#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 4.26 -0.11 0.00 2.47 -1.26 -1.52 119.74 123.58 3a9t s LYS 3 Ca 0.00 2.32 -0.29 0.00 -1.56 0.00 0.00 55.97 56.43 3a9t s LYS 3 Cb 0.00 -3.09 -0.03 0.00 -1.46 0.00 0.00 37.83 33.24 3a9t s LYS 3 CO 0.00 -0.41 1.41 0.34 0.16 0.00 0.00 175.35 176.85 3a9t s ASP 4 N 0.24 6.84 0.53 1.43 -1.08 -0.85 -4.74 116.67 119.05 3a9t s ASP 4 Ca 0.58 1.91 0.36 0.00 -0.52 0.00 0.00 52.55 54.88 3a9t s ASP 4 Cb -0.42 -2.54 1.92 0.00 -1.46 0.00 0.00 42.92 40.42 3a9t s ASP 4 CO 0.46 -0.81 2.09 1.55 0.52 0.00 0.00 175.17 178.97 3a9t h PRO 5 N 8.63 0.00 0.00 4.34 0.13 -1.92 -3.30 132.00 139.88 3a9t h PRO 5 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3a9t h PRO 5 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3a9t h PRO 5 CO 0.96 0.00 -0.92 0.54 -0.23 0.00 0.00 178.00 178.34 3a9t n ARG 6 N -2.76 1.46 -4.14 0.86 1.74 -1.26 -5.09 116.66 107.47 3a9t n ARG 6 Ca -0.02 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.83 3a9t n ARG 6 Cb 0.06 -0.96 -0.05 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.92 3.05 0.58 -1.55 1.51 -1.25 -4.96 117.35 112.81 3a9t s TYR 7 Ca 0.00 -0.12 -0.19 0.00 -1.01 0.00 0.00 57.07 55.75 3a9t s TYR 7 Cb 0.00 -1.38 -0.06 0.00 -0.11 0.00 0.00 41.96 40.41 3a9t s TYR 7 CO 0.00 0.53 0.94 0.28 -1.11 0.00 0.00 175.55 176.19 3a9t n VAL 8 N -1.07 3.41 -4.30 0.71 0.31 -1.26 -4.40 118.33 111.73 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 0.58 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.39 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 1.31 -1.16 3.75 2.92 0.00 -1.26 -4.85 105.19 105.90 3a9t n GLY 9 Ca 0.13 -1.22 -0.23 0.00 0.00 0.00 0.00 46.02 44.70 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 4.89 0.35 1.61 0.01 -1.26 -2.00 114.94 114.53 3a9t s ASN 10 Ca 0.00 -0.62 -0.27 0.00 -0.71 0.00 0.00 52.86 51.26 3a9t s ASN 10 Cb 0.00 -0.90 -0.09 0.00 0.41 0.00 0.00 41.25 40.67 3a9t s ASN 10 CO 0.00 -0.21 1.12 -0.76 -1.51 0.00 0.00 177.10 175.74 3a9t s LEU 11 N -3.84 4.33 0.40 0.60 1.43 -0.57 -4.72 118.68 116.31 3a9t s LEU 11 Ca 0.36 2.26 -0.26 0.00 -1.03 0.00 0.00 54.13 55.47 3a9t s LEU 11 Cb -0.05 -3.89 -0.10 0.00 0.03 0.00 0.00 46.19 42.18 3a9t s LEU 11 CO 0.23 -0.42 1.27 -2.65 0.23 0.00 0.00 176.35 175.01 3a9t n PRO 12 N 0.50 1.97 -4.26 1.29 -0.02 -1.26 -4.71 135.00 128.51 3a9t n PRO 12 Ca 0.02 0.70 -0.23 0.00 -2.02 0.00 0.00 63.50 61.97 3a9t n PRO 12 Cb 0.46 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.51 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 -2.12 2.40 -0.23 -0.52 1.02 -0.90 -4.67 119.74 114.72 3a9t s LYS 13 Ca 0.60 -1.36 -0.06 0.00 0.02 0.00 0.00 55.97 55.16 3a9t s LYS 13 Cb -0.52 -2.23 -0.02 0.00 -0.52 0.00 0.00 37.83 34.54 3a9t s LYS 13 CO 0.59 0.36 0.03 0.42 -0.92 0.00 0.00 175.35 175.83 3a9t s ILE 14 N -2.30 4.04 -0.11 2.17 1.01 -0.58 -0.10 121.20 125.34 3a9t s ILE 14 Ca 0.32 -0.27 -0.13 0.00 0.00 0.00 0.00 60.65 60.57 3a9t s ILE 14 Cb -0.06 -2.86 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 3a9t s ILE 14 CO 0.21 0.38 0.32 -0.83 0.00 0.00 0.00 174.94 175.02 3a9t s GLY 15 N 1.39 2.29 -0.21 6.18 0.00 0.90 -0.44 107.32 117.44 3a9t s GLY 15 Ca 0.05 -0.40 -0.05 0.00 0.00 0.00 0.00 44.72 44.32 3a9t s GLY 15 CO 0.02 0.27 0.01 -0.42 0.00 0.00 0.00 173.10 172.97 3a9t s ILE 16 N -0.15 4.03 -0.43 0.90 -1.09 0.10 -1.08 121.20 123.48 3a9t s ILE 16 Ca 0.19 -0.28 -0.06 0.00 -2.23 0.00 0.00 60.65 58.27 3a9t s ILE 16 Cb -0.14 -2.83 0.11 0.00 -1.58 0.00 0.00 42.46 38.02 3a9t s ILE 16 CO 0.07 0.42 0.26 -0.13 -1.23 0.00 0.00 174.94 174.32 3a9t s ARG 17 N 1.07 2.23 -0.33 2.79 0.52 0.89 -2.51 118.95 123.61 3a9t s ARG 17 Ca 0.02 -1.76 -0.25 0.00 -0.52 0.00 0.00 55.73 53.22 3a9t s ARG 17 Cb -0.14 -3.72 0.01 0.00 0.52 0.00 0.00 34.95 31.62 3a9t s ARG 17 CO 0.02 -1.10 0.87 -1.25 0.02 0.00 0.00 175.30 173.86 3a9t s PRO 18 N 1.25 3.94 0.19 3.54 0.04 -1.26 -1.36 135.00 141.33 3a9t s PRO 18 Ca 0.07 0.66 -0.02 0.00 0.04 0.00 0.00 61.00 61.75 3a9t s PRO 18 Cb -0.24 -3.75 -0.05 0.00 0.04 0.00 0.00 34.50 30.50 3a9t s PRO 18 CO -0.02 -0.79 0.39 0.95 0.04 0.00 0.00 177.00 177.57 3a9t s THR 19 N 3.21 5.19 0.12 1.26 -4.23 -0.45 -0.45 115.64 120.29 3a9t s THR 19 Ca 0.36 -0.23 -0.09 0.00 -1.18 0.00 0.00 61.69 60.55 3a9t s THR 19 Cb -0.13 -3.70 -0.00 0.00 1.34 0.00 0.00 72.50 70.00 3a9t s THR 19 CO 0.15 -0.12 0.23 -0.51 -0.54 0.00 0.00 174.62 173.82 3a9t s ILE 20 N -1.82 0.11 0.20 2.99 2.07 0.01 -4.57 121.20 120.20 3a9t s ILE 20 Ca 0.39 -1.27 -0.30 0.00 -1.41 0.00 0.00 60.65 58.06 3a9t s ILE 20 Cb -0.11 -1.55 -0.09 0.00 0.13 0.00 0.00 42.46 40.84 3a9t s ILE 20 CO 0.28 -0.51 1.40 -0.62 -1.91 0.00 0.00 174.94 173.59 3a9t s ASP 21 N -2.91 6.75 0.54 4.50 -1.08 -1.14 -4.16 116.67 119.17 3a9t s ASP 21 Ca 0.10 2.52 0.33 0.00 -0.52 0.00 0.00 52.55 54.98 3a9t s ASP 21 Cb 0.04 -2.61 1.31 0.00 -1.46 0.00 0.00 42.92 40.20 3a9t s ASP 21 CO -0.07 -0.65 1.97 1.23 0.52 0.00 0.00 175.17 178.17 3a9t h GLY 22 N 5.63 0.00 -5.70 2.66 0.00 -1.84 -3.38 103.07 100.45 3a9t h GLY 22 Ca -0.45 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.34 3a9t h GLY 22 CO 0.81 0.00 1.23 0.50 0.00 0.00 0.00 176.54 179.07 3a9t s ARG 23 N -3.66 3.93 0.57 4.80 0.52 -1.26 -4.87 118.95 118.98 3a9t s ARG 23 Ca 0.01 2.28 0.06 0.00 -0.52 0.00 0.00 55.73 57.56 3a9t s ARG 23 Cb 0.09 -4.14 0.10 0.00 0.52 0.00 0.00 34.95 31.52 3a9t s ARG 23 CO 0.55 -1.17 0.78 0.54 0.02 0.00 0.00 175.30 176.03 3a9t n ARG 24 N 7.66 0.40 -3.57 3.54 1.74 -1.26 -0.12 116.66 125.05 3a9t n ARG 24 Ca 0.21 -2.67 -0.22 0.00 -0.77 0.00 0.00 57.85 54.40 3a9t n ARG 24 Cb 0.43 -0.35 0.08 0.00 -1.02 0.00 0.00 32.46 31.59 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 -2.32 -7.36 0.00 5.56 5.02 -1.26 -4.47 118.16 113.33 3a9t n LYS 25 Ca 0.15 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 3a9t n LYS 25 Cb 0.53 -5.84 0.00 0.00 -0.02 0.00 0.00 35.03 29.70 3a9t n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9t n GLY 26 N -1.72 -1.08 0.51 0.72 0.00 -1.26 -5.03 105.19 97.32 3a9t n GLY 26 Ca -0.09 0.39 -0.20 0.00 0.00 0.00 0.00 46.02 46.12 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 0.04 -0.36 1.61 2.07 -1.78 -3.14 116.25 114.69 3a9t h VAL 27 Ca 0.00 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.55 3a9t h VAL 27 Cb 0.00 0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 29.76 3a9t h VAL 27 CO 0.00 0.00 0.02 -0.09 0.02 0.00 0.00 177.57 177.52 3a9t h ARG 28 N -1.31 0.12 -0.41 1.57 2.43 -0.70 -2.06 114.38 114.02 3a9t h ARG 28 Ca -0.13 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.11 3a9t h ARG 28 Cb 0.98 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 3a9t h ARG 28 CO 0.21 0.08 0.28 0.93 -1.51 0.00 0.00 179.97 179.96 3a9t h GLU 29 N 0.12 0.20 -0.00 0.20 3.07 -1.82 -0.75 114.58 115.61 3a9t h GLU 29 Ca 0.18 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 3a9t h GLU 29 Cb 0.24 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3a9t h GLU 29 CO -0.28 0.13 -0.01 -1.13 -1.40 0.00 0.00 179.01 176.33 3a9t n SER 30 N -4.46 0.01 0.00 1.42 3.41 -0.79 -3.71 113.62 109.50 3a9t n SER 30 Ca 0.06 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 3a9t n SER 30 Cb 0.33 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.42 0.53 -0.28 1.04 4.77 -0.46 -4.76 117.00 116.41 3a9t n LEU 31 Ca 0.09 -0.70 0.03 0.00 -0.03 0.00 0.00 56.01 55.40 3a9t n LEU 31 Cb 0.31 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.56 3a9t n LEU 31 CO 0.26 0.13 1.12 -0.33 -1.33 0.00 0.00 177.39 177.24 3a9t h GLU 32 N 0.00 0.71 0.24 3.23 4.39 -1.27 -0.63 114.58 121.24 3a9t h GLU 32 Ca 0.00 -0.04 -0.34 0.00 0.34 0.00 0.00 59.36 59.32 3a9t h GLU 32 Cb 0.04 -0.16 0.03 0.00 -0.10 0.00 0.00 28.75 28.56 3a9t h GLU 32 CO 0.00 0.47 -1.51 1.49 -1.16 0.00 0.00 179.01 178.30 3a9t h GLU 33 N 0.73 0.50 -0.70 2.33 4.81 -1.86 -2.95 114.58 117.45 3a9t h GLU 33 Ca 0.39 -0.86 -0.07 0.00 -0.13 0.00 0.00 59.36 58.69 3a9t h GLU 33 Cb 0.40 0.32 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 3a9t h GLU 33 CO -0.26 1.41 0.16 1.15 -0.73 0.00 0.00 179.01 180.73 3a9t h THR 34 N 0.14 1.26 -0.16 0.32 2.02 -1.82 -0.76 112.91 113.92 3a9t h THR 34 Ca -0.26 -0.99 -0.07 0.00 0.77 0.00 0.00 66.41 65.86 3a9t h THR 34 Cb 2.15 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 69.12 3a9t h THR 34 CO 0.26 0.38 -0.19 0.74 0.37 0.00 0.00 175.52 177.08 3a9t h THR 35 N 1.06 1.35 -0.39 3.16 2.02 -1.23 -2.33 112.91 116.54 3a9t h THR 35 Ca 0.22 -1.38 -0.07 0.00 0.77 0.00 0.00 66.41 65.95 3a9t h THR 35 Cb 0.39 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 3a9t h THR 35 CO 0.00 0.41 -0.04 -0.03 0.37 0.00 0.00 175.52 176.23 3a9t h MET 36 N 0.03 0.65 0.00 6.66 -1.53 -1.46 -1.98 114.93 117.30 3a9t h MET 36 Ca 0.02 -0.17 -0.06 0.00 -3.44 0.00 0.00 59.70 56.05 3a9t h MET 36 Cb 0.74 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 31.71 3a9t h MET 36 CO 0.05 0.70 -0.29 -0.91 0.14 0.00 0.00 176.91 176.59 3a9t h ASN 37 N 0.61 0.00 -0.43 1.39 -0.26 -1.09 -1.93 115.58 113.87 3a9t h ASN 37 Ca 0.12 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.73 3a9t h ASN 37 Cb 0.45 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.70 3a9t h ASN 37 CO 0.02 0.29 -0.23 -0.03 -1.06 0.00 0.00 177.43 176.42 3a9t h MET 38 N 0.00 0.91 -0.54 0.81 4.05 -0.79 -1.79 114.93 117.57 3a9t h MET 38 Ca -0.00 -0.41 -0.08 0.00 -0.28 0.00 0.00 59.70 58.93 3a9t h MET 38 Cb 0.63 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.39 3a9t h MET 38 CO 0.04 1.06 0.03 0.00 0.23 0.00 0.00 176.91 178.27 3a9t h ALA 39 N 0.82 0.72 -0.63 0.39 0.00 -1.08 -2.59 119.26 116.89 3a9t h ALA 39 Ca 0.09 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3a9t h ALA 39 Cb 0.81 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3a9t h ALA 39 CO 0.07 0.51 0.12 0.87 0.00 0.00 0.00 179.25 180.82 3a9t h LYS 40 N 0.81 1.02 -0.82 0.00 1.57 -1.25 -1.59 116.57 116.31 3a9t h LYS 40 Ca 0.16 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3a9t h LYS 40 Cb 0.49 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 3a9t h LYS 40 CO 0.02 0.93 0.52 0.00 -0.57 0.00 0.00 179.45 180.35 3a9t h ALA 41 N 1.16 1.05 -0.15 3.86 0.00 -1.13 0.84 119.26 124.88 3a9t h ALA 41 Ca 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3a9t h ALA 41 Cb 0.40 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3a9t h ALA 41 CO 0.01 0.48 0.02 0.28 0.00 0.00 0.00 179.25 180.05 3a9t h VAL 42 N 1.12 1.22 -0.53 0.00 2.07 -1.20 -0.44 116.25 118.48 3a9t h VAL 42 Ca 0.30 -0.71 0.07 0.00 0.82 0.00 0.00 66.70 67.18 3a9t h VAL 42 Cb -0.08 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 3a9t h VAL 42 CO -0.06 0.21 0.22 0.00 0.02 0.00 0.00 177.57 177.96 3a9t h ALA 43 N 0.81 0.67 -0.72 1.67 0.00 -0.79 0.18 119.26 121.08 3a9t h ALA 43 Ca 0.05 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3a9t h ALA 43 Cb 0.30 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3a9t h ALA 43 CO 0.00 -0.17 0.32 -0.22 0.00 0.00 0.00 179.25 179.19 3a9t h LYS 44 N 0.42 1.04 0.00 0.00 3.64 -0.64 -1.05 116.57 119.98 3a9t h LYS 44 Ca 0.25 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3a9t h LYS 44 Cb 0.25 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3a9t h LYS 44 CO -0.23 0.82 -0.00 1.25 -2.27 0.00 0.00 179.45 179.01 3a9t h LEU 45 N 1.02 -0.00 -0.64 5.20 5.85 0.10 -2.73 115.31 124.10 3a9t h LEU 45 Ca 0.24 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 3a9t h LEU 45 Cb 0.14 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 3a9t h LEU 45 CO -0.03 0.26 0.22 -0.07 -0.34 0.00 0.00 178.44 178.48 3a9t h LEU 46 N -0.26 0.93 -2.36 2.25 3.38 -0.86 -2.17 115.31 116.22 3a9t h LEU 46 Ca -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3a9t h LEU 46 Cb 0.26 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3a9t h LEU 46 CO 0.00 0.88 -0.03 -0.33 0.09 0.00 0.00 178.44 179.04 3a9t h GLU 47 N 0.92 0.00 -0.06 1.13 5.08 -1.19 0.27 114.58 120.74 3a9t h GLU 47 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3a9t h GLU 47 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3a9t h GLU 47 CO -0.01 0.03 0.00 0.39 -1.00 0.00 0.00 179.01 178.42 3a9t n GLU 48 N -3.67 2.28 0.00 2.33 1.02 -0.87 -4.56 120.64 117.18 3a9t n GLU 48 Ca -0.03 -1.93 0.00 0.00 -0.02 0.00 0.00 57.16 55.18 3a9t n GLU 48 Cb 0.13 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 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 1.34 0.79 -4.20 1.62 3.02 -0.72 -5.05 115.26 112.06 3a9t n ASN 49 Ca 0.14 -0.07 -0.33 0.00 -0.03 0.00 0.00 54.58 54.29 3a9t n ASN 49 Cb 0.59 0.30 -0.16 0.00 -0.61 0.00 0.00 39.78 39.90 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 -0.46 2.23 -0.01 2.41 1.01 0.89 -5.06 120.40 121.41 3a9t s VAL 50 Ca 0.00 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.11 3a9t s VAL 50 Cb 0.00 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 3a9t s VAL 50 CO 0.00 0.54 -0.16 -0.36 0.00 0.00 0.00 175.10 175.12 3a9t s PHE 51 N 0.82 1.47 0.89 5.22 0.40 -1.26 -1.16 117.98 124.35 3a9t s PHE 51 Ca -0.07 -0.28 -0.10 0.00 -0.60 0.00 0.00 56.93 55.88 3a9t s PHE 51 Cb -0.15 -0.94 0.13 0.00 0.51 0.00 0.00 43.02 42.56 3a9t s PHE 51 CO -0.01 -0.02 1.12 0.71 0.70 0.00 0.00 175.22 177.72 3a9t s TYR 52 N -0.42 1.93 -0.41 0.36 4.12 0.86 -4.83 117.35 118.95 3a9t s TYR 52 Ca 0.06 1.65 0.09 0.00 0.02 0.00 0.00 57.07 58.90 3a9t s TYR 52 Cb -0.06 -3.23 0.51 0.00 -1.52 0.00 0.00 41.96 37.65 3a9t s TYR 52 CO -0.00 -2.56 1.21 2.48 0.02 0.00 0.00 175.55 176.70 3a9t n TYR 53 N -4.05 0.32 0.25 2.71 4.11 -1.26 -0.69 117.16 118.55 3a9t n TYR 53 Ca 0.10 0.17 0.12 0.00 -0.00 0.00 0.00 57.90 58.28 3a9t n TYR 53 Cb 0.53 -0.66 0.22 0.00 -0.00 0.00 0.00 39.34 39.42 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 -1.81 3.47 0.00 9.48 6.94 -1.26 -4.87 115.26 127.22 3a9t n ASN 54 Ca -0.01 -1.99 0.00 0.00 -0.02 0.00 0.00 54.58 52.57 3a9t n ASN 54 Cb 0.14 -0.26 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 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 1.47 3.14 3.77 4.83 0.00 0.13 -4.96 105.19 113.57 3a9t n GLY 55 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.89 3.56 0.28 1.61 -0.21 -1.26 -4.73 119.66 118.03 3a9t s GLN 56 Ca 0.00 1.79 -0.29 0.00 0.02 0.00 0.00 55.36 56.88 3a9t s GLN 56 Cb 0.00 -2.28 -0.10 0.00 1.00 0.00 0.00 33.01 31.63 3a9t s GLN 56 CO 0.00 -0.72 1.12 -2.14 -2.12 0.00 0.00 175.29 171.43 3a9t s PRO 57 N -2.88 4.61 0.38 2.91 0.02 -1.26 -0.10 135.00 138.68 3a9t s PRO 57 Ca 0.67 1.85 -0.27 0.00 0.02 0.00 0.00 61.00 63.28 3a9t s PRO 57 Cb -0.29 -3.18 -0.11 0.00 0.02 0.00 0.00 34.50 30.94 3a9t s PRO 57 CO 0.34 0.16 1.28 1.55 -0.33 0.00 0.00 177.00 180.01 3a9t n VAL 58 N 1.16 2.22 -3.77 3.83 3.14 -0.31 -4.76 118.33 119.84 3a9t n VAL 58 Ca -0.01 -0.50 -0.36 0.00 -2.96 0.00 0.00 64.34 60.51 3a9t n VAL 58 Cb 0.44 -1.57 -0.07 0.00 -1.06 0.00 0.00 33.84 31.58 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 -2.02 3.96 0.15 1.45 2.02 -1.26 -4.49 118.70 118.52 3a9t s GLU 59 Ca 0.58 -0.18 0.06 0.00 0.02 0.00 0.00 54.97 55.45 3a9t s GLU 59 Cb -0.54 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.30 3a9t s GLU 59 CO 0.61 0.45 0.05 0.00 0.02 0.00 0.00 175.26 176.38 3a9t s VAL 61 N -1.63 1.24 -0.07 0.00 1.01 0.42 -4.90 120.40 116.46 3a9t s VAL 61 Ca 0.28 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.75 3a9t s VAL 61 Cb -0.10 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 3a9t s VAL 61 CO 0.20 0.39 0.05 -0.63 0.00 0.00 0.00 175.10 175.11 3a9t s ILE 62 N 1.06 4.67 0.47 2.22 1.01 -1.26 0.01 121.20 129.37 3a9t s ILE 62 Ca -0.06 -0.19 -0.24 0.00 0.00 0.00 0.00 60.65 60.15 3a9t s ILE 62 Cb -0.15 -3.02 -0.08 0.00 0.01 0.00 0.00 42.46 39.22 3a9t s ILE 62 CO -0.01 0.55 1.35 0.00 0.00 0.00 0.00 174.94 176.82 3a9t n ALA 63 N 1.87 1.63 0.30 9.38 0.00 -1.04 -4.86 120.51 127.79 3a9t n ALA 63 Ca -0.18 0.22 0.17 0.00 0.00 0.00 0.00 53.44 53.66 3a9t n ALA 63 Cb 0.54 -2.33 0.98 0.00 0.00 0.00 0.00 19.45 18.64 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 