.02 0.00 -1.82 0.00 0.00 70.33 68.20 3a9t n THR 499 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3a9t s ASP 500 N 0.24 -0.89 0.66 8.00 1.01 -1.07 -5.05 116.67 119.57 3a9t s ASP 500 Ca 0.00 -0.94 0.42 0.00 0.71 0.00 0.00 52.55 52.73 3a9t s ASP 500 Cb 0.00 1.16 2.26 0.00 1.01 0.00 0.00 42.92 47.35 3a9t s ASP 500 CO 0.00 -0.04 2.27 1.55 0.21 0.00 0.00 175.17 179.16 3a9t h PRO 501 N 4.92 0.00 -0.45 8.23 0.13 -1.80 -2.44 132.00 140.59 3a9t h PRO 501 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3a9t h PRO 501 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3a9t h PRO 501 CO -0.04 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 177.98 3a9t n THR 502 N -3.03 0.60 -4.23 1.56 -2.24 -1.26 -4.90 114.28 100.78 3a9t n THR 502 Ca -0.03 -0.65 -0.24 0.00 -2.27 0.00 0.00 64.05 60.86 3a9t n THR 502 Cb 0.13 0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 3a9t n THR 502 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 3a9t s TRP 503 N -1.40 2.81 0.15 4.78 0.51 -0.92 -4.21 118.94 120.66 3a9t s TRP 503 Ca 0.35 -0.17 -0.30 0.00 -2.12 0.00 0.00 56.10 53.85 3a9t s TRP 503 Cb 0.18 -1.30 -0.08 0.00 -0.81 0.00 0.00 33.47 31.47 3a9t s TRP 503 CO 0.25 0.56 1.31 -1.25 -0.51 0.00 0.00 176.95 177.31 3a9t s PRO 504 N -3.39 4.38 -0.06 4.98 0.04 -0.44 -4.43 135.00 136.07 3a9t s PRO 504 Ca 0.30 2.01 0.04 0.00 0.04 0.00 0.00 61.00 63.39 3a9t s PRO 504 Cb -0.08 -3.23 -0.02 0.00 0.04 0.00 0.00 34.50 31.21 3a9t s PRO 504 CO 0.20 -0.30 -0.17 0.99 0.04 0.00 0.00 177.00 177.76 3a9t s THR 505 N 0.54 2.76 -0.09 1.26 2.01 -0.37 -4.07 115.64 117.68 3a9t s THR 505 Ca 0.59 -0.82 -0.02 0.00 0.31 0.00 0.00 61.69 61.75 3a9t s THR 505 Cb -0.35 -2.07 0.04 0.00 0.01 0.00 0.00 72.50 70.13 3a9t s THR 505 CO 0.34 0.58 0.03 -0.89 -0.69 0.00 0.00 174.62 173.99 3a9t s THR 506 N -0.45 0.21 -0.34 -0.82 2.01 -0.69 -1.46 115.64 114.10 3a9t s THR 506 Ca 0.05 0.10 -0.23 0.00 0.31 0.00 0.00 61.69 61.92 3a9t s THR 506 Cb -0.12 -0.49 0.00 0.00 0.01 0.00 0.00 72.50 71.91 3a9t s THR 506 CO 0.02 0.13 0.78 0.26 -0.69 0.00 0.00 174.62 175.12 3a9t s TRP 507 N 2.03 3.15 -0.09 4.92 0.52 -1.26 -1.89 118.94 126.32 3a9t s TRP 507 Ca 0.04 0.67 -0.00 0.00 0.02 0.00 0.00 56.10 56.83 3a9t s TRP 507 Cb -0.13 -3.31 -0.03 0.00 -1.15 0.00 0.00 33.47 28.85 3a9t s TRP 507 CO -0.05 -0.65 -0.07 0.12 0.02 0.00 0.00 176.95 176.31 3a9t s PHE 508 N 3.03 2.94 -0.20 -1.98 5.36 -0.58 -1.03 117.98 125.52 3a9t s PHE 508 Ca 0.32 -0.11 -0.01 0.00 -0.96 0.00 0.00 56.93 56.16 3a9t s PHE 508 Cb -0.14 -1.77 0.05 0.00 -0.34 0.00 0.00 43.02 40.83 3a9t s PHE 508 CO 0.15 0.20 -0.01 0.08 -1.46 0.00 0.00 175.22 174.18 3a9t s VAL 509 N -0.46 0.96 0.52 3.12 1.01 0.11 -0.78 120.40 124.89 3a9t s VAL 509 Ca 0.07 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 3a9t s VAL 509 Cb -0.12 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.88 3a9t s VAL 509 CO 0.02 -0.09 1.01 -2.16 0.00 0.00 0.00 175.10 173.88 3a9t s PRO 510 N 1.67 3.81 0.26 2.72 0.04 -1.26 -0.77 135.00 141.47 3a9t s PRO 510 Ca -0.02 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 61.82 3a9t s PRO 