1.96 0.00 -5.36 0.00 3.32 -1.94 -3.44 116.42 110.96 3a9t h ASP 64 Ca -0.50 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.43 3a9t h ASP 64 Cb 1.29 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.72 3a9t h ASP 64 CO 0.59 0.00 -0.33 0.42 -1.72 0.00 0.00 179.24 178.20 3a9t s THR 65 N -4.49 0.02 0.19 0.35 -4.23 -1.26 -5.13 115.64 101.09 3a9t s THR 65 Ca -0.05 -1.60 -0.30 0.00 -1.18 0.00 0.00 61.69 58.56 3a9t s THR 65 Cb 0.14 -2.22 -0.08 0.00 1.34 0.00 0.00 72.50 71.68 3a9t s THR 65 CO 0.50 -0.07 1.12 0.00 -0.54 0.00 0.00 174.62 175.63 3a9t s ILE 67 N -0.34 4.71 -0.08 0.00 1.01 0.41 -4.84 121.20 122.07 3a9t s ILE 67 Ca 0.49 0.70 0.02 0.00 0.00 0.00 0.00 60.65 61.86 3a9t s ILE 67 Cb -0.30 -4.24 -0.02 0.00 0.01 0.00 0.00 42.46 37.90 3a9t s ILE 67 CO 0.36 -0.53 0.07 0.61 0.00 0.00 0.00 174.94 175.45 3a9t n GLY 68 N 4.71 0.82 0.36 6.18 0.00 -1.26 -0.81 105.19 115.19 3a9t n GLY 68 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 1.07 2.97 0.18 -0.02 0.00 -1.26 -4.21 105.19 103.92 3a9t n GLY 69 Ca 0.00 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 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 1.11 1.37 0.27 1.61 3.04 -1.86 -2.57 116.25 119.22 3a9t h VAL 70 Ca -0.03 -2.06 -0.00 0.00 -1.01 0.00 0.00 66.70 63.60 3a9t h VAL 70 Cb 0.13 2.04 -0.02 0.00 -2.01 0.00 0.00 31.29 31.42 3a9t h VAL 70 CO 0.04 0.62 -0.25 0.50 -1.01 0.00 0.00 177.57 177.47 3a9t h LYS 71 N 0.30 -0.52 0.00 4.17 1.63 -1.97 0.14 116.57 120.31 3a9t h LYS 71 Ca -0.02 0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 3a9t h LYS 71 Cb 1.24 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.99 3a9t h LYS 71 CO 0.12 -0.35 -0.23 0.93 -3.45 0.00 0.00 179.45 176.47 3a9t h GLU 72 N -0.54 0.00 -0.30 1.90 5.08 -1.94 -1.79 114.58 116.98 3a9t h GLU 72 Ca -0.01 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 3a9t h GLU 72 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 3a9t h GLU 72 CO -0.04 0.23 -0.51 0.00 -1.00 0.00 0.00 179.01 177.69 3a9t h ALA 73 N 1.77 0.47 -0.16 3.43 0.00 -1.00 -2.28 119.26 121.50 3a9t h ALA 73 Ca -0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 54.91 54.30 3a9t h ALA 73 Cb 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3a9t h ALA 73 CO 0.03 0.66 -0.38 0.00 0.00 0.00 0.00 179.25 179.57 3a9t h ALA 74 N 0.69 1.07 -0.14 0.00 0.00 -0.51 -1.90 119.26 118.47 3a9t h ALA 74 Ca 0.02 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 3a9t h ALA 74 Cb 1.12 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3a9t h ALA 74 CO 0.12 0.59 -0.42 0.93 0.00 0.00 0.00 179.25 180.46 3a9t h GLU 75 N 0.29 0.33 0.03 0.00 5.08 -1.24 -1.75 114.58 117.32 3a9t h GLU 75 Ca 0.03 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3a9t h GLU 75 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3a9t h GLU 75 CO 0.06 0.70 -0.02 0.00 -1.00 0.00 0.00 179.01 178.75 3a9t h ALA 76 N 1.29 -0.05 -0.51 3.43 0.00 -1.01 -1.46 119.26 120.94 3a9t h ALA 76 Ca 0.02 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.86 3a9t h ALA 76 Cb 0.86 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 3a9t h ALA 76 CO 0.07 -0.38 0.16 0.00 0.00 0.00 0.00 179.25 179.10 3a9t h ALA 77 N 0.61 0.62 -0.70 0.00 0.00 -1.21 0.29 119.26 118.86 3a9t h ALA 77 Ca -0.00 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3a9t h ALA 77 Cb 0.32 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3a9t h ALA 77 CO 0.01 -0.24 0.43 1.49 0.00 0.00 0.00 179.25 180.94 3a9t h GLU 78 N 0.32 0.80 -0.28 0.00 4.57 -1.22 0.11 114.58 118.88 3a9t h GLU 78 Ca 0.25 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.31 3a9t h GLU 78 Cb 0.30 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3a9t h GLU 78 CO -0.28 0.53 -0.12 -0.22 -1.18 0.00 0.00 179.01 177.74 3a9t h LYS 79 N 0.82 0.58 -0.40 1.92 3.64 -0.08 -1.21 116.57 121.84 3a9t h LYS 79 Ca 0.29 -0.25 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 3a9t h LYS 79 Cb 0.07 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 3a9t h LYS 79 CO -0.13 0.81 0.04 0.74 -2.27 0.00 0.00 179.45 178.64 3a9t h PHE 80 N 0.33 0.74 -0.53 1.91 0.05 -0.19 -0.95 116.94 118.30 3a9t h PHE 80 Ca 0.07 -0.11 -0.05 0.00 3.82 0.00 0.00 57.97 61.70 3a9t h PHE 80 Cb 0.63 -0.20 -0.02 0.00 2.00 0.00 0.00 35.95 38.36 3a9t h PHE 80 CO 0.06 0.74 0.14 0.00 -0.18 0.00 0.00 178.31 179.07 3a9t h ALA 81 N 0.91 1.26 0.00 2.45 0.00 -0.79 -0.44 119.26 122.64 3a9t h ALA 81 Ca 0.12 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3a9t h ALA 81 Cb 0.42 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3a9t h ALA 81 CO 0.01 0.52 -0.51 -0.09 0.00 0.00 0.00 179.25 179.18 3a9t h ARG 82 N 0.78 0.00 -0.69 0.00 2.43 -0.97 -3.14 114.38 112.79 3a9t h ARG 82 Ca 0.18 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3a9t h ARG 82 Cb 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3a9t h ARG 82 CO -0.00 0.51 0.00 0.39 -1.51 0.00 0.00 179.97 179.36 3a9t n GLU 83 N -3.62 3.29 -3.06 0.20 1.02 -0.38 -4.98 120.64 113.12 3a9t n GLU 83 Ca -0.00 -2.80 -0.13 0.00 -0.02 0.00 0.00 57.16 54.21 3a9t n GLU 83 Cb 0.59 -1.75 0.07 0.00 -0.02 0.00 0.00 31.44 30.32 3a9t n GLU 83 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3a9t n GLY 84 N 1.38 -0.35 3.76 0.62 0.00 -0.70 -4.81 105.19 105.09 3a9t n GLY 84 Ca 0.25 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.29 4.83 0.00 1.61 1.01 -0.26 -2.11 120.40 122.18 3a9t s VAL 85 Ca 0.11 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.44 3a9t s VAL 85 Cb -0.01 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3a9t s VAL 85 CO 0.58 0.42 0.35 0.61 0.00 0.00 0.00 175.10 177.06 3a9t n GLY 86 N 2.33 -0.75 3.08 4.51 0.00 0.86 -4.82 105.19 110.40 3a9t n GLY 86 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.24 -0.01 0.01 1.61 1.01 -1.11 -4.07 120.40 117.60 3a9t s VAL 87 Ca 0.00 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.06 3a9t s VAL 87 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 3a9t s VAL 87 CO 0.00 0.01 -0.18 -0.94 0.00 0.00 0.00 175.10 173.99 3a9t s SER 88 N 0.29 2.16 -0.06 3.32 1.04 -0.45 -0.07 113.70 119.92 3a9t s SER 88 Ca -0.01 -0.41 -0.01 0.00 0.48 0.00 0.00 55.95 56.00 3a9t s SER 88 Cb -0.03 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 65.91 3a9t s SER 88 CO -0.01 0.17 -0.01 -0.63 0.98 0.00 0.00 173.24 173.75 3a9t s ILE 89 N -0.60 0.38 -0.14 -1.02 1.01 -0.24 -1.46 121.20 119.12 3a9t s ILE 89 Ca 0.06 0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.71 3a9t s ILE 89 Cb -0.08 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 3a9t s ILE 89 CO 0.00 0.24 0.15 -0.89 0.00 0.00 0.00 174.94 174.45 3a9t s THR 90 N 1.69 5.45 0.04 2.92 2.01 0.10 -0.07 115.64 127.78 3a9t s THR 90 Ca 0.01 0.24 0.04 0.00 0.31 0.00 0.00 61.69 62.29 3a9t s THR 90 Cb -0.13 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 3a9t s THR 90 CO -0.04 0.55 -0.13 0.68 -0.69 0.00 0.00 174.62 174.99 3a9t s VAL 91 N -0.51 0.99 -0.14 3.82 -7.23 -0.47 0.84 120.40 117.71 3a9t s VAL 91 Ca 0.13 -0.95 -0.30 0.00 -1.81 0.00 0.00 61.98 59.04 3a9t s VAL 91 Cb -0.12 -0.91 0.12 0.00 0.56 0.00 0.00 36.38 36.03 3a9t s VAL 91 CO 0.02 -0.03 0.95 0.28 -0.31 0.00 0.00 175.10 176.01 3a9t s THR 92 N -0.86 0.00 -0.76 5.32 -1.32 -1.02 -1.35 115.64 115.66 3a9t s THR 92 Ca 0.00 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.58 3a9t s THR 92 Cb -0.08 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.88 3a9t s THR 92 CO 0.01 0.00 0.56 -0.81 -2.21 0.00 0.00 174.62 172.17 3a9t n PRO 93 N 0.71 2.62 -2.00 7.08 -0.04 -1.26 -1.61 135.00 140.50 3a9t n PRO 93 Ca -0.11 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 62.92 3a9t n PRO 93 Cb 0.58 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.01 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 -1.37 3.80 0.12 0.00 -0.11 -1.25 -3.73 118.94 116.39 3a9t s TRP 95 Ca 0.00 1.48 0.05 0.00 1.22 0.00 0.00 56.10 58.85 3a9t s TRP 95 Cb 0.00 -2.75 -0.04 0.00 -1.50 0.00 0.00 33.47 29.18 3a9t s TRP 95 CO 0.00 0.40 -0.12 0.00 -4.62 0.00 0.00 176.95 172.61 3a9t n TYR 97 N 0.42 2.59 0.00 0.00 4.01 -1.26 -4.91 117.16 118.01 3a9t n TYR 97 Ca -0.15 -2.54 0.00 0.00 -0.16 0.00 0.00 57.90 55.05 3a9t n TYR 97 Cb 0.58 -2.19 0.00 0.00 -0.31 0.00 0.00 39.34 37.41 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 4.09 0.03 0.48 2.72 0.00 -1.26 -0.26 105.19 110.99 3a9t n GLY 98 Ca 0.55 0.01 0.30 0.00 0.00 0.00 0.00 46.02 46.88 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 0.51 0.00 2.61 1.35 -1.92 0.69 112.91 116.15 3a9t h THR 99 Ca 0.00 -0.01 -0.01 0.00 -0.55 0.00 0.00 66.41 65.84 3a9t h THR 99 Cb 0.00 0.49 -0.00 0.00 -1.73 0.00 0.00 68.15 66.91 3a9t h THR 99 CO 0.00 0.00 -0.04 -0.33 -0.25 0.00 0.00 175.52 174.90 3a9t h GLU 100 N 0.02 0.00 -0.21 4.72 5.08 -1.01 -2.85 114.58 120.32 3a9t h GLU 100 Ca 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 3a9t h GLU 100 Cb 1.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.11 3a9t h GLU 100 CO -0.02 0.04 0.00 0.25 -1.00 0.00 0.00 179.01 178.29 3a9t n THR 101 N -3.97 0.91 -2.18 1.13 -2.24 0.22 -2.40 114.28 105.75 3a9t n THR 101 Ca -0.03 -0.95 -0.35 0.00 -2.27 0.00 0.00 64.05 60.45 3a9t n THR 101 Cb 0.13 0.56 0.01 0.00 -2.10 0.00 0.00 70.33 68.93 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 -0.96 3.28 -0.33 -0.78 -1.94 -1.08 -4.98 119.30 112.50 3a9t s MET 102 Ca 0.15 1.55 -0.22 0.00 -1.71 0.00 0.00 55.69 55.45 3a9t s MET 102 Cb 0.08 -2.00 0.00 0.00 2.01 0.00 0.00 34.83 34.92 3a9t s MET 102 CO 0.10 -0.90 0.74 0.34 -0.01 0.00 0.00 175.02 175.30 3a9t s ASP 103 N -1.96 6.57 0.00 3.03 -1.08 -1.26 -4.91 116.67 117.06 3a9t s ASP 103 Ca 0.71 0.46 0.23 0.00 -0.52 0.00 0.00 52.55 53.43 3a9t s ASP 103 Cb -0.23 -2.38 0.56 0.00 -1.46 0.00 0.00 42.92 39.42 3a9t s ASP 103 CO 0.29 -0.62 1.46 0.23 0.52 0.00 0.00 175.17 177.06 3a9t n MET 104 N 6.19 2.13 -2.13 4.34 2.81 -1.26 -4.88 117.12 124.32 3a9t n MET 104 Ca 0.02 -1.69 -0.43 0.00 -1.81 0.00 0.00 57.70 53.79 3a9t n MET 104 Cb 0.48 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.51 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 -1.61 6.22 0.01 7.83 -1.08 -1.26 -4.85 116.67 121.93 3a9t s ASP 105 Ca 0.35 1.36 0.27 0.00 -0.52 0.00 0.00 52.55 54.01 3a9t s ASP 105 Cb 0.20 -2.53 1.13 0.00 -1.46 0.00 0.00 42.92 40.26 3a9t s ASP 105 CO 0.29 -1.43 1.86 -0.81 0.52 0.00 0.00 175.17 175.60 3a9t n PRO 106 N 7.98 0.01 -0.62 4.34 -0.04 -1.26 -3.85 135.00 141.56 3a9t n PRO 106 Ca 0.20 0.05 0.06 0.00 -0.04 0.00 0.00 63.50 63.77 3a9t n PRO 106 Cb 0.46 -1.51 0.31 0.00 -0.04 0.00 0.00 33.50 32.72 3a9t n PRO 106 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3a9t n HIS 107 N -1.54 1.47 -3.87 0.54 8.25 -1.26 -4.92 115.22 113.89 3a9t n HIS 107 Ca 0.06 -0.53 -0.12 0.00 -0.26 0.00 0.00 57.72 56.87 3a9t n HIS 107 Cb 0.32 -0.34 -0.12 0.00 1.12 0.00 0.00 29.99 30.97 3a9t n HIS 107 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3a9t s ILE 108 N -2.14 0.03 0.28 1.59 -4.36 -1.25 -5.05 121.20 110.29 3a9t s ILE 108 Ca 0.42 -0.23 -0.30 0.00 -0.26 0.00 0.00 60.65 60.28 3a9t s ILE 108 Cb 0.30 -0.18 -0.11 0.00 1.25 0.00 0.00 42.46 43.72 3a9t s ILE 108 CO 0.16 -0.13 1.61 -2.84 0.24 0.00 0.00 174.94 173.98 3a9t s PRO 109 N -0.38 4.13 0.01 0.37 0.02 -1.26 -4.84 135.00 133.05 3a9t s PRO 109 Ca -0.04 2.57 0.02 0.00 0.02 0.00 0.00 61.00 63.57 3a9t s PRO 109 Cb -0.03 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.45 3a9t s PRO 109 CO 0.00 -0.65 -0.07 -1.59 -0.33 0.00 0.00 177.00 174.37 3a9t s LYS 110 N -0.23 0.49 0.05 5.54 -2.85 -1.26 -1.34 119.74 120.15 3a9t s LYS 110 Ca 0.65 -0.37 0.02 0.00 -1.00 0.00 0.00 55.97 55.27 3a9t s LYS 110 Cb -0.48 -0.42 -0.03 0.00 -2.06 0.00 0.00 37.83 34.84 3a9t s LYS 110 CO 0.45 0.11 -0.07 0.00 0.10 0.00 0.00 175.35 175.94 3a9t s ALA 111 N -0.50 0.65 -0.11 0.59 0.00 -0.53 -1.17 121.76 120.69 3a9t s ALA 111 Ca -0.01 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.05 3a9t s ALA 111 Cb -0.05 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.17 3a9t s ALA 111 CO 0.00 -0.09 -0.14 0.08 0.00 0.00 0.00 175.76 175.61 3a9t s VAL 112 N -2.00 1.41 -0.30 0.00 1.01 0.63 0.02 120.40 121.18 3a9t s VAL 112 Ca -0.04 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 3a9t s VAL 112 Cb -0.06 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.05 3a9t s VAL 112 CO -0.01 0.42 0.05 0.86 0.00 0.00 0.00 175.10 176.42 3a9t s TRP 113 N 1.03 3.18 -0.26 5.22 -0.00 0.25 -0.49 118.94 127.87 3a9t s TRP 113 Ca -0.06 -1.35 -0.11 0.00 -0.00 0.00 0.00 56.10 54.57 3a9t s TRP 113 Cb -0.15 -2.20 -0.05 0.00 -0.00 0.00 0.00 33.47 31.07 3a9t s TRP 113 CO -0.02 -0.69 0.19 0.20 -0.00 0.00 0.00 176.95 176.63 3a9t s GLY 114 N 1.40 1.96 0.19 5.86 0.00 -0.69 -2.42 107.32 113.62 3a9t s GLY 114 Ca -0.00 -0.96 -0.31 0.00 0.00 0.00 0.00 44.72 43.44 3a9t s GLY 114 CO 0.01 0.53 1.50 -0.12 0.00 0.00 0.00 173.10 175.02 3a9t s PHE 115 N 1.39 3.06 -1.23 1.90 5.36 -0.63 -4.47 117.98 123.37 3a9t s PHE 115 Ca 0.08 0.81 -0.14 0.00 -0.96 0.00 0.00 56.93 56.73 3a9t s PHE 115 Cb -0.15 -3.86 0.16 0.00 -0.34 0.00 0.00 43.02 38.83 3a9t s PHE 115 CO 0.07 -3.03 1.50 -1.71 -1.46 0.00 0.00 175.22 170.60 3a9t n ASN 116 N 3.34 5.19 -4.50 6.13 2.85 -1.26 -3.87 115.26 123.13 3a9t n ASN 116 Ca 0.11 -2.98 -0.25 0.00 -0.11 0.00 0.00 54.58 51.35 3a9t n ASN 116 Cb 0.40 -1.58 -0.10 0.00 1.24 0.00 0.00 39.78 39.74 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 2.76 2.03 -0.16 8.20 0.00 -1.26 -1.48 107.32 117.41 3a9t s GLY 117 Ca 0.43 -1.97 -0.07 0.00 0.00 0.00 0.00 44.72 43.11 3a9t s GLY 117 CO 0.01 -2.00 0.22 -1.30 0.00 0.00 0.00 173.10 170.03 3a9t n THR 118 N -0.70 1.70 -0.30 0.90 -2.24 -1.26 -4.50 114.28 107.87 3a9t n THR 118 Ca -0.05 -0.58 0.18 0.00 -2.27 0.00 0.00 64.05 61.33 3a9t n THR 118 Cb 0.62 -1.71 0.44 0.00 -2.10 0.00 0.00 70.33 67.58 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 -0.07 0.52 -4.90 -0.78 3.07 -1.95 -3.43 114.58 107.03 3a9t h GLU 119 Ca -0.45 -0.03 -0.31 0.00 -0.50 0.00 0.00 59.36 58.07 3a9t h GLU 119 Cb 1.93 -0.12 -0.18 0.00 -0.84 0.00 0.00 28.75 29.55 3a9t h GLU 119 CO 0.01 0.34 -0.73 1.03 -1.40 0.00 0.00 179.01 178.26 3a9t s ARG 120 N -5.59 0.81 0.00 2.33 1.81 -1.26 -5.06 118.95 111.99 3a9t s ARG 120 Ca -0.09 -1.12 -0.03 0.00 -1.72 0.00 0.00 55.73 52.77 3a9t s ARG 120 Cb 0.24 -0.49 -0.12 0.00 -0.45 0.00 0.00 34.95 34.13 3a9t s ARG 120 CO 0.79 0.07 2.01 -2.30 -0.68 0.00 0.00 175.30 175.19 3a9t n PRO 121 N 0.63 0.99 -0.12 3.54 -0.02 -1.26 -4.60 135.00 134.17 3a9t n PRO 121 Ca -0.17 -0.44 -0.06 0.00 -2.02 0.00 0.00 63.50 60.81 3a9t n PRO 121 Cb 0.57 -1.67 0.02 0.00 -0.02 0.00 0.00 33.50 32.40 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 5.07 0.54 2.00 -1.23 0.00 -1.63 -1.21 103.07 106.60 3a9t h GLY 122 Ca 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 3a9t h GLY 122 CO 0.28 0.09 -0.11 0.00 0.00 0.00 0.00 176.54 176.81 3a9t h ALA 123 N 1.21 1.09 -0.09 3.60 0.00 -1.81 -2.16 119.26 121.10 3a9t h ALA 123 Ca 0.17 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 3a9t h ALA 123 Cb 0.09 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3a9t h ALA 123 CO -0.13 0.14 -0.70 0.28 0.00 0.00 0.00 179.25 178.84 3a9t h VAL 124 N 0.00 1.37 -0.18 0.00 2.07 -1.61 -2.65 116.25 115.25 3a9t h VAL 124 Ca -0.00 -2.08 -0.19 0.00 0.82 0.00 0.00 66.70 65.25 3a9t h VAL 124 Cb 0.48 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 3a9t h VAL 124 CO 0.01 0.63 -0.66 0.22 0.02 0.00 0.00 177.57 177.79 3a9t h TYR 125 N 0.30 0.88 -0.08 1.57 3.20 -0.84 -1.23 116.97 120.78 3a9t h TYR 125 Ca -0.03 -0.35 0.04 0.00 3.14 0.00 0.00 58.73 61.53 3a9t h TYR 125 Cb 1.27 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 39.35 3a9t h TYR 125 CO 0.05 1.15 -0.21 1.25 -1.64 0.00 0.00 178.16 178.76 3a9t h LEU 126 N 0.49 -0.62 -0.88 2.82 5.85 -1.32 0.23 115.31 121.88 3a9t h LEU 126 Ca -0.02 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 3a9t h LEU 126 Cb 1.26 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.55 3a9t h LEU 126 CO 0.13 -0.26 -0.51 0.00 -0.34 0.00 0.00 178.44 177.46 3a9t h ALA 127 N 0.66 1.06 0.05 1.25 0.00 -1.47 -2.21 119.26 118.60 3a9t h ALA 127 Ca 0.08 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3a9t h ALA 127 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3a9t h ALA 127 CO -0.24 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.63 3a9t h ALA 128 N 1.38 -0.07 -0.08 0.00 0.00 -0.59 -1.49 119.26 118.41 3a9t h ALA 128 Ca 0.00 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 3a9t h ALA 128 Cb 0.93 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3a9t h ALA 128 CO 0.07 -0.31 -0.43 -0.24 0.00 0.00 0.00 179.25 178.34 3a9t h VAL 129 N -0.52 1.32 -0.18 0.00 3.04 -0.60 -1.60 116.25 117.71 3a9t h VAL 129 Ca -0.01 -1.55 -0.14 0.00 -1.01 0.00 0.00 66.70 63.99 3a9t h VAL 129 Cb 0.46 1.73 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 3a9t h VAL 129 CO 0.01 0.46 -0.50 -0.07 -1.01 0.00 0.00 177.57 176.46 3a9t h LEU 130 N 0.15 0.53 -1.11 3.16 3.38 -1.42 0.21 115.31 120.21 3a9t h LEU 130 Ca 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 3a9t h LEU 130 Cb 0.82 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3a9t h LEU 130 CO 0.06 0.94 0.33 0.00 0.09 0.00 0.00 178.44 179.86 3a9t h ALA 131 N 1.08 1.31 0.12 1.53 0.00 -0.80 0.17 119.26 122.67 3a9t h ALA 131 Ca 0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3a9t h ALA 131 Cb 1.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3a9t h ALA 131 CO 0.09 0.54 -0.06 0.78 0.00 0.00 0.00 179.25 180.60 3a9t h GLY 132 N 1.02 -0.17 0.45 0.00 0.00 -0.39 -0.99 103.07 102.99 3a9t h GLY 132 Ca 0.23 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.69 3a9t h GLY 132 CO -0.03 -0.06 -0.03 -0.97 0.00 0.00 0.00 176.54 175.45 3a9t h TYR 133 N -0.36 -0.07 -0.84 5.60 -1.99 0.03 0.18 116.97 119.53 3a9t h TYR 133 Ca -0.02 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.74 3a9t h TYR 133 Cb 0.29 0.08 -0.04 0.00 2.00 0.00 0.00 36.73 39.06 3a9t h TYR 133 CO -0.01 -0.08 0.53 -0.91 -0.00 0.00 0.00 178.16 177.69 3a9t h ASN 134 N 0.06 0.99 0.29 3.88 2.35 -0.65 0.37 115.58 122.88 3a9t h ASN 134 Ca 0.16 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 3a9t h ASN 134 Cb 0.22 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3a9t h ASN 134 CO -0.28 0.74 -0.38 -0.61 -1.65 0.00 0.00 177.43 175.25 3a9t h GLN 135 N 1.15 0.12 0.00 0.81 4.15 -0.38 -2.80 115.11 118.16 3a9t h GLN 135 Ca 0.30 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.67 3a9t h GLN 135 Cb -0.09 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.60 3a9t h GLN 135 CO -0.06 0.48 -0.72 1.63 -1.93 0.00 0.00 178.83 178.23 3a9t n LYS 136 N -4.07 0.23 -1.86 1.69 5.02 -0.02 -4.96 118.16 114.19 3a9t n LYS 136 Ca -0.02 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3a9t n LYS 136 Cb 0.43 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 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 1.38 0.65 3.03 0.72 0.00 -0.02 -5.03 105.19 105.91 3a9t n GLY 137 Ca 0.03 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.20 4.79 0.33 0.99 1.43 -0.35 -5.03 118.68 120.64 3a9t s LEU 138 Ca 0.00 -2.46 -0.27 0.00 -1.03 0.00 0.00 54.13 50.36 3a9t s LEU 138 Cb 0.00 -1.70 -0.13 0.00 0.03 0.00 0.00 46.19 44.40 3a9t s LEU 138 CO 0.00 -0.37 1.10 -2.65 0.23 0.00 0.00 176.35 174.66 3a9t n PRO 139 N 3.90 1.60 -3.75 1.29 -0.02 -1.26 -4.42 135.00 132.33 3a9t n PRO 139 Ca 0.04 0.56 -0.13 0.00 -2.02 0.00 0.00 63.50 61.95 3a9t n PRO 139 Cb 0.39 -2.04 -0.09 0.00 -0.02 0.00 0.00 33.50 31.74 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 -1.12 -0.82 0.09 3.55 0.00 -1.26 -4.50 121.76 117.71 3a9t s ALA 140 Ca 0.58 0.47 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 3a9t s ALA 140 Cb -0.63 -0.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.38 3a9t s ALA 140 CO 0.60 -0.24 0.45 -0.06 0.00 0.00 0.00 175.76 176.51 3a9t s PHE 141 N -1.02 3.61 -0.15 0.00 0.40 -0.32 -0.15 117.98 120.34 3a9t s PHE 141 Ca -0.11 0.90 -0.02 0.00 -0.60 0.00 0.00 56.93 57.10 3a9t s PHE 141 Cb -0.05 -2.24 -0.02 0.00 0.51 0.00 0.00 43.02 41.22 3a9t s PHE 141 CO 0.04 0.50 -0.07 0.20 0.70 0.00 0.00 175.22 176.59 3a9t s GLY 142 N -1.67 1.65 -0.20 4.36 0.00 -1.26 -0.27 107.32 109.92 3a9t s GLY 142 Ca 0.33 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 44.20 3a9t s GLY 142 CO 0.18 -0.08 -0.17 -0.42 0.00 0.00 0.00 173.10 172.60 3a9t s ILE 143 N 0.42 2.12 -0.09 0.90 1.01 0.36 -4.95 121.20 120.97 3a9t s ILE 143 Ca -0.06 -1.13 -0.03 0.00 0.00 0.00 0.00 60.65 59.42 3a9t s ILE 143 Cb -0.15 -1.99 0.04 0.00 0.01 0.00 0.00 42.46 40.37 3a9t s ILE 143 CO 0.04 0.37 0.08 -0.47 0.00 0.00 0.00 174.94 174.96 3a9t s TYR 144 N 1.24 0.08 0.46 3.97 5.04 -1.26 -1.71 117.35 125.17 3a9t s TYR 144 Ca 0.01 0.08 -0.23 0.00 -2.44 0.00 0.00 57.07 54.49 3a9t s TYR 144 Cb -0.15 -0.54 -0.07 0.00 0.35 0.00 0.00 41.96 41.55 3a9t s TYR 144 CO -0.11 -0.31 1.17 0.20 -1.34 0.00 0.00 175.55 175.16 3a9t s GLY 145 N 2.17 2.79 0.25 8.97 0.00 -1.26 -4.95 107.32 115.29 3a9t s GLY 145 Ca 0.04 0.95 0.09 0.00 0.00 0.00 0.00 44.72 45.80 3a9t s GLY 145 CO -0.05 1.42 1.57 0.07 0.00 0.00 0.00 173.10 176.10 3a9t h LYS 146 N 2.08 0.06 -5.75 2.90 2.10 -2.00 -3.45 116.57 112.51 3a9t h LYS 146 Ca -0.49 -0.05 -0.66 0.00 -2.00 0.00 0.00 60.65 57.45 3a9t h LYS 146 Cb 1.25 0.01 -0.15 0.00 -0.90 0.00 0.00 32.23 32.44 3a9t h LYS 146 CO 0.60 0.69 -0.60 -0.51 -2.00 0.00 0.00 179.45 177.63 3a9t s ASP 147 N -6.85 5.39 0.20 7.07 1.01 -1.26 -5.09 116.67 117.14 3a9t s ASP 147 Ca -0.02 0.15 -0.30 0.00 0.71 0.00 0.00 52.55 53.09 3a9t s ASP 147 Cb 0.12 -1.66 -0.09 0.00 1.01 0.00 0.00 42.92 42.31 3a9t s ASP 147 CO 0.78 0.33 1.34 -0.69 0.21 0.00 0.00 175.17 177.13 3a9t s VAL 148 N -0.57 3.12 0.18 -1.27 1.01 -1.26 -4.84 120.40 116.77 3a9t s VAL 148 Ca 0.10 0.92 0.09 0.00 0.00 0.00 0.00 61.98 63.09 3a9t s VAL 148 Cb -0.12 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3a9t s VAL 148 CO 0.02 0.13 -0.13 -1.10 0.00 0.00 0.00 175.10 174.03 3a9t s GLN 149 N -0.08 1.94 0.50 2.72 -0.21 -0.55 -5.04 119.66 118.94 3a9t s GLN 149 Ca 0.58 -1.32 -0.19 0.00 0.02 0.00 0.00 55.36 54.45 3a9t s GLN 149 Cb -0.37 -2.09 -0.08 0.00 1.00 0.00 0.00 33.01 31.46 3a9t s GLN 149 CO 0.38 0.43 1.01 -0.51 -2.12 0.00 0.00 175.29 174.48 3a9t s ASP 150 N -2.76 6.43 0.11 5.90 1.01 -1.26 -4.42 116.67 121.68 3a9t s ASP 150 Ca 0.24 1.76 -0.35 0.00 0.71 0.00 0.00 52.55 54.91 3a9t s ASP 150 Cb -0.09 -2.54 -0.18 0.00 1.01 0.00 0.00 42.92 41.13 3a9t s ASP 150 CO 0.14 -0.72 0.96 0.00 0.21 0.00 0.00 175.17 175.76 3a9t n ALA 151 N -1.26 -2.51 -0.71 5.23 0.00 -1.26 -1.72 120.51 118.29 3a9t n ALA 151 Ca 0.08 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.03 3a9t n ALA 151 Cb 0.53 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 1.82 1.31 3.54 0.00 0.00 -1.26 -4.96 105.19 105.65 3a9t n GLY 152 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 2.16 0.00 1.61 -0.08 -0.70 -4.77 116.55 114.77 3a9t n ASP 153 Ca 0.00 -0.31 0.14 0.00 -1.51 0.00 0.00 54.79 53.10 3a9t n ASP 153 Cb 0.00 -1.49 0.82 0.00 2.34 0.00 0.00 41.12 42.79 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 7.88 0.00 -3.04 5.18 -2.24 -1.26 -4.66 114.28 116.15 3a9t n THR 154 Ca 0.40 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.75 3a9t n THR 154 Cb 0.46 -0.57 -0.06 0.00 -2.10 0.00 0.00 70.33 68.06 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 -2.01 6.39 -0.11 3.42 0.01 -1.26 -4.90 114.94 116.48 3a9t s ASN 155 Ca 0.41 -0.14 -0.30 0.00 -0.71 0.00 0.00 52.86 52.13 3a9t s ASN 155 Cb 0.19 -2.35 -0.02 0.00 0.41 0.00 0.00 41.25 39.48 3a9t s ASN 155 CO 0.32 -0.81 1.18 -0.63 -1.51 0.00 0.00 177.10 175.66 3a9t s ILE 156 N 3.01 4.35 0.72 0.60 1.01 -1.26 -5.02 121.20 124.62 3a9t s ILE 156 Ca 0.26 1.66 -0.15 0.00 0.00 0.00 0.00 60.65 62.43 3a9t s ILE 156 Cb -0.13 -4.07 0.03 0.00 0.01 0.00 0.00 42.46 38.30 3a9t s ILE 156 CO 0.20 -0.05 1.17 -2.16 0.00 0.00 0.00 174.94 174.09 3a9t s PRO 157 N 2.64 2.28 0.28 2.79 0.04 -1.26 -4.77 135.00 137.00 3a9t s PRO 157 Ca 0.54 1.61 0.01 0.00 0.04 0.00 0.00 61.00 63.19 3a9t s PRO 157 Cb -0.22 -1.87 0.53 0.00 0.04 0.00 0.00 34.50 32.98 3a9t s PRO 157 CO 0.18 -1.70 1.84 1.49 0.04 0.00 0.00 177.00 178.85 3a9t h GLU 158 N -0.32 0.99 -0.26 4.56 4.57 -1.99 -0.93 114.58 121.19 3a9t h GLU 158 Ca -0.47 -0.06 -0.11 0.00 -1.18 0.00 0.00 59.36 57.54 3a9t h GLU 158 Cb 1.28 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.63 3a9t h GLU 158 CO 0.51 0.65 -0.32 0.38 -1.18 0.00 0.00 179.01 179.05 3a9t h ASP 159 N 1.02 0.56 -0.24 1.04 -0.00 -2.00 -2.51 116.42 114.29 3a9t h ASP 159 Ca 0.49 -0.22 -0.08 0.00 -0.00 0.00 0.00 57.03 57.22 3a9t h ASP 159 Cb 0.44 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 39.61 3a9t h ASP 159 CO -0.25 0.85 -0.17 0.58 -0.00 0.00 0.00 179.24 180.24 3a9t h VAL 160 N 0.47 1.31 -0.14 4.15 2.07 -1.79 -3.13 116.25 119.19 3a9t h VAL 160 Ca 0.06 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.33 3a9t h VAL 160 Cb 0.78 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 3a9t h VAL 160 CO 0.06 0.40 -0.18 0.11 0.02 0.00 0.00 177.57 177.98 3a9t h LYS 161 N 0.25 -0.22 -0.89 1.57 1.57 -1.04 -1.50 116.57 116.31 3a9t h LYS 161 Ca 0.05 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 58.96 3a9t h LYS 161 Cb 0.70 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.99 3a9t h LYS 161 CO 0.05 -0.14 0.58 1.49 -0.57 0.00 0.00 179.45 180.85 3a9t h GLU 162 N -0.23 0.77 -0.06 3.15 4.81 -1.49 -0.97 114.58 120.55 3a9t h GLU 162 Ca 0.10 -0.05 -0.21 0.00 -0.13 0.00 0.00 59.36 59.07 3a9t h GLU 162 Cb 0.37 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 29.59 3a9t h GLU 162 CO -0.27 0.51 -0.79 0.87 -0.73 0.00 0.00 179.01 178.60 3a9t h LYS 163 N 0.79 0.64 -0.66 1.92 1.57 -1.37 -1.48 116.57 117.97 3a9t h LYS 163 Ca 0.44 -0.61 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 3a9t h LYS 163 Cb 0.57 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 3a9t h LYS 163 CO -0.20 1.22 0.32 -0.07 -0.57 0.00 0.00 179.45 180.15 3a9t h LEU 164 N 0.29 0.85 -0.16 2.94 3.38 -0.84 0.16 115.31 121.92 3a9t h LEU 164 Ca -0.08 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.64 3a9t h LEU 164 Cb 1.44 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3a9t h LEU 164 CO 0.16 0.74 -0.39 0.40 0.09 0.00 0.00 178.44 179.44 3a9t h ILE 165 N 0.91 1.35 -0.54 1.22 2.04 -1.24 -0.03 117.51 121.22 3a9t h ILE 165 Ca 0.23 -1.65 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 3a9t h ILE 165 Cb 0.10 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3a9t h ILE 165 CO -0.03 0.50 0.28 -0.09 0.00 0.00 0.00 178.15 178.81 3a9t h ARG 166 N 0.19 0.75 0.00 2.37 2.43 -1.16 0.15 114.38 119.13 3a9t h ARG 166 Ca -0.00 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3a9t h ARG 166 Cb 0.99 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 3a9t h ARG 166 CO 0.08 0.60 -0.00 0.35 -1.51 0.00 0.00 179.97 179.49 3a9t h PHE 167 N 0.72 -0.00 -0.19 2.20 3.57 -0.94 -1.72 116.94 120.58 3a9t h PHE 167 Ca 0.19 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.72 3a9t h PHE 167 Cb 0.07 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 3a9t h PHE 167 CO -0.01 0.07 -0.04 0.00 -2.23 0.00 0.00 178.31 176.11 3a9t h ALA 168 N 0.91 0.13 -0.40 2.41 0.00 -0.68 0.21 119.26 121.84 3a9t h ALA 168 Ca -0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3a9t h ALA 168 Cb 0.08 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3a9t h ALA 168 CO 0.00 -0.47 0.16 0.87 0.00 0.00 0.00 179.25 179.81 3a9t h LYS 169 N 0.01 0.60 -0.12 0.00 1.57 -0.93 0.26 116.57 117.95 3a9t h LYS 169 Ca 0.09 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3a9t h LYS 169 Cb 0.13 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3a9t h LYS 169 CO -0.18 0.57 0.06 0.00 -0.57 0.00 0.00 179.45 179.33 3a9t h ALA 170 N 1.00 0.15 -0.41 3.86 0.00 -1.12 -0.64 119.26 122.11 3a9t h ALA 170 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3a9t h ALA 170 Cb 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3a9t h ALA 170 CO -0.01 -0.30 0.23 0.78 0.00 0.00 0.00 179.25 179.95 3a9t h GLY 171 N 0.09 0.60 0.90 0.00 0.00 -0.44 -1.63 103.07 102.58 3a9t h GLY 171 Ca 0.04 -0.26 0.02 0.00 0.00 0.00 0.00 47.33 47.14 3a9t h GLY 171 CO -0.01 0.25 0.44 -2.00 0.00 0.00 0.00 176.54 175.22 3a9t h LEU 172 N 0.53 0.72 -0.60 3.11 5.85 -0.33 0.50 115.31 125.10 3a9t h LEU 172 Ca 0.14 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.87 3a9t h LEU 172 Cb 0.03 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3a9t h LEU 172 CO -0.03 0.51 0.39 0.00 -0.34 0.00 0.00 178.44 178.97 3a9t h ALA 173 N 1.28 0.76 -0.52 1.25 0.00 -0.76 0.43 119.26 121.70 3a9t h ALA 173 Ca 0.27 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3a9t h ALA 173 Cb -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3a9t h ALA 173 CO -0.09 0.17 0.14 0.28 0.00 0.00 0.00 179.25 179.74 3a9t h VAL 174 N 0.78 1.24 -0.03 0.00 2.07 -0.71 -2.64 116.25 116.97 3a9t h VAL 174 Ca 0.22 -0.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 3a9t h VAL 174 Cb -0.06 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3a9t h VAL 174 CO -0.06 0.31 -0.28 0.00 0.02 0.00 0.00 177.57 177.55 3a9t h ALA 175 N 1.01 1.48 -0.14 1.67 0.00 -0.45 -2.98 119.26 119.84 3a9t h ALA 175 Ca 0.17 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3a9t h ALA 175 Cb 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3a9t h ALA 175 CO -0.00 0.38 -0.25 0.52 0.00 0.00 0.00 179.25 179.90 3a9t h MET 176 N 0.04 0.26 0.02 0.00 2.86 -0.56 -3.17 114.93 114.39 3a9t h MET 176 Ca 0.01 -0.09 -0.21 0.00 -2.06 0.00 0.00 59.70 57.35 3a9t h MET 176 Cb 0.53 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 3a9t h MET 176 CO 0.04 0.50 -0.93 0.52 1.06 0.00 0.00 176.91 178.10 3a9t h MET 177 N 0.23 0.17 -6.48 1.72 2.86 -1.39 -3.44 114.93 108.60 3a9t h MET 177 Ca 0.04 -0.21 -0.59 0.00 -2.06 0.00 0.00 59.70 56.88 3a9t h MET 177 Cb 0.58 0.06 0.06 0.00 0.06 0.00 0.00 31.60 32.36 3a9t h MET 177 CO 0.04 0.98 0.78 1.63 1.06 0.00 0.00 176.91 181.40 3a9t n LYS 178 N -3.60 2.07 0.00 1.72 5.02 -1.20 -1.80 118.16 120.37 3a9t n LYS 178 Ca -0.04 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 57.00 3a9t n LYS 178 Cb 0.85 -2.