510 Cb -0.17 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 3a9t s PRO 510 CO -0.07 -0.39 1.11 -0.80 0.04 0.00 0.00 177.00 176.89 3a9t s ASN 511 N -2.72 7.24 0.09 6.66 0.01 0.03 -4.91 114.94 121.33 3a9t s ASN 511 Ca 0.62 2.25 0.03 0.00 -0.71 0.00 0.00 52.86 55.05 3a9t s ASN 511 Cb -0.12 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.88 3a9t s ASN 511 CO 0.28 -0.18 0.12 -0.76 -1.51 0.00 0.00 177.10 175.06 3a9t s LEU 512 N -1.22 3.95 -0.00 0.60 1.43 -1.26 -4.90 118.68 117.27 3a9t s LEU 512 Ca 0.46 0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.66 3a9t s LEU 512 Cb -0.32 -2.60 -0.07 0.00 0.03 0.00 0.00 46.19 43.23 3a9t s LEU 512 CO 0.40 0.16 0.19 0.35 0.23 0.00 0.00 176.35 177.67 3a9t n THR 513 N 0.30 0.00 -0.33 5.49 -2.24 -0.69 -4.99 114.28 111.83 3a9t n THR 513 Ca -0.08 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 3a9t n THR 513 Cb 0.52 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3a9t n THR 513 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a9t n GLY 514 N 1.57 1.41 3.38 3.38 0.00 -0.63 -4.97 105.19 109.33 3a9t n GLY 514 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3a9t n GLY 514 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a9t s GLU 515 N -0.34 1.60 3.42 1.61 2.02 -1.25 -4.58 118.70 121.18 3a9t s GLU 515 Ca 0.00 -1.90 0.00 0.00 0.02 0.00 0.00 54.97 53.09 3a9t s GLU 515 Cb 0.00 -0.41 0.00 0.00 0.10 0.00 0.00 34.13 33.82 3a9t s GLU 515 CO 0.00 -0.34 0.00 0.41 0.02 0.00 0.00 175.26 175.35 3a9t n GLY 516 N -0.62 2.41 0.00 -1.39 0.00 -1.26 -1.08 105.19 103.25 3a9t n GLY 516 Ca -0.01 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.80 3a9t n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9t n ALA 517 N 7.77 2.52 -1.95 4.61 0.00 -1.26 -3.58 120.51 128.62 3a9t n ALA 517 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 3a9t n ALA 517 Cb 0.00 -1.16 0.10 0.00 0.00 0.00 0.00 19.45 18.40 3a9t n ALA 517 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a9t n PHE 518 N -0.66 1.21 0.13 0.00 3.72 -0.24 -2.48 117.46 119.15 3a9t n PHE 518 Ca 0.07 -1.75 -0.00 0.00 -0.05 0.00 0.00 57.45 55.72 3a9t n PHE 518 Cb 0.03 -0.28 0.14 0.00 -0.94 0.00 0.00 39.48 38.43 3a9t n PHE 518 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3a9t h LYS 519 N 1.60 0.00 -2.95 -1.08 1.57 -1.59 -1.45 116.57 112.68 3a9t h LYS 519 Ca 0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3a9t h LYS 519 Cb 1.32 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.51 3a9t h LYS 519 CO 0.33 0.62 0.23 0.16 -0.57 0.00 0.00 179.45 180.22 3a9t s ASP 520 N -6.65 -0.54 0.24 0.86 1.47 -1.26 -4.54 116.67 106.24 3a9t s ASP 520 Ca 0.00 -0.02 -0.05 0.00 1.18 0.00 0.00 52.55 53.66 3a9t s ASP 520 Cb 0.11 0.59 0.46 0.00 -0.34 0.00 0.00 42.92 43.74 3a9t s ASP 520 CO 0.75 -0.96 1.69 0.58 0.68 0.00 0.00 175.17 177.91 3a9t h VAL 521 N 2.00 0.53 -0.35 2.11 2.07 -1.91 -1.70 116.25 119.01 3a9t h VAL 521 Ca -0.33 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.16 3a9t h VAL 521 Cb 1.30 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 3a9t h VAL 521 CO 0.37 0.05 0.02 0.22 