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 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 3.37 2.77 3.90 0.72 0.00 -0.05 -5.00 105.19 110.91 3a9t n GLY 179 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.37 2.39 0.26 1.61 -0.14 -0.75 -4.73 119.74 118.02 3a9t s LYS 180 Ca 0.00 0.14 0.09 0.00 -1.36 0.00 0.00 55.97 54.84 3a9t s LYS 180 Cb 0.00 -2.05 -0.04 0.00 -1.68 0.00 0.00 37.83 34.06 3a9t s LYS 180 CO 0.00 -1.26 0.06 -1.12 -0.76 0.00 0.00 175.35 172.27 3a9t s SER 181 N -4.47 4.84 -0.22 2.83 0.01 -0.43 -0.31 113.70 115.95 3a9t s SER 181 Ca 0.60 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 57.34 3a9t s SER 181 Cb -0.11 -1.02 0.03 0.00 0.21 0.00 0.00 66.02 65.14 3a9t s SER 181 CO 0.49 -0.01 -0.15 -0.47 0.41 0.00 0.00 173.24 173.51 3a9t s TYR 182 N -2.26 2.99 -0.20 2.43 5.04 -0.36 -2.00 117.35 122.99 3a9t s TYR 182 Ca 0.32 -1.84 -0.19 0.00 -2.44 0.00 0.00 57.07 52.92 3a9t s TYR 182 Cb -0.07 -1.95 -0.03 0.00 0.35 0.00 0.00 41.96 40.26 3a9t s TYR 182 CO 0.21 -0.82 0.52 -1.17 -1.34 0.00 0.00 175.55 172.96 3a9t s LEU 183 N 1.24 4.15 -0.42 6.97 2.96 -0.47 -1.79 118.68 131.30 3a9t s LEU 183 Ca -0.00 0.68 -0.15 0.00 -0.22 0.00 0.00 54.13 54.44 3a9t s LEU 183 Cb -0.16 -2.72 0.03 0.00 0.50 0.00 0.00 46.19 43.85 3a9t s LEU 183 CO -0.09 -0.18 0.32 -0.55 -1.32 0.00 0.00 176.35 174.53 3a9t s SER 184 N 1.15 6.09 -0.46 3.68 0.15 0.13 -1.19 113.70 123.25 3a9t s SER 184 Ca 0.24 -1.02 -0.15 0.00 0.70 0.00 0.00 55.95 55.72 3a9t s SER 184 Cb -0.15 -2.16 0.06 0.00 -1.71 0.00 0.00 66.02 62.06 3a9t s SER 184 CO 0.10 -0.50 0.37 -0.63 1.20 0.00 0.00 173.24 173.78 3a9t s ILE 185 N 1.66 5.22 0.00 6.45 1.01 -0.26 -1.53 121.20 133.75 3a9t s ILE 185 Ca 0.05 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.71 3a9t s ILE 185 Cb -0.20 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.19 3a9t s ILE 185 CO 0.09 -0.52 0.00 0.61 0.00 0.00 0.00 174.94 175.12 3a9t n GLY 186 N 5.19 -1.64 0.00 6.18 0.00 -0.25 -0.91 105.19 113.76 3a9t n GLY 186 Ca -0.12 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.84 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 0.00 0.00 -4.77 1.61 2.88 -1.26 -4.79 113.62 107.29 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 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 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 2.13 2.52 -0.24 2.46 1.01 -1.26 -4.66 120.40 122.35 3a9t s VAL 188 Ca 0.00 0.50 -0.06 0.00 0.00 0.00 0.00 61.98 62.43 3a9t s VAL 188 Cb 0.00 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 3a9t s VAL 188 CO 0.00 0.11 0.02 -0.55 0.00 0.00 0.00 175.10 174.69 3a9t s SER 189 N -0.24 4.78 -1.78 3.32 0.15 -1.26 -4.70 113.70 113.97 3a9t s SER 189 Ca 0.52 -0.33 -0.17 0.00 0.70 0.00 0.00 55.95 56.67 3a9t s SER 189 Cb -0.42 -1.84 0.17 0.00 -1.71 0.00 0.00 66.02 62.22 3a9t s SER 189 CO 0.54 -0.04 0.46 0.23 1.20 0.00 0.00 173.24 175.62 3a9t n MET 190 N 4.87 -1.02 -0.96 5.44 2.81 -1.26 -0.22 117.12 126.78 3a9t n MET 190 Ca -0.17 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 3a9t n MET 190 Cb 0.51 -4.45 0.00 0.00 -0.71 0.00 0.00 33.22 28.56 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 -1.50 0.21 3.64 3.03 0.00 -1.26 -4.95 105.19 104.36 3a9t n GLY 191 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.46 3.38 0.22 -0.61 1.01 0.70 -4.90 121.20 119.54 3a9t s ILE 192 Ca 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.98 3a9t s ILE 192 Cb 0.00 -3.35 0.22 0.00 0.01 0.00 0.00 42.46 39.35 3a9t s ILE 192 CO 0.00 -0.10 1.64 0.00 0.00 0.00 0.00 174.94 176.48 3a9t h ALA 193 N 10.95 0.55 0.00 9.38 0.00 -1.92 -0.55 119.26 137.66 3a9t h ALA 193 Ca -0.41 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3a9t h ALA 193 Cb 1.20 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3a9t h ALA 193 CO 0.96 -0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.21 3a9t n GLY 194 N -1.40 -0.59 0.17 0.00 0.00 -1.26 -1.62 105.19 100.48 3a9t n GLY 194 Ca 0.09 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.30 0.92 -4.75 1.61 3.41 -0.21 -1.79 113.62 111.50 3a9t n SER 195 Ca 0.04 -0.73 -0.40 0.00 -0.26 0.00 0.00 58.87 57.52 3a9t n SER 195 Cb 0.07 0.26 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 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 -2.70 4.45 -0.29 -3.33 1.01 -0.64 -4.36 120.40 114.53 3a9t s VAL 196 Ca 0.18 1.89 -0.14 0.00 0.00 0.00 0.00 61.98 63.91 3a9t s VAL 196 Cb 0.18 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 3a9t s VAL 196 CO 0.61 0.41 0.31 -0.69 0.00 0.00 0.00 175.10 175.74 3a9t s VAL 197 N -0.48 5.22 -0.63 2.92 1.01 -1.26 -4.89 120.40 122.29 3a9t s VAL 197 Ca 0.41 0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.63 3a9t s VAL 197 Cb -0.23 -3.67 0.16 0.00 0.00 0.00 0.00 36.38 32.64 3a9t s VAL 197 CO 0.28 0.14 0.52 -1.10 0.00 0.00 0.00 175.10 174.93 3a9t s GLN 198 N 1.96 2.90 0.44 2.72 -0.21 -1.26 -4.94 119.66 121.27 3a9t s GLN 198 Ca 0.12 -2.19 0.19 0.00 0.02 0.00 0.00 55.36 53.50 3a9t s GLN 198 Cb -0.16 -4.07 1.13 0.00 1.00 0.00 0.00 33.01 30.91 3a9t s GLN 198 CO 0.11 -1.23 1.90 0.93 -2.12 0.00 0.00 175.29 174.88 3a9t h GLU 199 N 7.90 0.33 -1.00 2.91 5.08 -2.01 -1.30 114.58 126.50 3a9t h GLU 199 Ca -0.07 -0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.44 3a9t h GLU 199 Cb 1.03 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 30.11 3a9t h GLU 199 CO 0.80 0.22 0.61 -0.44 -1.00 0.00 0.00 179.01 179.20 3a9t h ASP 200 N 0.34 0.82 0.16 1.42 3.45 -1.99 -0.54 116.42 120.07 3a9t h ASP 200 Ca 0.40 0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.93 3a9t h ASP 200 Cb 1.05 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.75 3a9t h ASP 200 CO -0.12 0.34 -0.08 0.15 -1.57 0.00 0.00 179.24 177.97 3a9t h PHE 201 N 0.83 -0.20 -0.40 4.55 3.57 -1.65 -0.94 116.94 122.71 3a9t h PHE 201 Ca 0.55 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 62.04 3a9t h PHE 201 Cb 0.75 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 3a9t h PHE 201 CO -0.01 0.06 0.23 0.74 -2.23 0.00 0.00 178.31 177.10 3a9t h PHE 202 N -0.44 0.54 0.27 0.41 0.04 -1.47 0.55 116.94 116.83 3a9t h PHE 202 Ca -0.02 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 3a9t h PHE 202 Cb 0.35 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.32 3a9t h PHE 202 CO 0.00 0.40 -0.13 0.37 -0.60 0.00 0.00 178.31 178.36 3a9t h GLN 203 N 0.52 -0.35 0.21 1.51 4.15 -1.15 0.38 115.11 120.37 3a9t h GLN 203 Ca 0.14 0.02 -0.32 0.00 0.77 0.00 0.00 58.65 59.27 3a9t h GLN 203 Cb 0.03 0.08 0.04 0.00 0.21 0.00 0.00 27.48 27.84 3a9t h GLN 203 CO -0.02 0.00 -1.36 -0.91 -1.93 0.00 0.00 178.83 174.61 3a9t h ASN 204 N -0.81 0.84 0.59 -0.69 2.35 -1.23 -2.54 115.58 114.08 3a9t h ASN 204 Ca -0.04 -0.89 -0.28 0.00 -0.55 0.00 0.00 56.30 54.54 3a9t h ASN 204 Cb 0.51 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 3a9t h ASN 204 CO 0.06 1.66 -1.40 1.88 -1.65 0.00 0.00 177.43 177.98 3a9t h TYR 205 N 0.15 0.33 -0.00 1.19 -1.99 -1.00 -3.40 116.97 112.25 3a9t h TYR 205 Ca -0.23 -0.24 0.00 0.00 2.00 0.00 0.00 58.73 60.26 3a9t h TYR 205 Cb 2.05 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 40.77 3a9t h TYR 205 CO 0.13 1.26 -0.06 1.28 -0.00 0.00 0.00 178.16 180.76 3a9t n LEU 206 N -3.41 0.22 -2.01 3.88 4.77 -1.01 -4.90 117.00 114.55 3a9t n LEU 206 Ca -0.12 -0.57 -0.16 0.00 -0.03 0.00 0.00 56.01 55.13 3a9t n LEU 206 Cb 1.02 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.12 3a9t n LEU 206 CO 0.50 0.05 -0.09 0.61 -1.33 0.00 0.00 177.39 177.13 3a9t n GLY 207 N 0.91 -0.22 3.90 -0.72 0.00 0.56 -3.63 105.19 105.98 3a9t n GLY 207 Ca 0.00 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 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 -5.09 2.87 0.30 1.61 1.00 0.10 -0.87 119.30 119.22 3a9t s MET 208 Ca 0.12 -1.19 0.07 0.00 0.00 0.00 0.00 55.69 54.69 3a9t s MET 208 Cb -0.05 -2.60 -0.03 0.00 0.00 0.00 0.00 34.83 32.15 3a9t s MET 208 CO 0.15 0.09 0.30 1.03 0.00 0.00 0.00 175.02 176.59 3a9t s ARG 209 N -4.05 2.94 -0.19 2.03 0.52 0.58 -3.59 118.95 117.19 3a9t s ARG 209 Ca 0.42 -1.11 0.01 0.00 -0.52 0.00 0.00 55.73 54.53 3a9t s ARG 209 Cb -0.07 -2.61 0.04 0.00 0.52 0.00 0.00 34.95 32.82 3a9t s ARG 209 CO 0.28 0.22 -0.12 -0.80 0.02 0.00 0.00 175.30 174.90 3a9t s ASN 210 N -3.98 3.21 0.01 0.23 0.01 -1.26 -1.22 114.94 111.94 3a9t s ASN 210 Ca 0.38 -0.78 0.02 0.00 -0.71 0.00 0.00 52.86 51.78 3a9t s ASN 210 Cb -0.07 -1.25 -0.04 0.00 0.41 0.00 0.00 41.25 40.30 3a9t s ASN 210 CO 0.27 -0.11 -0.01 -1.61 -1.51 0.00 0.00 177.10 174.13 3a9t s GLU 211 N 1.40 2.71 -0.02 -0.60 0.41 -0.74 -4.96 118.70 116.91 3a9t s GLU 211 Ca 0.01 -0.66 0.04 0.00 -0.41 0.00 0.00 54.97 53.94 3a9t s GLU 211 Cb -0.15 -2.62 -0.01 0.00 -1.78 0.00 0.00 34.13 29.57 3a9t s GLU 211 CO -0.09 0.61 -0.12 0.71 -0.49 0.00 0.00 175.26 175.87 3a9t s TYR 212 N -1.10 1.16 -0.16 1.61 1.51 -1.26 -0.70 117.35 118.41 3a9t s TYR 212 Ca 0.20 -0.25 -0.07 0.00 -1.01 0.00 0.00 57.07 55.94 3a9t s TYR 212 Cb -0.11 -0.77 0.07 0.00 -0.11 0.00 0.00 41.96 41.04 3a9t s TYR 212 CO 0.11 -0.05 0.35 0.54 -1.11 0.00 0.00 175.55 175.38 3a9t s VAL 213 N -0.15 -0.35 0.52 0.71 0.11 -0.58 -4.97 120.40 115.69 3a9t s VAL 213 Ca 0.02 0.18 -0.21 0.00 -2.93 0.00 0.00 61.98 59.04 3a9t s VAL 213 Cb -0.06 -0.55 -0.06 0.00 -1.53 0.00 0.00 36.38 34.17 3a9t s VAL 213 CO 0.00 0.08 1.18 -0.62 -3.33 0.00 0.00 175.10 172.41 3a9t s ASP 214 N 2.09 5.76 0.50 3.54 -1.08 -1.26 -1.09 116.67 125.13 3a9t s ASP 214 Ca -0.04 2.33 0.34 0.00 -0.52 0.00 0.00 52.55 54.66 3a9t s ASP 214 Cb -0.11 -2.60 1.71 0.00 -1.46 0.00 0.00 42.92 40.46 3a9t s ASP 214 CO -0.11 -1.20 2.02 0.24 0.52 0.00 0.00 175.17 176.64 3a9t h MET 215 N 1.52 0.00 0.00 4.34 2.86 -1.90 -1.79 114.93 119.96 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 1.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 3a9t h MET 215 CO 0.58 0.00 0.02 0.66 1.06 0.00 0.00 176.91 179.23 3a9t h SER 216 N 0.00 0.00 -0.31 1.22 4.64 -2.01 0.95 113.55 118.04 3a9t h SER 216 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3a9t h SER 216 Cb 0.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 3a9t h SER 216 CO 0.00 0.00 0.10 -0.08 -0.87 0.00 0.00 176.83 175.98 3a9t h GLU 217 N 0.00 0.55 0.00 4.77 4.57 -1.70 -0.39 114.58 122.39 3a9t h GLU 217 Ca 0.00 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 58.03 3a9t h GLU 217 Cb 0.04 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 3a9t h GLU 217 CO 0.00 0.50 -0.29 0.74 -1.18 0.00 0.00 179.01 178.78 3a9t h PHE 218 N 0.55 0.00 -0.04 0.92 -1.00 -1.02 -0.88 116.94 115.47 3a9t h PHE 218 Ca 0.13 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 3a9t h PHE 218 Cb 0.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.76 3a9t h PHE 218 CO 0.01 0.29 -0.08 0.28 -1.61 0.00 0.00 178.31 177.20 3a9t h VAL 219 N 0.00 1.44 -0.15 -0.55 2.07 -1.15 -2.34 116.25 115.57 3a9t h VAL 219 Ca -0.00 -1.43 0.01 0.00 0.82 0.00 0.00 66.70 66.10 3a9t h VAL 219 Cb 0.62 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 3a9t h VAL 219 CO 0.04 0.39 0.06 -0.09 0.02 0.00 0.00 177.57 177.98 3a9t h ARG 220 N -0.42 0.13 0.00 1.57 2.43 -1.11 -0.20 114.38 116.78 3a9t h ARG 220 Ca 0.00 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3a9t h ARG 220 Cb 0.67 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 3a9t h ARG 220 CO 0.02 0.08 -0.22 0.00 -1.51 0.00 0.00 179.97 178.34 3a9t h ARG 221 N 0.13 0.00 0.22 0.20 3.08 -1.22 0.38 114.38 117.17 3a9t h ARG 221 Ca 0.06 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.82 3a9t h ARG 221 Cb 0.03 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.12 3a9t h ARG 221 CO -0.06 0.22 -1.30 0.82 -1.07 0.00 0.00 179.97 178.58 3a9t h ILE 222 N 0.00 1.34 -0.12 2.04 2.04 -1.09 0.34 117.51 122.07 3a9t h ILE 222 Ca -0.00 -2.64 -0.02 0.00 1.00 0.00 0.00 64.86 63.19 3a9t h ILE 222 Cb 0.47 3.07 -0.00 0.00 -0.74 0.00 0.00 36.82 39.61 3a9t h ILE 222 CO 0.03 0.78 -0.02 -0.33 0.00 0.00 0.00 178.15 178.61 3a9t h GLU 223 N 0.02 0.23 -0.00 2.37 4.39 -0.80 -3.13 114.58 117.66 3a9t h GLU 223 Ca -0.23 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.39 3a9t h GLU 223 Cb 2.02 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.66 3a9t h GLU 223 CO 0.24 0.51 -0.09 1.28 -1.16 0.00 0.00 179.01 179.79 3a9t n LEU 224 N -4.75 0.33 -2.28 1.33 4.77 0.10 -4.94 117.00 111.56 3a9t n LEU 224 Ca -0.06 0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 3a9t n LEU 224 Cb 0.23 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 3a9t n LEU 224 CO 0.36 0.06 0.12 0.61 -1.33 0.00 0.00 177.39 177.21 3a9t n GLY 225 N 1.30 0.08 3.44 -0.72 0.00 -0.80 -4.93 105.19 103.55 3a9t n GLY 225 Ca 0.14 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 3a9t n GLY 225 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3a9t n ILE 226 N -3.62 4.13 -3.60 -0.61 5.41 0.11 -4.85 119.36 116.34 3a9t n ILE 226 Ca -0.04 -4.44 0.01 0.00 1.00 0.00 0.00 62.75 59.28 3a9t n ILE 226 Cb 0.55 -2.42 -0.01 0.00 -0.71 0.00 0.00 39.64 37.05 3a9t n ILE 226 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3a9t s TYR 227 N 2.46 -0.01 -0.58 1.39 -0.85 -1.26 -4.86 117.35 113.64 3a9t s TYR 227 Ca 0.47 0.00 -0.27 0.00 -0.52 0.00 0.00 57.07 56.75 3a9t s TYR 227 Cb 0.01 0.50 -0.02 0.00 0.38 0.00 0.00 41.96 42.83 3a9t s TYR 227 CO 0.03 -0.03 1.84 0.34 -1.52 0.00 0.00 175.55 176.20 3a9t s ASP 228 N -2.54 5.36 0.40 -0.18 -1.08 -1.26 -4.83 116.67 112.54 3a9t s ASP 228 Ca 0.13 0.44 0.14 0.00 -0.52 0.00 0.00 52.55 52.74 3a9t s ASP 228 Cb 0.04 -2.53 0.82 0.00 -1.46 0.00 0.00 42.92 39.79 3a9t s ASP 228 CO -0.05 -2.28 1.87 0.11 0.52 0.00 0.00 175.17 175.34 3a9t h LYS 229 N 14.61 0.00 0.01 4.34 1.57 -1.99 0.11 116.57 135.22 3a9t h LYS 229 Ca -0.27 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3a9t h LYS 229 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3a9t h LYS 229 CO 1.20 0.32 -0.01 1.49 -0.57 0.00 0.00 179.45 181.88 3a9t h GLU 230 N 0.00 -0.02 -0.70 3.15 4.22 -2.01 -2.34 114.58 116.88 3a9t h GLU 230 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 3a9t h GLU 230 Cb 0.58 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3a9t h GLU 230 CO 0.04 0.25 0.37 1.49 -2.18 0.00 0.00 179.01 178.98 3a9t h GLU 231 N -0.29 0.99 -0.01 1.92 4.81 -1.89 -2.78 114.58 117.33 3a9t h GLU 231 Ca -0.00 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3a9t h GLU 231 Cb 0.28 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 3a9t h GLU 231 CO 0.00 0.75 -0.36 -0.92 -0.73 0.00 0.00 179.01 177.75 3a9t h TYR 232 N 0.97 -1.01 -0.93 0.92 5.03 -0.82 0.71 116.97 121.83 3a9t h TYR 232 Ca 0.24 0.03 0.13 0.00 2.58 0.00 0.00 58.73 61.71 3a9t h TYR 232 Cb 0.06 0.44 -0.08 0.00 1.55 0.00 0.00 36.73 38.71 3a9t h TYR 232 CO -0.00 -0.45 0.60 0.93 -1.32 0.00 0.00 178.16 177.92 3a9t h GLU 233 N -0.51 0.82 -0.48 1.82 4.39 -1.32 0.26 114.58 119.56 3a9t h GLU 233 Ca 0.06 -0.05 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 3a9t h GLU 233 Cb 0.60 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 3a9t h GLU 233 CO -0.29 0.54 -0.12 0.00 -1.16 0.00 0.00 179.01 177.98 3a9t h ARG 234 N 0.85 0.89 -0.05 2.33 3.08 -1.02 -1.87 114.38 118.59 3a9t h ARG 234 Ca 0.46 -0.32 -0.20 0.00 0.07 0.00 0.00 59.98 59.99 3a9t h ARG 234 Cb 0.57 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 3a9t h ARG 234 CO -0.23 0.96 -0.81 0.00 -1.07 0.00 0.00 179.97 178.82 3a9t h ALA 235 N 1.06 0.49 -0.46 0.04 0.00 0.57 -1.69 119.26 119.29 3a9t h ALA 235 Ca 0.13 -0.65 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3a9t h ALA 235 Cb 0.64 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3a9t h ALA 235 CO 0.04 0.78 -0.07 1.25 0.00 0.00 0.00 179.25 181.26 3a9t h LEU 236 N 0.27 0.78 -0.53 0.00 6.46 -0.43 -0.99 115.31 120.87 3a9t h LEU 236 Ca -0.05 -0.22 -0.16 0.00 -0.12 0.00 0.00 57.88 57.33 3a9t h LEU 236 Cb 1.42 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 3a9t h LEU 236 CO 0.14 0.89 -0.62 0.50 -0.62 0.00 0.00 178.44 178.73 3a9t h LYS 237 N 0.73 0.39 -0.26 1.25 3.64 -1.24 -2.68 116.57 118.39 3a9t h LYS 237 Ca 0.13 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 3a9t h LYS 237 Cb 0.55 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3a9t h LYS 237 CO 0.03 0.89 -0.03 2.35 -2.27 0.00 0.00 179.45 180.43 3a9t h TRP 238 N 0.29 0.54 -0.78 1.91 7.01 -0.99 -2.21 115.95 121.72 3a9t h TRP 238 Ca -0.01 -0.10 0.04 0.00 2.11 0.00 0.00 58.89 60.93 3a9t h TRP 238 Cb 1.16 -0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 28.04 3a9t h TRP 238 CO 0.04 0.67 0.49 0.28 -2.79 0.00 0.00 178.44 177.12 3a9t h VAL 239 N 0.25 1.09 0.00 2.65 2.07 -1.15 0.16 116.25 121.32 3a9t h VAL 239 Ca 0.07 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 3a9t h VAL 239 Cb 0.47 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3a9t h VAL 239 CO 0.02 0.17 -0.27 0.11 0.02 0.00 0.00 177.57 177.62 3a9t h LYS 240 N 0.94 0.00 0.00 1.57 1.79 -1.37 -0.51 116.57 119.00 3a9t h LYS 240 Ca 0.32 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.69 3a9t h LYS 240 Cb 0.06 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.69 3a9t h LYS 240 CO -0.13 0.27 -1.28 0.39 -1.08 0.00 0.00 179.45 177.62 3a9t n GLU 241 N -3.69 0.62 0.00 3.15 1.02 -0.30 -4.62 120.64 116.81 3a9t n GLU 241 Ca -0.01 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 3a9t n GLU 241 Cb 0.38 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 3a9t n GLU 241 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3a9t n ASN 242 N -2.80 4.15 -4.45 1.62 3.02 0.41 -4.98 115.26 112.23 3a9t n ASN 242 Ca -0.06 -0.05 -0.44 0.00 -0.03 0.00 0.00 54.58 54.00 3a9t n ASN 242 Cb 0.73 0.93 -0.07 0.00 -0.61 0.00 0.00 39.78 40.77 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 2.34 4.31 -0.12 0.00 3.01 -1.26 -4.81 119.74 123.21 3a9t s LYS 244 Ca 0.13 1.48 -0.28 0.00 -1.01 0.00 0.00 55.97 56.28 3a9t s LYS 244 Cb -0.20 -3.63 -0.01 0.00 -1.01 0.00 0.00 37.83 32.98 3a9t s LYS 244 CO 0.12 -0.54 0.95 0.08 0.51 0.00 0.00 175.35 176.47 3a9t s VAL 245 N 2.80 4.82 0.60 3.17 1.01 -1.26 -0.81 120.40 130.73 3a9t s VAL 245 Ca 0.49 1.92 -0.04 0.00 0.00 0.00 0.00 61.98 64.35 3a9t s VAL 245 Cb -0.19 -4.26 0.13 0.00 0.00 0.00 0.00 36.38 32.06 3a9t s VAL 245 CO 0.13 0.02 0.83 0.61 0.00 0.00 0.00 175.10 176.68 3a9t n GLY 246 N 3.18 0.02 3.75 4.51 0.00 0.37 -4.86 105.19 112.17 3a9t n GLY 246 Ca 0.07 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 3a9t n GLY 246 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3a9t s PRO 247 N -4.66 3.20 -0.20 1.61 0.02 -1.26 -4.67 135.00 129.04 3a9t s PRO 247 Ca 0.52 2.13 -0.22 0.00 0.02 0.00 0.00 61.00 63.44 3a9t s PRO 247 Cb -0.02 -2.24 -0.02 0.00 0.02 0.00 0.00 34.50 32.24 3a9t s PRO 247 CO 0.35 -1.11 0.69 0.34 -0.33 0.00 0.00 177.00 176.94 3a9t s ASP 248 N -1.08 6.75 0.06 2.53 -1.08 -1.26 -4.48 116.67 118.10 3a9t s ASP 248 Ca 0.71 0.91 0.23 0.00 -0.52 0.00 0.00 52.55 53.89 3a9t s ASP 248 Cb -0.38 -2.38 0.15 0.00 -1.46 0.00 0.00 42.92 38.85 3a9t s ASP 248 CO 0.44 -0.33 1.12 0.59 0.52 0.00 0.00 175.17 177.52 3a9t n ASN 249 N 5.22 0.63 -4.78 -0.34 4.13 -1.26 -4.89 115.26 113.97 3a9t n ASN 249 Ca 0.01 -0.15 -0.41 0.00 1.68 0.00 0.00 54.58 55.71 3a9t n ASN 249 Cb 0.49 0.60 -0.01 0.00 -1.54 0.00 0.00 39.78 39.33 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 -3.91 6.47 0.17 6.41 0.01 -1.26 -4.99 114.94 117.84 3a9t s ASN 250 Ca 0.05 2.94 0.02 0.00 -0.71 0.00 0.00 52.86 55.17 3a9t s ASN 250 Cb 0.14 -2.66 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 3a9t s ASN 250 CO 0.78 -0.78 0.32 -0.13 -1.51 0.00 0.00 177.10 175.78 3a9t s ARG 251 N -1.98 3.45 0.07 -0.60 3.00 -1.26 -4.64 118.95 116.99 3a9t s ARG 251 Ca 0.52 -0.58 -0.20 0.00 0.00 0.00 0.00 55.73 55.47 3a9t s ARG 251 Cb -0.45 -2.93 -0.11 0.00 0.00 0.00 0.00 34.95 31.47 3a9t s ARG 251 CO 0.60 0.48 0.45 -0.25 0.00 0.00 0.00 175.30 176.58 3a9t n ASP 252 N -0.72 -0.43 0.00 0.23 9.92 -1.26 -0.24 116.55 124.05 3a9t n ASP 252 Ca -0.07 0.68 0.00 0.00 -0.53 0.00 0.00 54.79 54.87 3a9t n ASP 252 Cb 0.54 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 3a9t n ASP 252 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3a9t n GLY 253 N 1.06 3.28 0.08 0.44 0.00 -1.26 -4.74 105.19 104.05 3a9t n GLY 253 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.18 0.02 -3.24 1.61 3.01 0.66 -5.00 117.46 113.34 3a9t n PHE 254 Ca 0.00 -0.14 -0.39 0.00 1.01 0.00 0.00 57.45 57.93 3a9t n PHE 254 Cb 0.00 -0.01 -0.07 0.00 -0.01 0.00 0.00 39.48 39.39 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 -0.39 4.20 0.48 -1.08 1.02 -1.23 -4.46 119.74 118.27 3a9t s LYS 255 Ca 0.03 0.43 -0.17 0.00 0.02 0.00 0.00 55.97 56.27 3a9t s LYS 255 Cb 0.02 -3.56 -0.09 0.00 -0.52 0.00 0.00 37.83 33.68 3a9t s LYS 255 CO 0.02 -0.14 0.95 1.03 -0.92 0.00 0.00 175.35 176.29 3a9t s ARG 256 N 1.61 4.00 1.05 1.68 0.52 -1.26 -5.03 118.95 121.52 3a9t s ARG 256 Ca 0.24 0.94 -0.15 0.00 -0.52 0.00 0.00 55.73 56.24 3a9t s ARG 256 Cb -0.15 -2.18 0.21 0.00 0.52 0.00 0.00 34.95 33.35 3a9t s ARG 256 CO 0.10 -0.18 1.13 0.95 0.02 0.00 0.00 175.30 177.32 3a9t s THR 257 N -2.47 1.86 0.11 0.02 -4.23 -1.26 -4.80 115.64 104.87 3a9t s THR 257 Ca 0.59 0.00 -0.19 0.00 -1.18 0.00 0.00 61.69 60.91 3a9t s THR 257 Cb -0.10 -2.59 -0.06 0.00 1.34 0.00 0.00 72.50 71.10 3a9t s THR 257 CO 0.27 0.00 1.66 -0.08 -0.54 0.00 0.00 174.62 175.92 3a9t h GLU 258 N -2.04 0.40 -0.47 3.99 4.81 -1.98 -0.69 114.58 118.59 3a9t h GLU 258 Ca -0.50 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 58.69 3a9t h GLU 258 Cb 1.31 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 3a9t h GLU 258 CO 0.49 0.42 0.28 1.49 -0.73 0.00 0.00 179.01 180.96 3a9t h GLU 259 N 0.28 0.54 -0.71 1.92 4.81 -2.00 -1.43 114.58 118.00 3a9t h GLU 259 Ca 0.09 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.31 3a9t h GLU 259 Cb 0.17 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 3a9t h GLU 259 CO -0.01 0.36 0.46 1.96 -0.73 0.00 0.00 179.01 181.05 3a9t h GLN 260 N 0.56 0.89 0.00 1.92 4.20 -1.85 -1.93 115.11 118.91 3a9t h GLN 260 Ca 0.19 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.82 3a9t h GLN 260 Cb 0.02 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.59 3a9t h GLN 260 CO -0.09 0.59 -0.15 0.87 -0.67 0.00 0.00 178.83 179.38 3a9t h LYS 261 N 0.92 0.00 0.10 1.46 1.57 -0.43 0.36 116.57 120.55 3a9t h LYS 261 Ca 0.27 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.78 3a9t h LYS 261 Cb -0.05 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.28 3a9t h LYS 261 CO -0.08 0.15 -1.19 1.49 -0.57 0.00 0.00 179.45 179.25 3a9t h GLU 262 N 0.00 0.48 0.00 3.15 4.57 -0.53 -2.88 114.58 119.36 3a9t h GLU 262 Ca -0.00 -0.65 -0.12 0.00 -1.18 0.00 0.00 59.36 57.41 3a9t h GLU 262 Cb 0.43 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 3a9t h GLU 262 CO 0.02 1.28 -0.57 -0.22 -1.18 0.00 0.00 179.01 178.34 3a9t h LYS 263 N 0.21 0.00 -0.75 1.92 3.64 -1.05 -2.51 116.57 118.03 3a9t h LYS 263 Ca -0.15 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.18 3a9t h LYS 263 Cb 1.86 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.65 3a9t h LYS 263 CO 0.21 0.57 0.29 -0.44 -2.27 0.00 0.00 179.45 177.81 3a9t h ASP 264 N 0.00 1.03 0.17 4.20 5.19 -0.90 -0.94 116.42 125.18 3a9t h ASP 264 Ca -0.01 -0.17 -0.15 0.00 -0.62 0.00 0.00 57.03 56.08 3a9t h ASP 264 Cb 1.11 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.34 3a9t h ASP 264 CO 0.07 0.93 -0.54 -0.50 -3.12 0.00 0.00 179.24 176.08 3a9t h TRP 265 N 1.08 0.50 0.12 4.55 -0.00 -1.30 -2.12 115.95 118.77 3a9t h TRP 265 Ca 0.25 -0.17 -0.01 0.00 -0.00 0.00 0.00 58.89 58.96 3a9t h TRP 265 Cb 0.22 -0.09 0.00 0.00 -0.00 0.00 0.00 29.16 29.29 3a9t h TRP 265 CO 0.02 0.85 -0.06 0.93 -0.00 0.00 0.00 178.44 180.18 3a9t h GLU 266 N 0.31 -0.16 -0.17 0.49 5.08 -1.07 -2.16 114.58 116.90 3a9t h GLU 266 Ca 0.01 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 266 Cb 1.05 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3a9t h GLU 266 CO 0.09 0.22 0.09 0.82 -1.00 0.00 0.00 179.01 179.23 3a9t h ILE 267 N -0.56 1.10 -0.71 3.13 2.04 -1.25 -1.08 117.51 120.18 3a9t h ILE 267 Ca -0.02 -0.27 0.13 0.00 1.00 0.00 0.00 64.86 65.71 3a9t h ILE 267 Cb 0.45 0.98 -0.09 0.00 -0.74 0.00 0.00 36.82 37.41 3a9t h ILE 267 CO 0.03 0.09 0.25 0.28 0.00 0.00 0.00 178.15 178.80 3a9t h SER 268 N 0.17 0.21 -0.28 1.72 0.02 -1.41 0.49 113.55 114.46 3a9t h SER 268 Ca 0.06 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 3a9t h SER 268 Cb 0.07 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3a9t h SER 268 CO -0.01 0.08 0.07 0.58 -1.14 0.00 0.00 176.83 176.42 3a9t h VAL 269 N 0.40 1.21 -0.65 2.27 2.07 -1.06 -2.02 116.25 118.46 3a9t h VAL 269 Ca 0.39 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3a9t h VAL 269 Cb 0.58 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3a9t h VAL 269 CO -0.40 0.23 0.40 0.11 0.02 0.00 0.00 177.57 177.93 3a9t h LYS 270 N 0.29 0.87 -0.78 1.57 1.57 0.17 -1.60 116.57 118.66 3a9t h LYS 270 Ca 0.09 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3a9t h LYS 270 Cb 0.27 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 3a9t h LYS 270 CO -0.00 0.60 0.46 0.52 -0.57 0.00 0.00 179.45 180.47 3a9t h MET 271 N 0.89 1.06 -0.62 3.15 2.86 0.29 -0.25 114.93 122.32 3a9t h MET 271 Ca 0.24 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.74 3a9t h MET 271 Cb -0.05 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.36 3a9t h MET 271 CO -0.05 0.76 0.25 0.00 1.06 0.00 0.00 176.91 178.93 3a9t h ALA 272 N 1.24 0.80 -0.44 6.32 0.00 -0.59 -1.11 119.26 125.49 3a9t h ALA 272 Ca 0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3a9t h ALA 272 Cb -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3a9t h ALA 272 CO -0.05 0.41 0.11 -0.07 0.00 0.00 0.00 179.25 179.66 3a9t h LEU 273 N 0.86 0.65 -0.42 0.00 3.38 -0.81 -2.52 115.31 116.45 3a9t h LEU 273 Ca 0.21 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 3a9t h LEU 273 Cb 0.20 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3a9t h LEU 273 CO -0.02 0.71 -0.27 0.40 0.09 0.00 0.00 178.44 179.35 3a9t h ILE 274 N 0.57 1.27 -0.71 1.22 2.04 -0.91 -0.56 117.51 120.43 3a9t h ILE 274 Ca 0.14 -1.43 -0.04 0.00 1.00 0.00 0.00 64.86 64.53 3a9t h ILE 274 Cb 0.30 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 3a9t h ILE 274 CO -0.00 0.48 0.29 0.00 0.00 0.00 0.00 178.15 178.92 3a9t h ALA 275 N 0.81 1.17 -0.23 1.87 0.00 -1.18 0.01 119.26 121.70 3a9t h ALA 275 Ca 0.08 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 3a9t h ALA 275 Cb 0.85 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3a9t h ALA 275 CO 0.07 0.60 -0.64 -0.09 0.00 0.00 0.00 179.25 179.19 3a9t h ARG 276 N 1.02 0.84 -0.54 0.00 2.43 -1.33 -2.29 114.38 114.51 3a9t h ARG 276 Ca 0.24 -0.59 -0.05 0.00 -0.81 0.00 0.00 59.98 58.77 3a9t h ARG 276 Cb 0.19 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 3a9t h ARG 276 CO -0.02 1.21 0.13 -0.44 -1.51 0.00 0.00 179.97 179.35 3a9t h ASP 277 N 0.62 0.77 -0.35 -3.80 3.32 -0.73 -1.76 116.42 114.48 3a9t h ASP 277 Ca -0.01 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 3a9t h ASP 277 Cb 1.26 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 3a9t h ASP 277 CO 0.14 0.75 0.00 -0.07 -1.72 0.00 0.00 179.24 178.35 3a9t h LEU 278 N 0.80 0.60 0.31 1.55 3.38 -0.93 0.39 115.31 121.41 3a9t h LEU 278 Ca 0.18 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3a9t h LEU 278 Cb 0.29 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3a9t h LEU 278 CO -0.00 0.76 -0.15 0.24 0.09 0.00 0.00 178.44 179.38 3a9t h MET 279 N 0.43 -0.40 -0.08 1.13 2.86 -1.08 0.56 114.93 118.35 3a9t h MET 279 Ca 0.10 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3a9t h MET 279 Cb 0.45 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3a9t h MET 279 CO 0.02 -0.12 0.00 1.33 1.06 0.00 0.00 176.91 179.20 3a9t n VAL 280 N -5.17 0.48 -0.11 -2.22 0.24 -0.69 -1.23 118.33 109.62 3a9t n VAL 280 Ca -0.10 -0.74 0.01 0.00 -2.04 0.00 0.00 64.34 61.48 3a9t n VAL 280 Cb 0.24 0.82 -0.00 0.00 -1.47 0.00 0.00 33.84 33.43 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 0.13 -1.38 3.15 7.63 0.00 0.14 -4.74 105.19 110.12 3a9t n GLY 281 Ca 0.04 -1.51 0.04 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.64 -1.19 0.63 1.61 3.84 -0.07 -4.58 114.94 112.55 3a9t s ASN 282 Ca 0.00 0.66 0.38 0.00 0.21 0.00 0.00 52.86 54.11 3a9t s ASN 282 Cb 0.00 1.97 2.14 0.00 -0.55 0.00 0.00 41.25 44.81 3a9t s ASN 282 CO 0.00 -0.22 2.31 0.50 -2.79 0.00 0.00 177.10 176.90 3a9t h LYS 283 N 7.98 0.00 0.00 0.43 3.64 -1.94 -1.51 116.57 125.17 3a9t h LYS 283 Ca -0.18 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 3a9t h LYS 283 Cb 1.17 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 3a9t h LYS 283 CO 0.16 0.00 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.10 3a9t h LYS 284 N 0.00 0.00 0.00 1.90 1.63 -1.95 -1.66 116.57 116.48 3a9t h LYS 284 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3a9t h LYS 284 Cb 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 3a9t h LYS 284 CO 0.00 0.03 0.00 -0.07 -3.45 0.00 0.00 179.45 175.96 3a9t h LEU 285 N 0.00 0.00 0.22 5.20 3.38 -1.57 -3.20 115.31 119.34 3a9t h LEU 285 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3a9t h LEU 285 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3a9t h LEU 285 CO 0.00 0.00 -0.10 -0.33 0.09 0.00 0.00 178.44 178.10 3a9t h GLU 286 N 0.00 -0.28 0.00 1.13 5.08 -1.47 0.13 114.58 119.17 3a9t h GLU 286 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3a9t h GLU 286 Cb 0.34 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3a9t h GLU 286 CO 0.00 0.07 0.00 1.05 -1.00 0.00 0.00 179.01 179.13 3a9t h GLU 287 N -0.69 0.00 -0.00 2.33 4.11 -1.71 -1.43 114.58 117.19 3a9t h GLU 287 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 3a9t h GLU 287 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3a9t h GLU 287 CO 0.05 0.00 -0.08 -1.33 0.07 0.00 0.00 179.01 177.72 3a9t n MET 288 N -2.94 0.54 -0.24 1.06 2.81 -1.12 -4.90 117.12 112.32 3a9t n MET 288 Ca -0.01 -0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 3a9t n MET 288 Cb 0.17 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 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 1.30 0.86 2.63 3.03 0.00 -0.54 -5.02 105.19 107.46 3a9t n GLY 289 Ca 0.14 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.24 3.33 -0.24 1.61 4.02 0.44 -4.93 117.16 119.15 3a9t n TYR 290 Ca 0.00 -4.02 -0.06 0.00 -0.01 0.00 0.00 57.90 53.81 3a9t n TYR 290 Cb 0.00 -0.50 0.05 0.00 -0.02 0.00 0.00 39.34 38.86 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 3.51 0.99 0.97 2.72 0.00 -1.80 -0.44 103.07 109.02 3a9t h GLY 291 Ca 0.15 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 3a9t h GLY 291 CO 0.78 0.40 0.17 -2.09 0.00 0.00 0.00 176.54 175.80 3a9t h GLU 292 N 0.92 0.78 -0.43 4.80 4.81 -1.93 -2.68 114.58 120.85 3a9t h GLU 292 Ca 0.24 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 3a9t h GLU 292 Cb -0.01 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 3a9t h GLU 292 CO -0.04 0.72 -0.06 0.93 -0.73 0.00 0.00 179.01 179.83 3a9t h GLU 293 N 0.69 0.72 -0.69 1.92 3.07 -1.91 -2.68 114.58 115.71 3a9t h GLU 293 Ca 0.17 -0.21 0.11 0.00 -0.50 0.00 0.00 59.36 58.92 3a9t h GLU 293 Cb 0.25 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 3a9t h GLU 293 CO -0.01 0.77 0.46 0.00 -1.40 0.00 0.00 179.01 178.84 3a9t h ALA 294 N 1.27 1.95 -0.41 3.43 0.00 -0.74 -3.04 119.26 121.72 3a9t h ALA 294 Ca 0.12 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.11 3a9t h ALA 294 Cb 0.49 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 3a9t h ALA 294 CO 0.03 -0.11 -0.09 -0.07 0.00 0.00 0.00 179.25 179.00 3a9t h LEU 295 N 0.51 -0.36 0.00 0.00 3.38 -1.29 -0.15 115.31 117.40 3a9t h LEU 295 Ca 0.32 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.41 3a9t h LEU 295 Cb 0.57 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3a9t h LEU 295 CO -0.11 -0.13 0.00 0.61 0.09 0.00 0.00 178.44 178.91 3a9t n GLY 296 N -1.31 -0.39 0.57 0.83 0.00 -1.15 -4.27 105.19 99.47 3a9t n GLY 296 Ca 0.02 -1.79 0.06 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.41 2.75 -4.16 1.61 5.12 0.19 -4.84 116.66 116.91 3a9t n ARG 297 Ca 0.00 -2.29 -0.34 0.00 -1.93 0.00 0.00 57.85 53.29 3a9t n ARG 297 Cb 0.00 -1.45 -0.03 0.00 -1.16 0.00 0.00 32.46 29.83 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 -0.17 -2.56 -4.65 0.55 5.15 -1.03 -4.54 115.26 108.00 3a9t n ASN 298 Ca 0.14 -1.01 -0.38 0.00 -0.60 0.00 0.00 54.58 52.73 3a9t n ASN 298 Cb 0.58 -2.82 -0.08 0.00 -0.53 0.00 0.00 39.78 36.92 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 -3.47 3.57 -2.57 5.20 0.00 -0.37 -1.32 121.76 122.80 3a9t s ALA 299 Ca 0.55 -0.68 0.26 0.00 0.00 0.00 0.00 51.96 52.09 3a9t s ALA 299 Cb -0.30 -2.57 0.80 0.00 0.00 0.00 0.00 23.12 21.05 3a9t s ALA 299 CO 0.92 -0.35 1.60 1.51 0.00 0.00 0.00 175.76 179.44 3a9t n ILE 300 N 4.49 0.05 -3.61 0.00 3.06 -0.85 -4.63 119.36 117.87 3a9t n ILE 300 Ca -0.10 -0.34 -0.13 0.00 -2.50 0.00 0.00 62.75 59.68 3a9t n ILE 300 Cb 0.51 0.71 -0.07 0.00 0.54 0.00 0.00 39.64 41.34 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 -1.95 0.00 0.24 9.51 0.11 -1.24 -4.43 120.40 122.64 3a9t s VAL 301 Ca 0.35 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.32 3a9t s VAL 301 Cb 0.20 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 34.04 3a9t s VAL 301 CO 0.32 0.00 0.37 0.00 -3.33 0.00 0.00 175.10 172.46 3a9t s ALA 302 N -0.10 0.26 0.04 1.54 0.00 -0.55 -1.37 121.76 121.58 3a9t s ALA 302 Ca -0.01 -1.17 -0.05 0.00 0.00 0.00 0.00 51.96 50.72 3a9t s ALA 302 Cb -0.04 1.17 -0.01 0.00 0.00 0.00 0.00 23.12 24.24 3a9t s ALA 302 CO 0.01 -0.77 0.08 0.20 0.00 0.00 0.00 175.76 175.28 3a9t s GLY 303 N -3.08 0.19 -0.13 0.00 