0.02 0.00 0.00 177.57 178.25 3a9t h TYR 522 N 0.28 0.02 -0.85 1.57 3.20 -1.95 -2.26 116.97 116.98 3a9t h TYR 522 Ca 0.41 0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.44 3a9t h TYR 522 Cb 0.70 0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.95 3a9t h TYR 522 CO -0.25 -0.04 0.55 0.77 -1.64 0.00 0.00 178.16 177.55 3a9t h SER 523 N 0.12 0.62 -0.63 -2.11 0.02 -1.57 0.34 113.55 110.33 3a9t h SER 523 Ca 0.17 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3a9t h SER 523 Cb 0.22 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 3a9t h SER 523 CO -0.26 0.33 0.36 0.58 -1.14 0.00 0.00 176.83 176.70 3a9t h VAL 524 N 0.66 1.19 -0.01 2.27 2.07 -1.08 -1.06 116.25 120.29 3a9t h VAL 524 Ca 0.42 -0.46 -0.22 0.00 0.82 0.00 0.00 66.70 67.25 3a9t h VAL 524 Cb 0.67 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 3a9t h VAL 524 CO -0.18 0.21 -0.92 -0.03 0.02 0.00 0.00 177.57 176.67 3a9t h MET 525 N 0.86 0.41 0.00 1.57 1.85 -1.16 -3.00 114.93 115.46 3a9t h MET 525 Ca 0.22 -0.43 0.00 0.00 -0.61 0.00 0.00 59.70 58.89 3a9t h MET 525 Cb 0.01 0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.16 3a9t h MET 525 CO -0.04 1.09 0.00 -0.97 -0.40 0.00 0.00 176.91 176.59 3a9t h ASN 526 N 0.24 0.00 -0.35 1.39 -1.24 -0.76 -2.32 115.58 112.54 3a9t h ASN 526 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.94 3a9t h ASN 526 Cb 1.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.60 3a9t h ASN 526 CO 0.16 0.00 0.00 0.59 -1.29 0.00 0.00 177.43 176.89 3a9t n ASN 527 N -3.05 3.41 -4.71 1.15 3.02 -0.42 -4.91 115.26 109.75 3a9t n ASN 527 Ca 0.00 -1.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.14 3a9t n ASN 527 Cb 0.28 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 3a9t n ASN 527 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3a9t s TRP 528 N -1.52 3.42 -2.01 3.10 -0.11 -0.87 -4.91 118.94 116.04 3a9t s TRP 528 Ca 0.37 1.35 0.05 0.00 1.22 0.00 0.00 56.10 59.09 3a9t s TRP 528 Cb 0.22 -3.37 0.18 0.00 -1.50 0.00 0.00 33.47 29.00 3a9t s TRP 528 CO 0.31 -1.09 1.14 0.41 -4.62 0.00 0.00 176.95 173.10 3a9t n GLY 529 N 3.20 -0.45 3.84 5.86 0.00 -1.26 -4.90 105.19 111.48 3a9t n GLY 529 Ca 0.09 -0.14 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 3a9t n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9t s ALA 530 N -1.85 -1.25 -0.62 4.61 0.00 -1.26 -5.04 121.76 116.36 3a9t s ALA 530 Ca 0.10 -0.29 0.25 0.00 0.00 0.00 0.00 51.96 52.02 3a9t s ALA 530 Cb 0.05 0.79 0.60 0.00 0.00 0.00 0.00 23.12 24.57 3a9t s ALA 530 CO 0.07 -1.04 1.67 -2.95 0.00 0.00 0.00 175.76 173.51 3a9t h ASN 531 N 2.00 0.00 -1.65 0.00 -0.00 -1.94 -3.46 115.58 110.53 3a9t h ASN 531 Ca -0.21 -0.02 -0.53 0.00 -0.00 0.00 0.00 56.30 55.54 3a9t h ASN 531 Cb 1.25 0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 39.50 3a9t h ASN 531 CO 0.26 0.01 -0.47 -1.00 -0.00 0.00 0.00 177.43 176.23 3a9t s HIS 532 N -3.15 2.68 0.20 4.14 3.76 -1.26 -1.13 115.29 120.53 3a9t s HIS 532 Ca 0.09 -0.50 -0.23 0.00 -0.15 0.00 0.00 55.06 54.27 3a9t s HIS 532 Cb 0.10 -1.95 0.05 0.00 1.11 0.00 0.00 32.58 31.89 3a9t s HIS 532 CO 0.63 