0.00 -0.34 0.75 107.32 104.72 3a9t s GLY 303 Ca 0.28 -0.58 -0.00 0.00 0.00 0.00 0.00 44.72 44.42 3a9t s GLY 303 CO 0.11 -0.71 -0.10 -0.12 0.00 0.00 0.00 173.10 172.29 3a9t s PHE 304 N -2.54 1.72 0.04 1.90 5.36 -0.52 -1.11 117.98 122.84 3a9t s PHE 304 Ca -0.06 -0.92 -0.24 0.00 -0.96 0.00 0.00 56.93 54.76 3a9t s PHE 304 Cb -0.02 -1.36 -0.13 0.00 -0.34 0.00 0.00 43.02 41.18 3a9t s PHE 304 CO -0.04 -0.57 1.36 0.37 -1.46 0.00 0.00 175.22 174.88 3a9t h GLN 305 N 8.13 -0.78 0.00 10.12 4.15 -1.29 0.03 115.11 135.48 3a9t h GLN 305 Ca -0.32 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.15 3a9t h GLN 305 Cb 1.13 0.18 0.00 0.00 0.21 0.00 0.00 27.48 29.00 3a9t h GLN 305 CO 0.45 -0.52 0.00 0.41 -1.93 0.00 0.00 178.83 177.24 3a9t n GLY 306 N -1.41 2.09 3.77 2.39 0.00 -1.26 -3.86 105.19 106.89 3a9t n GLY 306 Ca -0.10 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 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 4.26 -0.22 1.61 -0.21 -1.26 -1.40 119.66 122.44 3a9t s GLN 307 Ca 0.00 1.94 0.05 0.00 0.02 0.00 0.00 55.36 57.37 3a9t s GLN 307 Cb 0.00 -2.89 -0.20 0.00 1.00 0.00 0.00 33.01 30.92 3a9t s GLN 307 CO 0.00 -0.17 -0.07 0.54 -2.12 0.00 0.00 175.29 173.47 3a9t n ARG 308 N 0.51 0.67 -0.36 2.91 5.12 -1.26 -4.12 116.66 120.14 3a9t n ARG 308 Ca 0.02 0.13 -0.03 0.00 -1.93 0.00 0.00 57.85 56.04 3a9t n ARG 308 Cb 0.45 -1.55 0.01 0.00 -1.16 0.00 0.00 32.46 30.21 3a9t n ARG 308 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 3a9t h GLN 309 N 0.01 -0.03 0.31 5.56 7.50 -1.99 -0.93 115.11 125.54 3a9t h GLN 309 Ca -0.55 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.59 3a9t h GLN 309 Cb 2.00 0.01 0.00 0.00 0.05 0.00 0.00 27.48 29.54 3a9t h GLN 309 CO -0.04 -0.02 -0.15 2.35 -1.50 0.00 0.00 178.83 179.47 3a9t h TRP 310 N -0.03 -0.39 -0.32 2.96 2.91 -1.57 -3.31 115.95 116.21 3a9t h TRP 310 Ca 0.30 -0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.40 3a9t h TRP 310 Cb 0.57 0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 29.33 3a9t h TRP 310 CO -0.86 -0.06 0.24 1.79 -1.03 0.00 0.00 178.44 178.52 3a9t h THR 311 N -0.97 0.78 0.00 2.65 1.35 -1.41 0.61 112.91 115.92 3a9t h THR 311 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 3a9t h THR 311 Cb 0.50 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 3a9t h THR 311 CO 0.07 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.81 3a9t n ASP 312 N -4.34 0.06 0.00 5.36 8.00 -0.36 0.07 116.55 125.33 3a9t n ASP 312 Ca 0.05 0.52 0.00 0.00 0.71 0.00 0.00 54.79 56.07 3a9t n ASP 312 Cb 0.41 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.98 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 -1.58 0.00 -3.38 1.24 4.19 -0.53 -4.20 117.16 112.91 3a9t n TYR 313 Ca 0.01 0.00 -0.19 0.00 3.31 0.00 0.00 57.90 61.03 3a9t n TYR 313 Cb 0.07 0.05 -0.01 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 -1.37 2.80 0.51 2.98 0.08 0.09 -4.38 117.98 118.69 3a9t s PHE 314 Ca 0.00 -0.41 -0.22 0.00 0.12 0.00 0.00 56.93 56.41 3a9t s PHE 314 Cb 0.00 -2.19 -0.06 0.00 -0.57 0.00 0.00 43.02 40.20 3a9t s PHE 314 CO 0.00 -0.18 1.31 -2.14 -0.10 0.00 0.00 175.22 174.10 3a9t s PRO 315 N -4.20 3.39 1.26 0.24 0.02 -1.17 -3.80 135.00 130.74 3a9t s PRO 315 Ca 0.49 2.12 -0.21 0.00 0.02 0.00 0.00 61.00 63.42 3a9t s PRO 315 Cb -0.06 -2.35 0.31 0.00 0.02 0.00 0.00 34.50 32.42 3a9t s PRO 315 CO 0.30 -0.95 1.10 0.27 -0.33 0.00 0.00 177.00 177.38 3a9t n ASN 316 N -0.76 -2.21 -1.83 2.53 0.23 0.60 -4.80 115.26 109.02 3a9t n ASN 316 Ca 0.09 -1.17 -0.01 0.00 -0.53 0.00 0.00 54.58 52.96 3a9t n ASN 316 Cb 0.46 -1.02 0.33 0.00 -2.08 0.00 0.00 39.78 37.46 3a9t n ASN 316 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3a9t n GLY 317 N -4.92 3.57 0.13 4.83 0.00 -1.26 -4.63 105.19 102.91 3a9t n GLY 317 Ca 0.15 -1.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.06 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 2.90 -0.24 0.19 1.61 3.32 -1.88 0.17 116.42 122.49 3a9t h ASP 318 Ca 0.16 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 3a9t h ASP 318 Cb 2.13 0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.78 3a9t h ASP 318 CO 0.61 -0.12 -0.09 0.15 -1.72 0.00 0.00 179.24 178.06 3a9t h PHE 319 N -0.15 -0.24 -0.15 4.55 3.04 -1.82 0.12 116.94 122.29 3a9t h PHE 319 Ca 0.03 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.02 3a9t h PHE 319 Cb 0.18 0.08 -0.05 0.00 2.56 0.00 0.00 35.95 38.72 3a9t h PHE 319 CO -0.14 -0.09 -0.17 1.98 -2.02 0.00 0.00 178.31 177.86 3a9t h MET 320 N -0.33 -0.19 0.00 1.11 4.05 -1.76 0.45 114.93 118.25 3a9t h MET 320 Ca -0.03 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.37 3a9t h MET 320 Cb 0.26 0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.10 3a9t h MET 320 CO 0.04 -0.13 -0.16 0.93 0.23 0.00 0.00 176.91 177.82 3a9t h GLU 321 N -0.20 0.00 0.07 0.39 5.08 -0.55 -1.53 114.58 117.84 3a9t h GLU 321 Ca 0.10 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 321 Cb 0.36 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.62 3a9t h GLU 321 CO -0.27 0.16 -0.42 1.15 -1.00 0.00 0.00 179.01 178.63 3a9t h THR 322 N 0.00 1.64 -0.15 1.13 2.02 0.27 -3.28 112.91 114.54 3a9t h THR 322 Ca -0.00 -2.44 -0.03 0.00 0.77 0.00 0.00 66.41 64.71 3a9t h THR 322 Cb 0.34 3.28 -0.00 0.00 -1.74 0.00 0.00 68.15 70.03 3a9t h THR 322 CO 0.02 0.66 -0.04 -0.29 0.37 0.00 0.00 175.52 176.24 3a9t h ILE 323 N -0.70 1.29 -0.68 3.11 6.09 -0.02 -2.35 117.51 124.26 3a9t h ILE 323 Ca -0.08 -1.01 0.08 0.00 -1.37 0.00 0.00 64.86 62.49 3a9t h ILE 323 Cb 1.32 1.65 -0.07 0.00 0.47 0.00 0.00 36.82 40.19 3a9t h ILE 323 CO 0.07 0.30 0.33 -0.07 -3.07 0.00 0.00 178.15 175.71 3a9t h LEU 324 N -0.01 0.44 -0.99 2.19 4.07 -1.46 -1.42 115.31 118.14 3a9t h LEU 324 Ca 0.04 0.05 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 3a9t h LEU 324 Cb 0.48 -0.02 -0.00 0.00 1.08 0.00 0.00 40.66 42.19 3a9t h LEU 324 CO 0.02 0.26 -0.09 0.78 -1.08 0.00 0.00 178.44 178.33 3a9t h ASN 325 N 0.59 0.00 -3.41 -0.43 2.35 -1.61 0.84 115.58 113.92 3a9t h ASN 325 Ca 0.33 0.00 -0.42 0.00 -0.55 0.00 0.00 56.30 55.65 3a9t h ASN 325 Cb 0.32 0.00 0.20 0.00 0.05 0.00 0.00 38.32 38.88 3a9t h ASN 325 CO -0.25 0.09 0.05 -0.44 -1.65 0.00 0.00 177.43 175.23 3a9t s SER 326 N -5.97 0.83 -0.23 5.81 0.01 -0.53 -4.59 113.70 109.03 3a9t s SER 326 Ca 0.02 1.04 0.14 0.00 1.31 0.00 0.00 55.95 58.47 3a9t s SER 326 Cb 0.08 -1.57 0.61 0.00 0.21 0.00 0.00 66.02 65.35 3a9t s SER 326 CO 0.60 -4.22 1.55 -1.54 0.41 0.00 0.00 173.24 170.04 3a9t n SER 327 N -4.88 4.16 -3.56 2.44 3.41 -1.26 -4.06 113.62 109.86 3a9t n SER 327 Ca 0.08 -3.14 -0.07 0.00 -0.26 0.00 0.00 58.87 55.48 3a9t n SER 327 Cb 0.58 -0.61 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 3a9t n SER 327 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3a9t s PHE 328 N -2.91 -0.25 0.00 7.33 -0.12 -1.26 -1.78 117.98 118.99 3a9t s PHE 328 Ca 0.47 0.22 0.00 0.00 -0.05 0.00 0.00 56.93 57.57 3a9t s PHE 328 Cb 0.38 0.51 0.00 0.00 -0.63 0.00 0.00 43.02 43.28 3a9t s PHE 328 CO 0.10 -0.35 0.00 -0.40 -0.05 0.00 0.00 175.22 174.52 3a9t n ASP 329 N 0.02 0.00 0.22 1.98 5.68 -1.13 -4.96 116.55 118.35 3a9t n ASP 329 Ca -0.05 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.39 3a9t n ASP 329 Cb 0.60 0.00 0.65 0.00 -1.14 0.00 0.00 41.12 41.22 3a9t n ASP 329 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3a9t h TRP 330 N 0.00 0.00 -0.46 2.11 0.09 -1.94 -2.28 115.95 113.47 3a9t h TRP 330 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 3a9t h TRP 330 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.24 3a9t h TRP 330 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 178.44 178.62 3a9t n ASN 331 N -2.68 2.98 0.00 0.11 3.02 -1.26 -4.98 115.26 112.45 3a9t n ASN 331 Ca 0.01 -1.95 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 3a9t n ASN 331 Cb 0.23 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 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 1.40 -2.94 3.77 7.41 0.00 -0.86 -4.94 105.19 109.03 3a9t n GLY 332 Ca 0.19 -1.91 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.58 3.86 0.25 1.61 -2.85 -1.26 -2.85 119.74 117.92 3a9t s LYS 333 Ca 0.00 2.26 -0.22 0.00 -1.00 0.00 0.00 55.97 57.01 3a9t s LYS 333 Cb 0.00 -2.72 0.04 0.00 -2.06 0.00 0.00 37.83 33.09 3a9t s LYS 333 CO 0.00 -0.62 0.81 -0.98 0.10 0.00 0.00 175.35 174.66 3a9t s ARG 334 N -2.32 1.65 0.55 1.78 1.70 -0.74 -4.94 118.95 116.63 3a9t s ARG 334 Ca 0.58 -0.94 -0.18 0.00 -0.47 0.00 0.00 55.73 54.72 3a9t s ARG 334 Cb -0.40 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 34.47 3a9t s ARG 334 CO 0.52 -0.76 1.07 0.00 -1.08 0.00 0.00 175.30 175.04 3a9t s ALA 335 N -3.47 2.76 0.91 7.88 0.00 -1.26 -4.35 121.76 124.23 3a9t s ALA 335 Ca 0.12 0.56 -0.12 0.00 0.00 0.00 0.00 51.96 52.52 3a9t s ALA 335 Cb -0.04 -3.27 0.13 0.00 0.00 0.00 0.00 23.12 19.94 3a9t s ALA 335 CO 0.06 -0.65 1.11 -2.14 0.00 0.00 0.00 175.76 174.14 3a9t s PRO 336 N -3.63 1.18 -0.33 0.00 0.02 -1.26 -4.91 135.00 126.07 3a9t s PRO 336 Ca 0.67 0.53 0.03 0.00 0.02 0.00 0.00 61.00 62.25 3a9t s PRO 336 Cb -0.18 -1.82 0.09 0.00 0.02 0.00 0.00 34.50 32.61 3a9t s PRO 336 CO 0.29 -2.22 0.04 0.71 -0.33 0.00 0.00 177.00 175.49 3a9t s TYR 337 N -3.10 3.67 -0.63 6.54 2.02 0.29 -5.00 117.35 121.14 3a9t s TYR 337 Ca 0.63 -2.83 -0.27 0.00 -0.37 0.00 0.00 57.07 54.23 3a9t s TYR 337 Cb -0.16 -2.80 -0.11 0.00 -0.40 0.00 0.00 41.96 38.48 3a9t s TYR 337 CO 0.55 -0.94 2.48 -0.89 -1.57 0.00 0.00 175.55 175.19 3a9t n ILE 338 N 4.32 -0.06 -4.54 2.71 2.08 -1.26 -3.78 119.36 118.82 3a9t n ILE 338 Ca 0.01 -0.60 -0.33 0.00 0.56 0.00 0.00 62.75 62.38 3a9t n ILE 338 Cb 0.42 -2.20 -0.15 0.00 -0.75 0.00 0.00 39.64 36.96 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 11.46 2.76 -0.17 1.39 2.19 -1.26 -1.48 117.98 132.88 3a9t s PHE 339 Ca 1.07 -1.10 -0.14 0.00 0.33 0.00 0.00 56.93 57.09 3a9t s PHE 339 Cb -0.43 -1.88 -0.05 0.00 -1.31 0.00 0.00 43.02 39.35 3a9t s PHE 339 CO 0.31 -0.50 0.31 0.00 1.83 0.00 0.00 175.22 177.17 3a9t s ALA 340 N 0.83 3.58 0.46 11.12 0.00 0.23 -4.93 121.76 133.05 3a9t s ALA 340 Ca -0.05 -0.47 -0.23 0.00 0.00 0.00 0.00 51.96 51.21 3a9t s ALA 340 Cb -0.15 -2.44 -0.07 0.00 0.00 0.00 0.00 23.12 20.45 3a9t s ALA 340 CO -0.01 0.01 1.14 0.99 0.00 0.00 0.00 175.76 177.90 3a9t s THR 341 N 0.65 3.20 -1.42 0.00 2.01 -1.26 -1.44 115.64 117.38 3a9t s THR 341 Ca 0.17 0.89 0.00 0.00 0.31 0.00 0.00 61.69 63.06 3a9t s THR 341 Cb -0.13 -3.44 0.00 0.00 0.01 0.00 0.00 72.50 68.94 3a9t s THR 341 CO 0.05 -0.03 0.00 -0.62 -0.69 0.00 0.00 174.62 173.33 3a9t n GLU 342 N -0.52 -1.83 -3.10 4.92 1.02 -0.38 -1.94 120.64 118.81 3a9t n GLU 342 Ca 0.07 0.80 -0.20 0.00 -0.02 0.00 0.00 57.16 57.82 3a9t n GLU 342 Cb 0.49 -5.33 -0.00 0.00 -0.02 0.00 0.00 31.44 26.57 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 -1.57 -3.69 -4.58 1.62 5.15 -0.14 -4.36 115.26 107.68 3a9t n ASN 343 Ca -0.18 -0.21 -0.39 0.00 -0.60 0.00 0.00 54.58 53.20 3a9t n ASN 343 Cb 0.60 -3.08 -0.02 0.00 -0.53 0.00 0.00 39.78 36.76 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 -2.52 6.38 0.41 1.20 -1.08 -0.82 -4.07 116.67 116.16 3a9t s ASP 344 Ca 0.28 -2.26 0.15 0.00 -0.52 0.00 0.00 52.55 50.21 3a9t s ASP 344 Cb -0.15 -2.58 1.01 0.00 -1.46 0.00 0.00 42.92 39.73 3a9t s ASP 344 CO 0.35 -1.66 1.89 -0.55 0.52 0.00 0.00 175.17 175.71 3a9t h ASN 345 N 8.11 0.46 -0.60 -0.34 7.08 -1.66 0.24 115.58 128.87 3a9t h ASN 345 Ca 0.39 0.03 -0.09 0.00 -3.08 0.00 0.00 56.30 53.56 3a9t h ASN 345 Cb 0.89 -0.06 -0.02 0.00 -2.08 0.00 0.00 38.32 37.05 3a9t h ASN 345 CO 1.40 0.22 0.04 -0.07 -2.08 0.00 0.00 177.43 176.94 3a9t h LEU 346 N 0.48 1.00 -1.13 6.14 3.38 -1.83 -1.20 115.31 122.15 3a9t h LEU 346 Ca 0.42 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 3a9t h LEU 346 Cb 0.93 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3a9t h LEU 346 CO -0.16 1.04 -0.24 -1.13 0.09 0.00 0.00 178.44 178.04 3a9t h ASN 347 N 0.93 0.00 -0.39 -0.43 -1.24 -1.32 -1.77 115.58 111.37 3a9t h ASN 347 Ca 0.18 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 57.07 3a9t h ASN 347 Cb 0.50 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 3a9t h ASN 347 CO 0.02 0.24 -0.18 1.23 -1.29 0.00 0.00 177.43 177.46 3a9t h GLY 348 N 2.00 0.94 1.19 1.57 0.00 -0.18 -1.71 103.07 106.89 3a9t h GLY 348 Ca -0.00 -0.78 -0.20 0.00 0.00 0.00 0.00 47.33 46.34 3a9t h GLY 348 CO 0.03 0.72 -0.64 -2.22 0.00 0.00 0.00 176.54 174.43 3a9t h ILE 349 N 0.77 1.28 -0.45 2.60 1.08 -0.79 -0.71 117.51 121.29 3a9t h ILE 349 Ca 0.11 -1.83 0.07 0.00 -0.39 0.00 0.00 64.86 62.82 3a9t h ILE 349 Cb 0.71 1.77 -0.06 0.00 -3.07 0.00 0.00 36.82 36.17 3a9t h ILE 349 CO 0.05 0.59 0.11 0.28 -0.69 0.00 0.00 178.15 178.50 3a9t h SER 350 N 0.61 0.06 -0.56 1.72 0.02 -1.16 0.13 113.55 114.37 3a9t h SER 350 Ca -0.01 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 3a9t h SER 350 Cb 1.25 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.85 3a9t h SER 350 CO 0.14 0.07 0.26 0.24 -1.14 0.00 0.00 176.83 176.39 3a9t h MET 351 N 0.26 0.81 -0.86 3.45 2.86 -1.22 -2.92 114.93 117.31 3a9t h MET 351 Ca 0.22 -0.12 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3a9t h MET 351 Cb 0.26 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 3a9t h MET 351 CO -0.26 0.67 0.57 1.25 1.06 0.00 0.00 176.91 180.20 3a9t h LEU 352 N 0.76 0.98 -0.07 1.22 5.85 0.17 -0.45 115.31 123.78 3a9t h LEU 352 Ca 0.19 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.91 3a9t h LEU 352 Cb 0.13 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 3a9t h LEU 352 CO -0.02 0.71 -0.10 -0.26 -0.34 0.00 0.00 178.44 178.43 3a9t h PHE 353 N 1.16 -0.24 -0.41 1.25 0.05 -0.61 0.44 116.94 118.56 3a9t h PHE 353 Ca 0.31 0.01 -0.08 0.00 3.82 0.00 0.00 57.97 62.03 3a9t h PHE 353 Cb -0.14 0.12 -0.02 0.00 2.00 0.00 0.00 35.95 37.92 3a9t h PHE 353 CO -0.01 -0.15 -0.08 0.78 -0.18 0.00 0.00 178.31 178.67 3a9t h GLY 354 N -0.14 0.77 0.84 -1.45 0.00 -1.37 -2.25 103.07 99.47 3a9t h GLY 354 Ca 0.06 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 3a9t h GLY 354 CO -0.15 0.51 0.03 -1.82 0.00 0.00 0.00 176.54 175.11 3a9t h TYR 355 N 0.66 0.16 0.00 5.60 5.03 -0.60 -1.08 116.97 126.75 3a9t h TYR 355 Ca 0.12 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 3a9t h TYR 355 Cb 0.53 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.76 3a9t h TYR 355 CO 0.03 0.30 -0.06 -0.07 -1.32 0.00 0.00 178.16 177.04 3a9t h LEU 356 N -0.02 0.00 0.00 2.82 3.38 -0.83 0.92 115.31 121.58 3a9t h LEU 356 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3a9t h LEU 356 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3a9t h LEU 356 CO -0.00 0.06 -0.82 -0.07 0.09 0.00 0.00 178.44 177.70 3a9t h LEU 357 N 0.00 0.00 0.00 1.67 3.38 -1.04 -3.42 115.31 115.91 3a9t h LEU 357 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3a9t h LEU 357 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3a9t h LEU 357 CO 0.01 0.05 -0.38 0.35 0.09 0.00 0.00 178.44 178.56 3a9t n THR 358 N -2.46 0.00 -1.97 0.22 -2.24 -0.44 -5.01 114.28 102.38 3a9t n THR 358 Ca 0.01 -0.09 -0.16 0.00 -2.27 0.00 0.00 64.05 61.55 3a9t n THR 358 Cb 0.50 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 69.22 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 -0.75 -4.79 -4.17 3.42 3.02 0.31 -4.76 115.26 107.54 3a9t n ASN 359 Ca 0.00 0.14 -0.22 0.00 -0.03 0.00 0.00 54.58 54.48 3a9t n ASN 359 Cb 0.00 -3.82 -0.14 0.00 -0.61 0.00 0.00 39.78 35.22 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 -2.71 1.28 0.44 3.41 -4.23 -1.26 -4.15 115.64 108.43 3a9t s THR 360 Ca 0.00 -1.05 -0.22 0.00 -1.18 0.00 0.00 61.69 59.24 3a9t s THR 360 Cb 0.00 -1.14 -0.12 0.00 1.34 0.00 0.00 72.50 72.58 3a9t s THR 360 CO 0.00 0.07 0.62 0.00 -0.54 0.00 0.00 174.62 174.77 3a9t n ALA 361 N 1.90 -1.18 -2.37 3.99 0.00 -1.26 -4.53 120.51 117.06 3a9t n ALA 361 Ca -0.18 0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.10 3a9t n ALA 361 Cb 0.54 -1.83 -0.15 0.00 0.00 0.00 0.00 19.45 18.02 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 -1.73 1.97 -0.30 0.00 -1.52 -1.26 -4.67 119.66 112.14 3a9t s GLN 362 Ca 0.64 -1.02 -0.14 0.00 -1.95 0.00 0.00 55.36 52.89 3a9t s GLN 362 Cb -0.57 -2.06 -0.03 0.00 -0.22 0.00 0.00 33.01 30.13 3a9t s GLN 362 CO 0.57 0.54 0.32 0.42 -0.25 0.00 0.00 175.29 176.89 3a9t s ILE 363 N -0.78 5.21 0.28 1.08 -1.09 0.17 -4.63 121.20 121.45 3a9t s ILE 363 Ca 0.12 0.24 -0.29 0.00 -2.23 0.00 0.00 60.65 58.49 3a9t s ILE 363 Cb -0.10 -3.71 -0.09 0.00 -1.58 0.00 0.00 42.46 36.98 3a9t s ILE 363 CO 0.02 0.08 1.05 0.12 -1.23 0.00 0.00 174.94 174.98 3a9t s PHE 364 N 1.96 3.65 -0.08 3.97 2.19 -1.26 -0.73 117.98 127.68 3a9t s PHE 364 Ca 0.11 1.75 -0.30 0.00 0.33 0.00 0.00 56.93 58.82 3a9t s PHE 364 Cb -0.16 -3.19 0.10 0.00 -1.31 0.00 0.00 43.02 38.46 3a9t s PHE 364 CO 0.11 -0.29 0.83 0.00 1.83 0.00 0.00 175.22 177.70 3a9t s ALA 365 N -1.22 -1.84 0.07 11.12 0.00 -1.03 -4.36 121.76 124.50 3a9t s ALA 365 Ca 0.45 1.38 -0.16 0.00 0.00 0.00 0.00 51.96 53.62 3a9t s ALA 365 Cb -0.29 -0.24 -0.06 0.00 0.00 0.00 0.00 23.12 22.52 3a9t s ALA 365 CO 0.37 -0.39 0.50 -0.51 0.00 0.00 0.00 175.76 175.74 3a9t s ASP 366 N -1.32 6.90 -0.96 0.00 -0.00 -1.23 -1.22 116.67 118.84 3a9t s ASP 366 Ca -0.05 1.09 -0.17 0.00 -0.00 0.00 0.00 52.55 53.42 3a9t s ASP 366 Cb -0.00 -2.30 0.15 0.00 -0.00 0.00 0.00 42.92 40.77 3a9t s ASP 366 CO 0.04 0.25 1.13 -0.69 -0.00 0.00 0.00 175.17 175.89 3a9t s VAL 367 N -1.20 4.90 -0.13 -1.27 1.01 0.80 -1.54 120.40 122.97 3a9t s VAL 367 Ca 0.29 -1.86 -0.26 0.00 0.00 0.00 0.00 61.98 60.15 3a9t s VAL 367 Cb -0.17 -4.76 -0.23 0.00 0.00 0.00 0.00 36.38 31.22 3a9t s VAL 367 CO 0.17 -1.46 0.69 -0.09 0.00 0.00 0.00 175.10 174.41 3a9t h ARG 368 N 8.44 -0.00 -3.13 2.72 9.65 -1.61 -3.48 114.38 126.97 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 1.00 0.00 -0.25 0.00 -1.39 0.00 0.00 29.97 29.34 3a9t h ARG 368 CO 1.08 0.88 -0.41 0.99 2.80 0.00 0.00 179.97 185.32 3a9t s THR 369 N -2.16 0.01 -0.32 0.20 2.01 -1.20 -4.99 115.64 109.19 3a9t s THR 369 Ca -0.17 -0.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.62 3a9t s THR 369 Cb -0.03 -0.40 -0.02 0.00 0.01 0.00 0.00 72.50 72.07 3a9t s THR 369 CO 0.61 -0.05 0.20 -0.47 -0.69 0.00 0.00 174.62 174.22 3a9t s TYR 370 N -0.12 3.21 -0.44 4.92 5.04 -1.26 -0.47 117.35 128.23 3a9t s TYR 370 Ca -0.02 -0.23 -0.14 0.00 -2.44 0.00 0.00 57.07 54.23 3a9t s TYR 370 Cb -0.03 -2.42 0.05 0.00 0.35 0.00 0.00 41.96 39.92 3a9t s TYR 370 CO 0.01 -0.34 0.34 -1.58 -1.34 0.00 0.00 175.55 172.64 3a9t s TRP 371 N 1.70 3.25 0.52 4.97 0.52 0.32 -4.99 118.94 125.24 3a9t s TRP 371 Ca 0.06 -0.90 -0.17 0.00 0.02 0.00 0.00 56.10 55.11 3a9t s TRP 371 Cb -0.17 -2.92 -0.07 0.00 -1.15 0.00 0.00 33.47 29.15 3a9t s TRP 371 CO 0.09 -0.73 1.00 -1.54 0.02 0.00 0.00 176.95 175.79 3a9t s SER 372 N 2.20 6.46 0.40 2.95 1.04 -1.26 -1.21 113.70 124.28 3a9t s SER 372 Ca 0.04 1.64 0.13 0.00 0.48 0.00 0.00 55.95 58.25 3a9t s SER 372 Cb -0.22 -2.52 0.97 0.00 0.10 0.00 0.00 66.02 64.35 3a9t s SER 372 CO 0.07 -0.70 1.89 -0.65 0.98 0.00 0.00 173.24 174.83 3a9t h PRO 373 N 0.91 0.50 -0.43 4.02 0.11 -1.88 -1.01 132.00 134.23 3a9t h PRO 373 Ca -0.47 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 3a9t h PRO 373 Cb 1.19 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3a9t h PRO 373 CO 0.60 0.33 0.03 1.49 -0.21 0.00 0.00 178.00 180.25 3a9t h GLU 374 N 0.52 0.73 -0.41 1.05 4.22 -1.96 -2.58 114.58 116.15 3a9t h GLU 374 Ca 0.42 -0.22 -0.13 0.00 0.08 0.00 0.00 59.36 59.50 3a9t h GLU 374 Cb 0.86 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 3a9t h GLU 374 CO -0.16 0.79 -0.28 0.00 -2.18 0.00 0.00 179.01 177.18 3a9t h ALA 375 N 0.91 0.74 -0.18 2.92 0.00 -1.58 -0.55 119.26 121.52 3a9t h ALA 375 Ca 0.12 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 3a9t h ALA 375 Cb 0.45 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3a9t h ALA 375 CO 0.02 0.66 -0.23 0.28 0.00 0.00 0.00 179.25 179.98 3a9t h VAL 376 N 0.74 1.24 -0.10 0.00 2.07 -1.36 -0.83 116.25 118.01 3a9t h VAL 376 Ca 0.09 -1.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.40 3a9t h VAL 376 Cb 0.83 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3a9t h VAL 376 CO 0.07 0.34 -0.29 0.50 0.02 0.00 0.00 177.57 178.22 3a9t h LYS 377 N 0.28 0.37 -0.77 1.57 1.63 -1.22 -0.08 116.57 118.34 3a9t h LYS 377 Ca 0.05 -0.26 -0.04 0.00 -0.85 0.00 0.00 60.65 59.54 3a9t h LYS 377 Cb 0.57 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.21 3a9t h LYS 377 CO 0.04 0.88 0.32 -0.09 -3.45 0.00 0.00 179.45 177.15 3a9t h ARG 378 N -0.08 1.15 0.20 1.90 2.43 -0.90 0.19 114.38 119.27 3a9t h ARG 378 Ca -0.01 -0.20 -0.35 0.00 -0.81 0.00 0.00 59.98 58.61 3a9t h ARG 378 Cb 0.90 -0.19 0.02 0.00 -0.42 0.00 0.00 29.97 30.28 3a9t h ARG 378 CO 0.06 0.93 -1.70 0.28 -1.51 0.00 0.00 179.97 178.02 3a9t h VAL 379 N 1.11 1.00 0.00 0.20 2.07 -1.19 -3.40 116.25 116.04 3a9t h VAL 379 Ca 0.26 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 65.23 3a9t h VAL 379 Cb 0.20 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 3a9t h VAL 379 CO -0.02 0.85 -0.98 0.35 0.02 0.00 0.00 177.57 177.78 3a9t n THR 380 N -3.62 0.00 -0.32 2.57 -2.24 -0.05 -4.99 114.28 105.63 3a9t n THR 380 Ca -0.23 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3a9t n THR 380 Cb 1.08 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.92 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 1.62 1.87 3.84 3.38 0.00 0.66 -5.00 105.19 111.55 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 -3.15 3.67 -0.30 1.61 6.14 -1.25 -4.91 117.35 119.17 3a9t s TYR 382 Ca 0.00 1.09 -0.11 0.00 0.64 0.00 0.00 57.07 58.69 3a9t s TYR 382 Cb 0.00 -2.38 -0.04 0.00 0.42 0.00 0.00 41.96 39.97 3a9t s TYR 382 CO 0.00 0.50 0.19 0.99 0.64 0.00 0.00 175.55 177.87 3a9t s THR 383 N -1.33 5.16 0.40 4.34 2.01 -1.26 -3.28 115.64 121.68 3a9t s THR 383 Ca 0.34 -0.01 -0.26 0.00 0.31 0.00 0.00 61.69 62.06 3a9t s THR 383 Cb -0.16 -3.52 -0.10 0.00 0.01 0.00 0.00 72.50 68.72 3a9t s THR 383 CO 0.18 0.17 1.26 0.18 -0.69 0.00 0.00 174.62 175.73 3a9t n LEU 384 N 5.06 3.83 -4.46 4.42 4.77 -1.26 -5.01 117.00 124.35 3a9t n LEU 384 Ca -0.14 1.13 -0.22 0.00 -0.03 0.00 0.00 56.01 56.75 3a9t n LEU 384 Cb 0.51 -1.49 -0.09 0.00 -2.33 0.00 0.00 43.42 40.02 3a9t n LEU 384 CO 0.34 -0.65 -0.23 -1.61 -1.33 0.00 0.00 177.39 173.91 3a9t s GLU 385 N -2.11 1.73 5.22 3.23 2.02 -1.26 -4.34 118.70 123.19 3a9t s GLU 385 Ca 0.60 -2.01 0.00 0.00 0.02 0.00 0.00 54.97 53.58 3a9t s GLU 385 Cb -0.53 -0.65 0.00 0.00 0.10 0.00 0.00 34.13 33.06 3a9t s GLU 385 CO 0.59 -0.34 0.00 0.41 0.02 0.00 0.00 175.26 175.94 3a9t n GLY 386 N -0.75 3.01 0.30 -1.39 0.00 -1.26 -1.63 105.19 103.48 3a9t n GLY 386 Ca -0.03 -0.17 0.20 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.01 1.61 3.08 -1.99 -2.16 114.38 114.91 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 -0.16 0.00 -1.07 0.00 0.00 179.97 178.74 3a9t n ALA 388 N -2.09 2.89 0.30 0.04 0.00 -0.65 -4.39 120.51 116.62 3a9t n ALA 388 Ca -0.01 -0.44 0.15 0.00 0.00 0.00 0.00 53.44 53.14 3a9t n ALA 388 Cb 0.21 -1.12 0.78 0.00 0.00 0.00 0.00 19.45 19.32 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 3.97 1.26 -0.37 0.00 0.00 -1.02 -0.97 119.26 122.14 3a9t h ALA 389 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3a9t h ALA 389 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3a9t h ALA 389 CO 0.00 -0.26 0.00 0.09 0.00 0.00 0.00 179.25 179.08 3a9t n ASN 390 N -2.75 3.22 0.00 0.00 3.02 -1.26 -4.83 115.26 112.66 3a9t n ASN 390 Ca -0.02 -2.18 0.00 0.00 -0.03 0.00 0.00 54.58 52.35 3a9t n ASN 390 Cb 0.32 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 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 0.44 2.80 3.11 7.41 0.00 -0.37 -4.52 105.19 114.06 3a9t n GLY 391 Ca 0.14 -1.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.80 0.31 -0.13 -0.61 -4.36 -0.35 -4.73 121.20 108.53 3a9t s ILE 392 Ca 0.00 -1.84 0.00 0.00 -0.26 0.00 0.00 60.65 58.55 3a9t s ILE 392 Cb 0.00 -1.59 -0.01 0.00 1.25 0.00 0.00 42.46 42.11 3a9t s ILE 392 CO 0.00 -0.94 -0.15 -0.63 0.24 0.00 0.00 174.94 173.46 3a9t s ILE 393 N -3.87 2.85 -0.46 8.37 1.01 0.17 -0.52 121.20 128.75 3a9t s ILE 393 Ca 0.09 -0.73 -0.21 0.00 0.00 0.00 0.00 60.65 59.80 3a9t s ILE 393 Cb 0.07 -2.19 0.03 0.00 0.01 0.00 0.00 42.46 40.39 3a9t s ILE 393 CO -0.08 0.52 0.70 -2.28 0.00 0.00 0.00 174.94 173.80 3a9t s HIS 394 N 0.47 3.02 -0.25 3.97 5.65 0.39 -1.04 115.29 127.50 3a9t s HIS 394 Ca -0.11 -0.04 -0.10 0.00 0.25 0.00 0.00 55.06 55.07 3a9t s HIS 394 Cb -0.16 -3.50 -0.04 0.00 -1.18 0.00 0.00 32.58 27.69 3a9t s HIS 394 CO 0.05 -0.95 0.14 -0.51 -0.65 0.00 0.00 174.74 172.82 3a9t s LEU 395 N 3.01 3.90 -0.30 8.88 1.43 -0.37 -1.65 118.68 133.58 3a9t s LEU 395 Ca 0.24 -0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.36 3a9t s LEU 395 Cb -0.14 -2.06 0.19 0.00 0.03 0.00 0.00 46.19 44.22 3a9t s LEU 395 CO 0.19 0.01 0.60 -0.51 0.23 0.00 0.00 176.35 176.87 3a9t s ILE 396 N 1.38 -1.00 0.87 -0.59 2.07 -0.59 -1.36 121.20 121.99 3a9t s ILE 396 Ca 0.07 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.20 3a9t s ILE 396 Cb -0.15 -1.00 0.12 0.00 0.13 0.00 0.00 42.46 41.56 3a9t s ILE 396 CO 0.06 0.00 1.11 0.21 -1.91 0.00 0.00 174.94 174.42 3a9t s ASN 397 N 2.85 3.50 0.00 4.50 2.47 -1.26 -3.53 114.94 123.47 3a9t s ASN 397 Ca 0.16 1.94 0.00 0.00 0.42 0.00 0.00 52.86 55.38 3a9t s ASN 397 Cb -0.13 -2.50 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 3a9t s ASN 397 CO -0.23 -2.69 1.05 -1.54 -3.72 0.00 0.00 177.10 169.97 3a9t n SER 398 N -3.95 2.90 0.00 -4.21 3.41 -1.26 -4.38 113.62 106.13 3a9t n SER 398 Ca 0.10 -1.68 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 3a9t n SER 398 Cb 0.53 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 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 1.19 1.29 3.31 5.00 0.00 -1.26 -5.03 105.19 109.70 3a9t n GLY 399 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.57 2.20 -0.28 4.61 0.00 -1.26 -0.23 121.76 126.22 3a9t s ALA 400 Ca 0.00 -1.10 -0.22 0.00 0.00 0.00 0.00 51.96 50.65 3a9t s ALA 400 Cb 0.00 -0.61 0.12 0.00 0.00 0.00 0.00 23.12 22.64 3a9t s ALA 400 CO 0.00 0.51 0.98 0.00 0.00 0.00 0.00 175.76 177.25 3a9t s ALA 401 N -0.53 -2.04 0.17 0.00 0.00 -1.26 -4.70 121.76 113.40 3a9t s ALA 401 Ca 0.07 2.01 -0.33 0.00 0.00 0.00 0.00 51.96 53.71 3a9t s ALA 401 Cb -0.11 -1.50 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 3a9t s ALA 401 CO 0.00 -0.28 1.38 0.00 0.00 0.00 0.00 175.76 176.86 3a9t n ALA 402 N 2.79 0.31 0.26 0.00 0.00 -1.26 -4.71 120.51 117.89 3a9t n ALA 402 Ca -0.15 0.45 0.15 0.00 0.00 0.00 0.00 53.44 53.90 3a9t n ALA 402 Cb 0.56 -2.20 0.79 0.00 0.00 0.00 0.00 19.45 18.61 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 4.53 0.00 -1.91 0.00 3.38 -1.90 0.77 115.31 120.18 3a9t h LEU 403 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 3a9t h LEU 403 Cb 1.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 3a9t h LEU 403 CO 0.78 0.00 -0.09 0.44 0.09 0.00 0.00 178.44 179.66 3a9t h ASP 404 N 0.00 0.00 0.37 -0.43 5.19 -1.92 -2.51 116.42 117.12 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 0.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.77 3a9t h ASP 404 CO 0.00 0.09 0.00 0.61 -3.12 0.00 0.00 179.24 176.82 3a9t n GLY 405 N -0.54 -0.92 0.23 2.75 0.00 0.27 -2.29 105.19 104.69 3a9t n GLY 405 Ca -0.01 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 0.94 -0.06 2.61 1.35 -1.62 -3.38 112.91 112.74 3a9t h THR 406 Ca 0.00 -0.71 -0.03 0.00 -0.55 0.00 0.00 66.41 65.12 3a9t h THR 406 Cb 0.18 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 3a9t h THR 406 CO 0.00 0.19 -0.03 0.61 -0.25 0.00 0.00 175.52 176.04 3a9t n GLY 407 N -0.79 0.51 0.23 5.82 0.00 -0.97 -1.85 105.19 108.14 3a9t n GLY 407 Ca -0.02 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.57 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 0.38 0.00 -6.70 1.61 4.39 -1.81 -3.37 114.58 109.08 3a9t h GLU 408 Ca -0.03 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.15 3a9t h GLU 408 Cb 0.14 0.00 0.06 0.00 -0.10 0.00 0.00 28.75 28.84 3a9t h GLU 408 CO 0.04 0.01 0.84 -0.65 -1.16 0.00 0.00 179.01 178.10 3a9t s GLN 409 N -3.32 4.21 0.01 2.33 -0.21 -1.25 -4.85 119.66 116.57 3a9t s GLN 409 Ca 0.05 2.39 0.06 0.00 0.02 0.00 0.00 55.36 57.89 3a9t s GLN 409 Cb 0.06 -3.11 -0.02 0.00 1.00 0.00 0.00 33.01 30.94 3a9t s GLN 409 CO 0.64 -0.55 -0.19 0.99 -2.12 0.00 0.00 175.29 174.06 3a9t s THR 410 N 0.50 1.49 -0.05 -0.19 2.01 -1.26 -1.06 115.64 117.07 3a9t s THR 410 Ca 0.65 -0.92 -0.02 0.00 0.31 0.00 0.00 61.69 61.70 3a9t s THR 410 Cb -0.44 -1.26 0.04 0.00 0.01 0.00 0.00 72.50 70.84 3a9t s THR 410 CO 0.39 0.32 0.09 -0.75 -0.69 0.00 0.00 174.62 173.97 3a9t s LYS 411 N -0.71 -0.03 -1.48 4.92 2.20 -0.93 -4.83 119.74 118.89 3a9t s LYS 411 Ca 0.07 0.40 -0.05 0.00 -0.36 0.00 0.00 55.97 56.02 3a9t s LYS 411 Cb -0.08 -0.38 0.02 0.00 -1.51 0.00 0.00 37.83 35.89 3a9t s LYS 411 CO 0.00 -0.29 0.51 -0.25 -0.36 0.00 0.00 175.35 174.96 3a9t n ASP 412 N 5.05 -5.37 0.00 1.43 10.43 -1.26 -1.63 116.55 125.20 3a9t n ASP 412 Ca -0.09 -0.27 0.00 0.00 2.57 0.00 0.00 54.79 57.00 3a9t n ASP 412 Cb 0.50 -4.37 0.00 0.00 1.84 0.00 0.00 41.12 39.09 3a9t n ASP 412 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3a9t n GLY 413 N -1.36 0.47 3.61 0.44 0.00 -1.26 -5.01 105.19 102.07 3a9t n GLY 413 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.53 2.33 0.10 1.61 1.02 -0.64 -5.10 119.74 118.53 3a9t s LYS 414 Ca 0.00 -0.91 -0.31 0.00 0.02 0.00 0.00 55.97 54.77 3a9t s LYS 414 Cb 0.00 -2.41 -0.07 0.00 -0.52 0.00 0.00 37.83 34.83 3a9t s LYS 414 CO 0.00 0.54 1.30 -1.25 -0.92 0.00 0.00 175.35 175.02 3a9t s PRO 415 N -2.06 4.37 0.34 -1.68 0.04 -1.26 -2.18 135.00 132.56 3a9t s PRO 415 Ca 0.22 1.95 -0.04 0.00 0.04 0.00 0.00 61.00 63.16 3a9t s PRO 415 Cb -0.11 -3.28 0.02 0.00 0.04 0.00 0.00 34.50 31.16 3a9t s PRO 415 CO 0.14 -0.35 0.52 1.33 0.04 0.00 0.00 177.00 178.68 3a9t n VAL 416 N 3.84 0.00 -3.85 -0.36 0.24 -0.23 -4.70 118.33 113.26 3a9t n VAL 416 Ca 0.10 -1.51 -0.26 0.00 -2.04 0.00 0.00 64.34 60.63 3a9t n VAL 416 Cb 0.44 1.01 -0.17 0.00 -1.47 0.00 0.00 33.84 33.65 3a9t n VAL 416 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3a9t s ILE 417 N -2.65 0.83 0.32 1.34 1.01 -1.26 -3.91 121.20 116.87 3a9t s ILE 417 Ca 0.25 -0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.72 3a9t s ILE 417 Cb -0.02 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 3a9t s ILE 417 CO 0.18 0.26 0.24 -0.54 0.00 0.00 0.00 174.94 175.08 3a9t s LYS 418 N 1.78 2.69 0.47 2.79 1.02 -1.26 -4.91 119.74 122.31 3a9t s LYS 418 Ca 0.04 -1.29 -0.23 0.00 0.02 0.00 0.00 55.97 54.51 3a9t s LYS 418 Cb -0.13 -2.44 -0.07 0.00 -0.52 0.00 0.00 37.83 34.67 3a9t s LYS 418 CO -0.07 0.16 1.19 -2.14 -0.92 0.00 0.00 175.35 173.57 3a9t s PRO 419 N -3.93 3.70 0.33 -1.68 0.02 -1.26 -4.60 135.00 127.57 3a9t s PRO 419 Ca 0.39 1.83 0.12 0.00 0.02 0.00 0.00 61.00 63.35 3a9t s PRO 419 Cb -0.06 -2.40 0.96 0.00 0.02 0.00 0.00 34.50 33.03 3a9t s PRO 419 CO 0.25 -0.62 1.71 0.10 -0.33 0.00 0.00 177.00 178.12 3a9t h TYR 420 N 2.00 0.96 0.00 6.54 -0.00 -1.82 0.48 116.97 125.13 3a9t h TYR 420 Ca -0.49 0.04 0.00 0.00 -0.00 0.00 0.00 58.73 58.27 3a9t h TYR 420 Cb 1.25 -0.27 0.00 0.00 -0.00 0.00 0.00 36.73 37.71 3a9t h TYR 420 CO 0.53 -0.01 0.00 2.48 -0.00 0.00 0.00 178.16 181.16 3a9t n TYR 421 N -4.91 0.00 0.34 0.10 4.11 -1.26 -1.70 117.16 113.84 3a9t n TYR 421 Ca 0.28 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 58.22 3a9t n TYR 421 Cb 0.83 -0.08 0.03 0.00 -0.00 0.00 0.00 39.34 40.12 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 -1.08 0.30 -2.02 -3.48 1.02 0.16 -5.04 120.64 110.50 3a9t n GLU 422 Ca 0.08 -0.95 -0.38 0.00 -0.02 0.00 0.00 57.16 55.88 3a9t n GLU 422 Cb 0.05 -1.14 0.01 0.00 -0.02 0.00 0.00 31.44 30.34 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 -0.74 4.00 0.23 -4.62 1.43 -0.69 -4.99 118.68 113.29 3a9t s LEU 423 Ca 0.09 