0.12 0.77 0.00 -0.85 0.00 0.00 174.74 175.42 3a9t s SER 534 N -2.85 3.29 -0.21 0.00 0.15 -0.29 -2.62 113.70 111.19 3a9t s SER 534 Ca 0.09 -0.50 -0.07 0.00 0.70 0.00 0.00 55.95 56.17 3a9t s SER 534 Cb -0.03 -1.35 -0.04 0.00 -1.71 0.00 0.00 66.02 62.89 3a9t s SER 534 CO 0.00 0.18 0.07 -0.63 1.20 0.00 0.00 173.24 174.06 3a9t s ILE 535 N 0.24 4.63 0.02 6.45 1.01 0.23 -1.05 121.20 132.72 3a9t s ILE 535 Ca -0.14 -0.08 0.07 0.00 0.00 0.00 0.00 60.65 60.50 3a9t s ILE 535 Cb -0.17 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 3a9t s ILE 535 CO 0.07 0.41 -0.21 -0.55 0.00 0.00 0.00 174.94 174.66 3a9t s SER 536 N 0.81 2.53 0.40 3.58 0.15 -0.37 -0.98 113.70 119.82 3a9t s SER 536 Ca 0.04 -0.47 -0.25 0.00 0.70 0.00 0.00 55.95 55.96 3a9t s SER 536 Cb -0.14 -0.24 -0.08 0.00 -1.71 0.00 0.00 66.02 63.85 3a9t s SER 536 CO 0.02 0.21 1.22 -0.47 1.20 0.00 0.00 173.24 175.42 3a9t s TYR 537 N -0.67 2.97 0.00 3.44 6.14 -1.26 -0.70 117.35 127.27 3a9t s TYR 537 Ca 0.08 1.50 0.00 0.00 0.64 0.00 0.00 57.07 59.29 3a9t s TYR 537 Cb -0.09 -3.50 0.00 0.00 0.42 0.00 0.00 41.96 38.80 3a9t s TYR 537 CO 0.01 -1.61 0.00 0.41 0.64 0.00 0.00 175.55 174.99 3a9t n GLY 538 N 0.66 -0.41 3.22 8.97 0.00 0.20 -4.76 105.19 113.07 3a9t n GLY 538 Ca 0.04 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 3a9t n GLY 538 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a9t s HIS 539 N -1.54 3.46 -0.18 1.61 3.76 -1.26 -2.34 115.29 118.81 3a9t s HIS 539 Ca 0.00 -1.97 0.16 0.00 -0.15 0.00 0.00 55.06 53.11 3a9t s HIS 539 Cb 0.00 -3.54 0.46 0.00 1.11 0.00 0.00 32.58 30.61 3a9t s HIS 539 CO 0.00 -0.97 1.35 0.44 -0.85 0.00 0.00 174.74 174.70 3a9t n ILE 540 N 4.56 2.21 -0.03 0.60 -5.35 -1.26 -4.74 119.36 115.35 3a9t n ILE 540 Ca -0.02 -2.14 -0.09 0.00 -0.27 0.00 0.00 62.75 60.22 3a9t n ILE 540 Cb 0.41 -0.26 -0.03 0.00 -1.74 0.00 0.00 39.64 38.02 3a9t n ILE 540 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3a9t h GLY 541 N 1.18 0.14 0.71 3.28 0.00 -1.97 -0.41 103.07 105.99 3a9t h GLY 541 Ca 0.03 0.04 0.05 0.00 0.00 0.00 0.00 47.33 47.45 3a9t h GLY 541 CO 0.18 -0.05 0.31 0.00 0.00 0.00 0.00 176.54 176.98 3a9t h ALA 542 N 1.16 0.77 -0.91 3.60 0.00 -1.89 0.14 119.26 122.12 3a9t h ALA 542 Ca 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3a9t h ALA 542 Cb 0.11 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3a9t h ALA 542 CO -0.16 -0.02 0.51 -0.44 0.00 0.00 0.00 179.25 179.15 3a9t h ASP 543 N 0.60 1.13 -0.60 0.00 3.32 -1.81 -1.19 116.42 117.87 3a9t h ASP 543 Ca 0.26 -0.09 -0.10 0.00 0.02 0.00 0.00 57.03 57.12 3a9t h ASP 543 Cb 0.15 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3a9t h ASP 543 CO -0.17 0.90 -0.00 -0.07 -1.72 0.00 0.00 179.24 178.18 3a9t h LEU 544 N 1.27 1.05 -0.33 1.55 3.38 -0.00 -0.97 115.31 121.26 3a9t h LEU 544 Ca 0.32 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3a9t h LEU 544 Cb 0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3a9t h LEU 544 CO -0.05 1.10 0.16 0.40 0.09 0.00 0.00 178.44 180.13 3a9t h ILE 545 N 0.98 1.16 -0.73 1.22 2.04 -0.27 0.20 117.51 122.11 3a9t h ILE 545 Ca 0.17 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 3a9t h ILE 545 Cb 0.56 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 3a9t h ILE 545 CO 0.03 0.17 0.24 0.74 0.00 0.00 0.00 178.15 179.33 3a9t h THR 546 N 0.40 1.26 -0.44 -0.27 2.02 -1.09 -0.61 112.91 114.18 3a9t h THR 546 Ca 0.11 -0.87 -0.05 0.00 0.77 0.00 0.00 66.41 66.37 3a9t h THR 546 Cb 0.12 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 3a9t h THR 546 CO -0.01 0.35 0.09 0.25 0.37 0.00 0.00 175.52 176.56 3a9t h LEU 547 N 1.08 0.68 -0.97 2.58 6.46 -0.71 -2.54 115.31 121.89 3a9t h LEU 547 Ca 0.24 -0.25 -0.06 0.00 -0.12 0.00 0.00 57.88 57.69 3a9t h LEU 547 Cb 0.28 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 3a9t h LEU 547 CO -0.01 0.76 0.08 0.00 -0.62 0.00 0.00 178.44 178.64 3a9t h ALA 548 N 0.95 1.16 -0.23 1.25 0.00 -0.28 -2.03 119.26 120.09 3a9t h ALA 548 Ca 0.13 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3a9t h ALA 548 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3a9t h ALA 548 CO 0.01 0.56 -0.17 0.66 0.00 0.00 0.00 179.25 180.31 3a9t h SER 549 N 0.78 0.38 0.20 0.00 4.64 -0.94 0.87 113.55 119.48 3a9t h SER 549 Ca 0.16 -0.10 -0.13 0.00 -0.47 0.00 0.00 61.79 61.25 3a9t h SER 549 Cb 0.36 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3a9t h SER 549 CO 0.01 0.57 -0.48 0.40 -0.87 0.00 0.00 176.83 176.46 3a9t h ILE 550 N 0.36 1.33 -0.01 0.95 2.04 -1.01 -2.58 117.51 118.60 3a9t h ILE 550 Ca 0.07 -1.69 0.00 0.00 1.00 0.00 0.00 64.86 64.23 3a9t h ILE 550 Cb 0.51 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 3a9t h ILE 550 CO 0.03 0.51 -0.08 0.18 0.00 0.00 0.00 178.15 178.79 3a9t n LEU 551 N -3.97 0.83 -3.47 1.44 4.77 -0.81 -4.93 117.00 110.85 3a9t n LEU 551 Ca -0.02 -0.20 -0.23 0.00 -0.03 0.00 0.00 56.01 55.53 3a9t n LEU 551 Cb 0.54 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.62 3a9t n LEU 551 CO 0.44 0.14 0.24 0.54 -1.33 0.00 0.00 177.39 177.42 3a9t n ARG 552 N -0.55 -7.66 -3.89 3.23 1.74 0.05 -4.94 116.66 104.64 3a9t n ARG 552 Ca 0.17 0.80 -0.35 0.00 -0.77 0.00 0.00 57.85 57.69 3a9t n ARG 552 Cb 0.29 -5.75 -0.14 0.00 -1.02 0.00 0.00 32.46 25.84 3a9t n ARG 552 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3a9t s ILE 553 N -3.31 3.20 0.55 0.55 1.01 0.08 -4.87 121.20 118.41 3a9t s ILE 553 Ca 0.56 -1.10 -0.21 0.00 0.00 0.00 0.00 60.65 59.90 3a9t s ILE 553 Cb -0.25 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.45 3a9t s ILE 553 CO 0.70 0.03 1.26 -2.16 0.00 0.00 0.00 174.94 174.77 3a9t s PRO 554 N 1.34 3.20 -0.47 2.79 0.04 -1.26 -4.37 135.00 136.27 3a9t s PRO 554 Ca -0.01 1.97 -0.08 0.00 0.04 0.00 0.00 61.00 62.92 3a9t s PRO 554 Cb -0.18 -2.16 0.12 0.00 0.04 0.00 0.00 34.50 32.32 3a9t s PRO 554 CO -0.01 -1.06 0.33 0.08 0.04 0.00 0.00 177.00 176.37 3a9t s VAL 555 N -1.46 4.02 0.14 -0.36 1.01 -1.26 -1.27 120.40 121.22 3a9t s VAL 555 Ca 0.72 -1.91 0.33 0.00 0.00 0.00 0.00 61.98 61.12 3a9t s VAL 555 Cb -0.34 -3.67 0.37 0.00 0.00 0.00 0.00 36.38 32.75 3a9t s VAL 555 CO 0.39 -0.77 1.98 -0.55 0.00 0.00 0.00 175.10 176.16 3a9t h ASN 556 N 8.29 0.00 -2.80 3.32 -1.07 -1.72 -3.44 115.58 118.16 3a9t h ASN 556 Ca -0.18 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.16 3a9t h ASN 556 Cb 1.06 0.00 -0.24 0.00 -2.07 0.00 0.00 38.32 37.07 3a9t h ASN 556 CO 0.82 0.03 -0.18 -0.32 0.07 0.00 0.00 177.43 177.85 3a9t s MET 557 N -3.71 0.51 -0.12 4.14 0.00 -1.25 -5.05 119.30 113.83 3a9t s MET 557 Ca 0.01 1.10 -0.30 0.00 0.00 0.00 0.00 55.69 56.49 3a9t s MET 557 Cb 0.09 0.26 0.10 0.00 0.00 0.00 0.00 34.83 35.28 3a9t s MET 557 CO 0.55 -0.18 0.87 -3.38 0.00 0.00 0.00 175.02 172.88 3a9t s HIS 558 N 1.98 -0.49 -0.41 4.11 -3.43 -1.24 0.73 115.29 116.53 3a9t s HIS 558 Ca -0.08 0.86 0.05 0.00 -0.80 0.00 0.00 55.06 55.09 3a9t s HIS 558 Cb -0.09 0.43 0.48 0.00 -1.43 0.00 0.00 32.58 31.97 3a9t s HIS 558 CO -0.16 -0.45 1.54 0.27 -2.00 0.00 0.00 174.74 173.94 3a9t n ASN 559 N 0.86 5.08 -4.73 7.38 6.94 -1.25 -5.00 115.26 124.54 3a9t n ASN 559 Ca -0.14 -3.77 -0.39 0.00 -0.02 0.00 0.00 54.58 50.26 3a9t n ASN 559 Cb 0.57 -0.62 -0.05 0.00 -2.36 0.00 0.00 39.78 37.32 3a9t n ASN 559 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3a9t s VAL 560 N -4.28 5.05 0.13 3.53 1.01 -1.26 -4.85 120.40 119.73 3a9t s VAL 560 Ca 0.54 1.24 -0.35 0.00 0.00 0.00 0.00 61.98 63.40 3a9t s VAL 560 Cb 0.44 -3.94 -0.15 0.00 0.00 0.00 0.00 36.38 32.73 3a9t s VAL 560 CO 0.02 0.32 1.45 -2.65 0.00 0.00 0.00 175.10 174.24 3a9t n PRO 561 N 3.45 1.68 0.07 2.72 -0.02 -1.26 -4.84 135.00 136.80 3a9t n PRO 561 Ca -0.05 0.60 0.18 0.00 -2.02 0.00 0.00 63.50 62.22 3a9t n PRO 561 Cb 0.51 -2.31 0.71 0.00 -0.02 0.00 0.00 33.50 32.40 3a9t n PRO 561 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3a9t h GLU 562 N 5.18 0.00 0.00 -0.52 5.08 -1.99 -0.36 114.58 121.97 3a9t h GLU 562 Ca -0.46 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.87 3a9t h GLU 562 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 3a9t h GLU 562 CO 0.83 0.00 -0.13 1.05 -1.00 0.00 0.00 179.01 179.76 3a9t h GLU 563 N 0.00 0.00 -0.00 2.33 9.09 -2.05 -2.15 114.58 121.80 3a9t h GLU 563 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 3a9t h GLU 563 Cb 0.83 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.93 3a9t h GLU 563 CO -0.00 0.13 -0.18 1.63 0.05 0.00 0.00 179.01 180.64 3a9t n LYS 564 N -3.63 0.41 -2.16 1.06 4.76 -0.15 -4.86 118.16 113.59 3a9t n LYS 564 Ca -0.02 -0.15 -0.43 0.00 -2.87 0.00 0.00 58.31 54.84 3a9t n LYS 564 Cb 0.26 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.93 3a9t n LYS 564 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3a9t s ILE 565 N -2.69 3.83 -0.32 -0.18 1.01 -0.81 -4.86 121.20 117.18 3a9t s ILE 565 Ca 0.22 0.99 0.03 0.00 0.00 0.00 0.00 60.65 61.89 3a9t s ILE 565 Cb 0.19 -3.68 0.09 0.00 0.01 0.00 0.00 42.46 39.07 3a9t s ILE 565 CO 0.54 -0.14 0.02 0.12 0.00 0.00 0.00 174.94 175.48 3a9t s PHE 566 N 4.10 3.45 0.28 3.97 5.36 -1.26 -5.10 117.98 128.77 3a9t s PHE 566 Ca 0.67 -2.73 0.08 0.00 -0.96 0.00 0.00 56.93 53.99 3a9t s PHE 566 Cb -0.28 -2.60 -0.06 0.00 -0.34 0.00 0.00 43.02 39.75 3a9t s PHE 566 CO 0.25 -0.92 -0.10 1.03 -1.46 0.00 0.00 175.22 174.01 3a9t s ARG 567 N 1.02 1.58 0.49 10.12 0.52 -1.26 -4.18 118.95 127.24 3a9t s ARG 567 Ca 0.07 -1.78 -0.22 0.00 -0.52 0.00 0.00 55.73 53.29 3a9t s ARG 567 Cb -0.19 -1.35 -0.09 0.00 0.52 0.00 0.00 34.95 33.84 3a9t s ARG 567 CO -0.09 0.13 0.91 -2.30 0.02 0.00 0.00 175.30 173.98 3a9t n PRO 568 N -0.59 1.08 -0.31 3.54 -0.02 -1.26 -4.72 135.00 132.71 3a9t n PRO 568 Ca -0.06 0.40 0.13 0.00 -2.02 0.00 0.00 63.50 61.95 3a9t n PRO 568 Cb 0.62 -2.01 0.31 0.00 -0.02 0.00 0.00 33.50 32.40 3a9t n PRO 568 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3a9t h ASP 569 N 1.03 0.39 -0.06 2.55 3.58 -1.24 -0.76 116.42 121.91 3a9t h ASP 569 Ca -0.46 0.15 0.02 0.00 0.42 0.00 0.00 57.03 57.16 3a9t h ASP 569 Cb 1.36 0.11 -0.00 0.00 1.72 0.00 0.00 39.33 42.51 3a9t h ASP 569 CO 0.54 0.03 0.12 0.00 -2.88 0.00 0.00 179.24 177.04 3a9t h ALA 570 N 1.70 1.42 -0.90 -0.78 0.00 -1.89 -2.60 119.26 116.21 3a9t h ALA 570 Ca 0.56 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.53 3a9t h ALA 570 Cb 1.05 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3a9t h ALA 570 CO -0.51 -0.15 0.57 -1.49 0.00 0.00 0.00 179.25 177.67 3a9t h TRP 571 N 0.00 1.06 0.00 0.00 6.55 -1.46 -0.87 115.95 121.23 3a9t h TRP 571 Ca 0.03 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.90 3a9t h TRP 571 Cb 0.26 -0.34 0.00 0.00 -0.86 0.00 0.00 29.16 28.22 3a9t h TRP 571 CO 0.00 0.56 0.00 0.66 -1.05 0.00 0.00 178.44 178.61 3a9t h SER 572 N 1.05 0.00 1.26 -3.49 4.64 -1.65 -1.18 113.55 114.18 3a9t h SER 572 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3a9t h SER 572 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3a9t h SER 572 CO -0.16 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 176.04 3a9t h MET 573 N 0.00 0.00 -0.66 4.77 2.86 -1.29 -2.43 114.93 118.18 3a9t h MET 573 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3a9t h MET 573 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3a9t h MET 573 CO 0.00 0.00 0.00 1.19 1.06 0.00 0.00 176.91 179.16 3a9t n PHE 574 N -2.54 0.88 0.00 -0.22 3.01 -0.45 -5.01 117.46 113.14 3a9t n PHE 574 Ca 0.03 -0.44 0.00 0.00 1.01 0.00 0.00 57.45 58.05 3a9t n PHE 574 Cb 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 3a9t n PHE 574 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3a9t n GLY 575 N 1.60 4.56 0.00 1.37 0.00 -0.91 -4.28 105.19 107.54 3a9t n GLY 575 Ca 0.23 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3a9t n GLY 575 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3a9t n THR 576 N -1.61 0.00 0.08 2.61 -2.24 -1.26 -4.37 114.28 107.50 3a9t n THR 576 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 3a9t n THR 576 Cb 0.00 -0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 67.69 3a9t n THR 576 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3a9t h LYS 577 N 0.00 0.17 -2.98 -0.78 1.63 -1.96 -3.40 116.57 109.25 3a9t h LYS 577 Ca 0.00 -0.22 -0.61 0.00 -0.85 0.00 0.00 60.65 58.97 3a9t h LYS 577 Cb 0.65 0.07 -0.40 0.00 -0.60 0.00 0.00 32.23 31.95 3a9t h LYS 577 CO 0.00 1.00 -0.75 0.34 -3.45 0.00 0.00 179.45 176.59 3a9t s ASP 578 N -6.93 3.60 0.39 4.20 2.15 -1.26 -4.99 116.67 113.83 3a9t s ASP 578 Ca -0.02 -2.50 0.06 0.00 0.43 0.00 0.00 52.55 50.52 3a9t s ASP 578 Cb 0.10 -0.95 0.80 0.00 -0.30 0.00 0.00 42.92 42.57 3a9t s ASP 578 CO 0.84 -0.28 2.04 -0.07 -0.17 0.00 0.00 175.17 177.52 3a9t h LEU 579 N 6.86 0.54 0.40 -1.34 3.38 -1.85 -0.98 115.31 122.33 3a9t h LEU 579 Ca -0.01 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3a9t h LEU 579 Cb 0.94 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3a9t h LEU 579 CO 0.45 0.39 -0.19 -0.08 0.09 0.00 0.00 178.44 179.10 3a9t h GLU 580 N 0.64 -0.52 -0.93 1.13 4.81 -1.94 0.19 114.58 117.96 3a9t h GLU 580 Ca 0.18 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.52 3a9t h GLU 580 Cb -0.05 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 29.38 3a9t h GLU 580 CO -0.04 -0.28 0.58 0.78 -0.73 0.00 0.00 179.01 179.32 3a9t h GLY 581 N -0.67 1.43 1.45 1.92 0.00 -1.90 -1.71 103.07 103.58 3a9t h GLY 581 Ca -0.06 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 3a9t h GLY 581 CO 0.09 0.26 -0.08 0.00 0.00 0.00 0.00 176.54 176.82 3a9t h ALA 582 N 1.45 1.14 -0.01 3.60 0.00 -0.89 -1.70 119.26 122.85 3a9t h ALA 582 Ca 0.42 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3a9t h ALA 582 Cb 0.23 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3a9t h ALA 582 CO -0.19 0.54 -0.01 0.22 0.00 0.00 0.00 179.25 179.81 3a9t h ASP 583 N 0.61 -0.02 -0.39 0.00 3.58 0.28 0.16 116.42 120.64 3a9t h ASP 583 Ca 0.11 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 3a9t h ASP 583 Cb 0.50 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 3a9t h ASP 583 CO 0.03 -0.01 0.20 1.88 -2.88 0.00 0.00 179.24 178.46 3a9t h TYR 584 N -0.01 0.54 -0.60 0.28 -1.99 -1.25 0.10 116.97 114.04 3a9t h TYR 584 Ca 0.01 -0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.68 3a9t h TYR 584 Cb 0.02 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.55 3a9t h TYR 584 CO -0.09 0.44 0.24 0.00 -0.00 0.00 0.00 178.16 178.75 3a9t h ARG 585 N 0.49 0.90 -0.41 4.88 3.08 -1.09 -1.78 114.38 120.45 3a9t h ARG 585 Ca 0.13 -0.16 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 3a9t h ARG 585 Cb 0.09 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3a9t h ARG 585 CO -0.02 0.76 -0.31 0.00 -1.07 0.00 0.00 179.97 179.33 3a9t h ALA 586 N 1.09 0.68 -0.61 0.04 0.00 -0.51 -2.09 119.26 117.85 3a9t h ALA 586 Ca 0.20 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3a9t h ALA 586 Cb 0.20 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3a9t h ALA 586 CO -0.02 0.67 0.07 0.00 0.00 0.00 0.00 179.25 179.98 3a9t h LYS 588 N 0.94 -0.20 -0.10 0.00 1.63 -1.27 -3.35 116.57 114.23 3a9t h LYS 588 Ca 0.18 0.01 -0.20 0.00 -0.85 0.00 0.00 60.65 59.80 3a9t h LYS 588 Cb 0.47 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 3a9t h LYS 588 CO 0.02 0.18 -0.76 0.87 -3.45 0.00 0.00 179.45 176.31 3a9t h LYS 589 N -0.62 0.54 -0.01 1.90 1.79 -1.45 -3.52 116.57 115.20 3a9t h LYS 589 Ca -0.02 -0.45 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 3a9t h LYS 589 Cb 0.47 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 3a9t h LYS 589 CO 0.03 1.07 0.00 1.28 -1.08 0.00 0.00 179.45 180.76