2.57 0.09 0.00 -1.03 0.00 0.00 54.13 55.85 3a9t s LEU 423 Cb 0.07 -4.17 -0.04 0.00 0.03 0.00 0.00 46.19 42.08 3a9t s LEU 423 CO 0.11 -1.16 0.00 0.42 0.23 0.00 0.00 176.35 175.95 3a9t s THR 424 N -1.38 3.58 0.45 5.49 -4.23 -1.26 -5.00 115.64 113.28 3a9t s THR 424 Ca 0.65 -1.69 0.17 0.00 -1.18 0.00 0.00 61.69 59.64 3a9t s THR 424 Cb -0.36 -2.87 0.36 0.00 1.34 0.00 0.00 72.50 70.98 3a9t s THR 424 CO 0.43 -0.26 1.94 0.44 -0.54 0.00 0.00 174.62 176.64 3a9t h ASP 425 N 2.23 0.32 0.20 3.99 3.32 -2.00 -0.47 116.42 124.01 3a9t h ASP 425 Ca -0.46 0.02 -0.19 0.00 0.02 0.00 0.00 57.03 56.42 3a9t h ASP 425 Cb 1.23 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 3a9t h ASP 425 CO 0.59 0.17 -0.72 -0.08 -1.72 0.00 0.00 179.24 177.48 3a9t h GLU 426 N 0.34 0.45 0.15 3.56 4.81 -1.99 -2.22 114.58 119.69 3a9t h GLU 426 Ca 0.33 -0.36 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3a9t h GLU 426 Cb 0.83 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 3a9t h GLU 426 CO -0.09 1.00 -0.20 -0.44 -0.73 0.00 0.00 179.01 178.54 3a9t h ASP 427 N 0.31 -0.56 -0.15 1.04 3.32 -1.43 -1.14 116.42 117.81 3a9t h ASP 427 Ca -0.03 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.11 3a9t h ASP 427 Cb 1.30 0.20 -0.03 0.00 0.22 0.00 0.00 39.33 41.02 3a9t h ASP 427 CO 0.13 -0.29 -0.06 0.40 -1.72 0.00 0.00 179.24 177.69 3a9t h ILE 428 N -0.41 0.79 -0.96 0.35 2.04 -1.46 -2.03 117.51 115.83 3a9t h ILE 428 Ca 0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.88 3a9t h ILE 428 Cb 0.41 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 3a9t h ILE 428 CO -0.09 0.00 0.63 0.50 0.00 0.00 0.00 178.15 179.20 3a9t h LYS 429 N -0.04 1.27 -0.38 2.37 3.64 -1.25 -2.17 116.57 120.01 3a9t h LYS 429 Ca 0.08 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 3a9t h LYS 429 Cb 0.16 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 3a9t h LYS 429 CO -0.18 0.84 -0.13 0.87 -2.27 0.00 0.00 179.45 178.59 3a9t h LYS 430 N 1.30 0.67 -0.22 1.90 1.57 -0.90 -0.38 116.57 120.52 3a9t h LYS 430 Ca 0.35 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3a9t h LYS 430 Cb -0.14 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 3a9t h LYS 430 CO -0.07 0.77 0.07 0.00 -0.57 0.00 0.00 179.45 179.65 3a9t h LEU 432 N 0.19 1.04 -0.93 0.00 3.38 -1.21 -2.79 115.31 114.99 3a9t h LEU 432 Ca 0.07 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 3a9t h LEU 432 Cb 0.24 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3a9t h LEU 432 CO -0.00 0.92 -0.42 -0.33 0.09 0.00 0.00 178.44 178.71 3a9t h GLU 433 N 1.10 0.00 -0.08 1.13 5.08 -0.94 -2.76 114.58 118.11 3a9t h GLU 433 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3a9t h GLU 433 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3a9t h GLU 433 CO -0.02 0.42 0.00 0.00 -1.00 0.00 0.00 179.01 178.40 3a9t n ALA 434 N -2.33 2.57 -2.60 3.43 0.00 -0.60 -4.84 120.51 116.14 3a9t n ALA 434 Ca -0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 53.44 52.78 3a9t n ALA 434 Cb 0.52 -1.21 -0.09 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.91 3.52 -0.04 0.00 2.01 -1.04 -4.58 115.64 113.60 3a9t s THR 435 Ca 0.34 -1.21 -0.01 0.00 0.31 0.00 0.00 61.69 61.11 3a9t s THR 435 Cb 0.17 -2.66 0.03 0.00 0.01 0.00 0.00 72.50 70.05 3a9t s THR 435 CO 0.27 0.10 0.03 -1.10 -0.69 0.00 0.00 174.62 173.23 3a9t s GLN 436 N -2.26 0.21 -0.15 4.92 -0.21 -0.54 -4.58 119.66 117.05 3a9t s GLN 436 Ca 0.23 0.22 -0.20 0.00 0.02 0.00 0.00 55.36 55.62 3a9t s GLN 436 Cb -0.11 -0.62 -0.03 0.00 1.00 0.00 0.00 33.01 33.25 3a9t s GLN 436 CO 0.15 -0.26 0.58 -0.06 -2.12 0.00 0.00 175.29 173.58 3a9t s PHE 437 N 1.76 3.46 0.04 0.91 0.40 0.01 -1.07 117.98 123.49 3a9t s PHE 437 Ca 0.00 0.95 0.06 0.00 -0.60 0.00 0.00 56.93 57.35 3a9t s PHE 437 Cb -0.13 -2.70 -0.03 0.00 0.51 0.00 0.00 43.02 40.67 3a9t s PHE 437 CO -0.03 -0.01 -0.13 1.03 0.70 0.00 0.00 175.22 176.78 3a9t s ARG 438 N 1.26 2.25 0.33 0.44 1.81 -0.61 0.14 118.95 124.58 3a9t s ARG 438 Ca 0.29 -0.89 -0.29 0.00 -1.72 0.00 0.00 55.73 53.12 3a9t s ARG 438 Cb -0.16 -2.32 -0.12 0.00 -0.45 0.00 0.00 34.95 31.91 3a9t s ARG 438 CO 0.12 0.56 1.50 -2.30 -0.68 0.00 0.00 175.30 174.50 3a9t n PRO 439 N 1.44 2.58 -1.81 3.54 -0.02 -1.26 -0.38 135.00 139.10 3a9t n PRO 439 Ca -0.15 0.91 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 3a9t n PRO 439 Cb 0.52 -2.64 0.06 0.00 -0.02 0.00 0.00 33.50 31.42 3a9t n PRO 439 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9t s ALA 440 N -0.64 2.45 -0.76 3.55 0.00 0.11 -4.71 121.76 121.76 3a9t s ALA 440 Ca 0.58 1.19 -0.26 0.00 0.00 0.00 0.00 51.96 53.47 3a9t s ALA 440 Cb -0.50 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.08 3a9t s ALA 440 CO 0.57 -1.48 1.64 -1.12 0.00 0.00 0.00 175.76 175.37 3a9t s SER 441 N -1.39 5.69 0.58 0.00 0.01 -1.26 -4.85 113.70 112.48 3a9t s SER 441 Ca 0.81 -0.33 0.29 0.00 1.31 0.00 0.00 55.95 58.03 3a9t s SER 441 Cb -0.36 -2.55 1.58 0.00 0.21 0.00 0.00 66.02 64.90 3a9t s SER 441 CO 0.39 -2.16 1.87 0.71 0.41 0.00 0.00 173.24 174.47 3a9t h THR 442 N 6.68 0.00 0.00 1.44 1.35 -1.78 0.18 112.91 120.78 3a9t h THR 442 Ca -0.14 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.66 3a9t h THR 442 Cb 1.08 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 3a9t h THR 442 CO 1.27 0.00 -0.30 1.05 -0.25 0.00 0.00 175.52 177.28 3a9t h GLU 443 N 0.00 0.00 0.01 4.72 4.11 -1.88 -2.76 114.58 118.78 3a9t h GLU 443 Ca 0.00 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 59.03 3a9t h GLU 443 Cb 0.48 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.67 3a9t h GLU 443 CO 0.00 0.30 -2.43 0.66 0.07 0.00 0.00 179.01 177.61 3a9t n TYR 444 N -3.97 0.12 -3.89 2.06 4.01 0.43 -4.78 117.16 111.16 3a9t n TYR 444 Ca -0.02 0.03 -0.29 0.00 -0.16 0.00 0.00 57.90 57.46 3a9t n TYR 444 Cb 0.37 -1.02 -0.12 0.00 -0.31 0.00 0.00 39.34 38.27 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 -2.52 3.54 0.51 -0.72 0.08 -0.01 -4.87 117.98 113.99 3a9t s PHE 445 Ca -0.35 -3.28 0.23 0.00 0.12 0.00 0.00 56.93 53.65 3a9t s PHE 445 Cb 0.10 -2.78 1.32 0.00 -0.57 0.00 0.00 43.02 41.09 3a9t s PHE 445 CO 0.60 -0.60 1.97 0.00 -0.10 0.00 0.00 175.22 177.09 3a9t h ARG 446 N 5.65 0.09 0.00 0.44 3.08 -1.50 -1.61 114.38 120.53 3a9t h ARG 446 Ca 0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3a9t h ARG 446 Cb 0.78 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.81 3a9t h ARG 446 CO 0.72 0.06 0.00 0.41 -1.07 0.00 0.00 179.97 180.10 3a9t n GLY 447 N -1.62 -1.36 0.59 0.04 0.00 0.11 -4.85 105.19 98.10 3a9t n GLY 447 Ca 0.11 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.46 -1.76 0.00 -0.02 0.00 -0.61 -3.07 105.19 100.20 3a9t n GLY 448 Ca 0.04 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.07 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 0.97 2.81 -0.02 0.00 -1.26 -0.29 105.19 107.40 3a9t n GLY 449 Ca 0.00 -2.13 -0.24 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.01 0.95 0.34 1.61 2.02 -1.26 0.04 117.35 120.04 3a9t s TYR 450 Ca 0.00 -0.40 -0.10 0.00 -0.37 0.00 0.00 57.07 56.21 3a9t s TYR 450 Cb 0.00 -0.95 -0.07 0.00 -0.40 0.00 0.00 41.96 40.54 3a9t s TYR 450 CO 0.00 -0.41 0.68 -1.54 -1.57 0.00 0.00 175.55 172.72 3a9t s SER 451 N 1.88 6.56 -0.32 2.29 1.04 0.49 -3.43 113.70 122.19 3a9t s SER 451 Ca 0.05 1.03 -0.22 0.00 0.48 0.00 0.00 55.95 57.28 3a9t s SER 451 Cb -0.13 -2.27 -0.00 0.00 0.10 0.00 0.00 66.02 63.72 3a9t s SER 451 CO -0.06 -0.28 0.71 -0.89 0.98 0.00 0.00 173.24 173.70 3a9t s THR 452 N -2.17 4.84 -0.31 2.02 2.01 0.68 -1.57 115.64 121.14 3a9t s THR 452 Ca 0.49 0.93 -0.03 0.00 0.31 0.00 0.00 61.69 63.39 3a9t s THR 452 Cb -0.10 -4.10 0.04 0.00 0.01 0.00 0.00 72.50 68.35 3a9t s THR 452 CO 0.27 -0.26 0.03 -0.62 -0.69 0.00 0.00 174.62 173.35 3a9t s ASP 453 N 1.70 4.98 0.20 3.53 2.15 -0.23 -1.15 116.67 127.85 3a9t s ASP 453 Ca 0.29 -1.15 -0.14 0.00 0.43 0.00 0.00 52.55 51.97 3a9t s ASP 453 Cb -0.14 -1.77 0.01 0.00 -0.30 0.00 0.00 42.92 40.72 3a9t s ASP 453 CO 0.13 -0.26 0.46 0.72 -0.17 0.00 0.00 175.17 176.05 3a9t s PHE 454 N 1.32 0.13 -0.21 -5.34 -0.12 -1.26 -1.46 117.98 111.04 3a9t s PHE 454 Ca -0.03 -0.48 0.01 0.00 -0.05 0.00 0.00 56.93 56.38 3a9t s PHE 454 Cb -0.19 0.24 0.04 0.00 -0.63 0.00 0.00 43.02 42.49 3a9t s PHE 454 CO 0.00 -0.90 -0.10 -1.17 -0.05 0.00 0.00 175.22 173.00 3a9t s LEU 455 N -2.93 2.40 0.25 -1.99 2.96 -1.26 -0.78 118.68 117.34 3a9t s LEU 455 Ca 0.14 -0.95 -0.31 0.00 -0.22 0.00 0.00 54.13 52.80 3a9t s LEU 455 Cb -0.00 -1.27 -0.11 0.00 0.50 0.00 0.00 46.19 45.31 3a9t s LEU 455 CO 0.01 -0.15 1.64 -0.89 -1.32 0.00 0.00 176.35 175.64 3a9t s THR 456 N 1.37 2.08 0.35 3.68 2.01 -0.37 -4.86 115.64 119.89 3a9t s THR 456 Ca -0.02 0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.76 3a9t s THR 456 Cb -0.17 -3.04 -0.10 0.00 0.01 0.00 0.00 72.50 69.20 3a9t s THR 456 CO -0.08 0.01 1.35 -0.54 -0.69 0.00 0.00 174.62 174.67 3a9t s LYS 457 N 0.20 4.27 0.85 4.92 1.02 -0.77 -4.81 119.74 125.42 3a9t s LYS 457 Ca 0.68 2.30 -0.12 0.00 0.02 0.00 0.00 55.97 58.86 3a9t s LYS 457 Cb -0.48 -3.02 0.14 0.00 -0.52 0.00 0.00 37.83 33.94 3a9t s LYS 457 CO 0.41 -0.30 1.20 0.20 -0.92 0.00 0.00 175.35 175.94 3a9t s GLY 458 N -0.42 1.71 0.00 -3.33 0.00 -1.26 -4.35 107.32 99.68 3a9t s GLY 458 Ca 0.50 -1.07 0.00 0.00 0.00 0.00 0.00 44.72 44.15 3a9t s GLY 458 CO 0.55 -0.46 0.00 0.61 0.00 0.00 0.00 173.10 173.80 3a9t n GLY 459 N -3.41 0.85 3.72 0.20 0.00 0.32 -4.85 105.19 102.02 3a9t n GLY 459 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.03 4.31 0.15 1.61 0.00 -1.24 -4.82 119.30 119.28 3a9t s MET 460 Ca 0.00 0.38 -0.30 0.00 0.00 0.00 0.00 55.69 55.77 3a9t s MET 460 Cb 0.00 -3.45 -0.08 0.00 0.00 0.00 0.00 34.83 31.31 3a9t s MET 460 CO 0.00 0.15 1.26 -1.25 0.00 0.00 0.00 175.02 175.18 3a9t s PRO 461 N 0.68 4.42 0.21 4.11 0.04 -1.26 -0.74 135.00 142.46 3a9t s PRO 461 Ca 0.24 1.94 -0.00 0.00 0.04 0.00 0.00 61.00 63.22 3a9t s PRO 461 Cb -0.15 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.10 3a9t s PRO 461 CO 0.09 -0.23 0.13 0.14 0.04 0.00 0.00 177.00 177.17 3a9t s VAL 462 N 0.42 0.08 -0.04 -0.36 -7.23 0.16 -0.20 120.40 113.23 3a9t s VAL 462 Ca 0.57 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.73 3a9t s VAL 462 Cb -0.34 -2.52 0.03 0.00 0.56 0.00 0.00 36.38 34.11 3a9t s VAL 462 CO 0.34 0.00 0.05 -0.89 -0.31 0.00 0.00 175.10 174.30 3a9t s THR 463 N -4.09 -0.10 0.05 5.32 2.01 -0.27 -0.28 115.64 118.29 3a9t s THR 463 Ca 0.39 0.39 0.02 0.00 0.31 0.00 0.00 61.69 62.80 3a9t s THR 463 Cb 0.07 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.40 3a9t s THR 463 CO 0.13 0.17 0.06 0.27 -0.69 0.00 0.00 174.62 174.56 3a9t s ILE 464 N 1.99 4.49 0.22 1.82 -4.36 -0.47 -1.13 121.20 123.76 3a9t s ILE 464 Ca 0.03 -0.67 -0.14 0.00 -0.26 0.00 0.00 60.65 59.60 3a9t s ILE 464 Cb -0.12 -3.12 0.01 0.00 1.25 0.00 0.00 42.46 40.48 3a9t s ILE 464 CO -0.03 0.21 0.48 -0.94 0.24 0.00 0.00 174.94 174.90 3a9t s SER 465 N -2.12 -0.14 -0.28 4.36 1.04 -0.70 -0.51 113.70 115.35 3a9t s SER 465 Ca 0.26 -0.74 -0.16 0.00 0.48 0.00 0.00 55.95 55.80 3a9t s SER 465 Cb -0.12 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.66 3a9t s SER 465 CO 0.18 -1.08 0.77 -0.60 0.98 0.00 0.00 173.24 173.49 3a9t s ARG 466 N -3.95 0.61 -0.13 4.02 6.06 -0.52 -1.26 118.95 123.79 3a9t s ARG 466 Ca 0.16 1.07 -0.12 0.00 -2.50 0.00 0.00 55.73 54.34 3a9t s ARG 466 Cb -0.00 0.13 -0.05 0.00 0.06 0.00 0.00 34.95 35.09 3a9t s ARG 466 CO 0.03 -0.13 0.27 -1.17 -2.50 0.00 0.00 175.30 171.80 3a9t s LEU 467 N 1.58 4.31 0.14 -0.88 2.96 -1.26 -1.67 118.68 123.86 3a9t s LEU 467 Ca -0.10 0.56 0.05 0.00 -0.22 0.00 0.00 54.13 54.42 3a9t s LEU 467 Cb -0.05 -2.33 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 3a9t s LEU 467 CO -0.19 0.20 -0.11 0.20 -1.32 0.00 0.00 176.35 175.14 3a9t s ASN 468 N -0.10 1.79 -0.20 3.68 0.01 0.44 -4.72 114.94 115.84 3a9t s ASN 468 Ca 0.17 -0.95 0.01 0.00 -0.71 0.00 0.00 52.86 51.38 3a9t s ASN 468 Cb -0.13 -0.02 0.03 0.00 0.41 0.00 0.00 41.25 41.54 3a9t s ASN 468 CO 0.05 -0.29 -0.17 -0.63 -1.51 0.00 0.00 177.10 174.55 3a9t s ILE 469 N -3.01 2.03 -0.16 0.60 1.01 -1.26 0.30 121.20 120.71 3a9t s ILE 469 Ca 0.14 -1.11 -0.02 0.00 0.00 0.00 0.00 60.65 59.67 3a9t s ILE 469 Cb 0.01 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 3a9t s ILE 469 CO 0.01 0.36 -0.09 -0.69 0.00 0.00 0.00 174.94 174.53 3a9t s VAL 470 N 1.26 3.30 0.23 2.92 1.01 0.56 -4.94 120.40 124.73 3a9t s VAL 470 Ca 0.01 -0.56 -0.31 0.00 0.00 0.00 0.00 61.98 61.12 3a9t s VAL 470 Cb -0.15 -2.43 -0.14 0.00 0.00 0.00 0.00 36.38 33.67 3a9t s VAL 470 CO -0.11 0.49 1.32 1.17 0.00 0.00 0.00 175.10 177.98 3a9t n LYS 471 N 3.84 1.80 -0.74 2.72 3.00 -1.26 -0.01 118.16 127.51 3a9t n LYS 471 Ca -0.18 0.64 0.00 0.00 -0.00 0.00 0.00 58.31 58.77 3a9t n LYS 471 Cb 0.52 -2.24 0.00 0.00 0.00 0.00 0.00 35.03 33.31 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 2.01 1.27 0.32 3.14 0.00 -1.26 -4.72 105.19 105.96 3a9t n GLY 472 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.69 0.00 0.99 7.94 -0.05 -5.16 117.00 121.42 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 0.05 0.00 0.61 -1.11 0.00 0.00 177.39 176.94 3a9t n GLY 474 N 2.04 0.09 3.76 -3.96 0.00 0.99 -4.94 105.19 103.16 3a9t n GLY 474 Ca 0.00 -1.81 -0.40 0.00 0.00 0.00 0.00 46.02 43.81 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 4.72 -0.07 1.61 0.04 -1.26 -0.32 135.00 139.72 3a9t s PRO 475 Ca 0.00 1.60 -0.07 0.00 0.04 0.00 0.00 61.00 62.57 3a9t s PRO 475 Cb 0.00 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.39 3a9t s PRO 475 CO 0.00 0.35 0.20 0.54 0.04 0.00 0.00 177.00 178.13 3a9t s VAL 476 N -1.23 0.01 -0.08 -0.36 0.11 0.15 -4.27 120.40 114.73 3a9t s VAL 476 Ca 0.44 -0.08 0.02 0.00 -2.93 0.00 0.00 61.98 59.43 3a9t s VAL 476 Cb -0.28 -0.31 -0.02 0.00 -1.53 0.00 0.00 36.38 34.25 3a9t s VAL 476 CO 0.35 -0.04 -0.12 -0.22 -3.33 0.00 0.00 175.10 171.73 3a9t s LEU 477 N -0.07 2.84 -0.03 2.54 2.96 -0.71 -0.42 118.68 125.78 3a9t s LEU 477 Ca -0.02 -0.19 0.07 0.00 -0.22 0.00 0.00 54.13 53.77 3a9t s LEU 477 Cb -0.02 -1.61 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 3a9t s LEU 477 CO 0.00 0.30 -0.26 0.00 -1.32 0.00 0.00 176.35 175.08 3a9t s GLN 478 N -0.42 2.28 0.05 1.98 -2.07 -0.67 -1.86 119.66 118.95 3a9t s GLN 478 Ca 0.05 -0.92 0.06 0.00 -1.82 0.00 0.00 55.36 52.73 3a9t s GLN 478 Cb -0.12 -2.08 -0.03 0.00 -1.09 0.00 0.00 33.01 29.69 3a9t s GLN 478 CO 0.02 0.49 -0.16 0.42 -1.32 0.00 0.00 175.29 174.74 3a9t s ILE 479 N -0.43 1.29 -0.28 3.63 1.01 0.25 -1.44 121.20 125.23 3a9t s ILE 479 Ca 0.05 -1.16 -0.01 0.00 0.00 0.00 0.00 60.65 59.53 3a9t s ILE 479 Cb -0.11 -1.17 0.13 0.00 0.01 0.00 0.00 42.46 41.32 3a9t s ILE 479 CO 0.01 -0.01 0.31 0.00 0.00 0.00 0.00 174.94 175.25 3a9t s ALA 480 N -0.95 -0.57 0.35 9.38 0.00 0.33 -3.58 121.76 126.72 3a9t s ALA 480 Ca 0.03 -0.10 -0.23 0.00 0.00 0.00 0.00 51.96 51.65 3a9t s ALA 480 Cb -0.09 -1.77 -0.10 0.00 0.00 0.00 0.00 23.12 21.17 3a9t s ALA 480 CO 0.02 -1.63 0.92 -1.21 0.00 0.00 0.00 175.76 173.86 3a9t s GLU 481 N 2.39 4.42 0.00 0.00 2.02 -1.26 -1.37 118.70 124.90 3a9t s GLU 481 Ca 0.09 1.20 0.00 0.00 0.02 0.00 0.00 54.97 56.28 3a9t s GLU 481 Cb -0.14 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.49 3a9t s GLU 481 CO -0.29 0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.59 3a9t n GLY 482 N 0.17 1.06 3.21 -1.39 0.00 0.62 -0.39 105.19 108.47 3a9t n GLY 482 Ca 0.03 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.76 1.08 0.18 1.61 1.51 0.07 0.35 117.35 120.39 3a9t s TYR 483 Ca 0.00 -0.96 -0.09 0.00 -1.01 0.00 0.00 57.07 55.02 3a9t s TYR 483 Cb 0.00 -0.61 -0.07 0.00 -0.11 0.00 0.00 41.96 41.18 3a9t s TYR 483 CO 0.00 -0.16 0.49 0.95 -1.11 0.00 0.00 175.55 175.71 3a9t s THR 484 N -3.62 5.01 0.17 -0.71 -4.23 0.08 -1.12 115.64 111.22 3a9t s THR 484 Ca 0.18 0.37 0.08 0.00 -1.18 0.00 0.00 61.69 61.14 3a9t s THR 484 Cb 0.05 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 3a9t s THR 484 CO -0.00 0.02 -0.16 0.68 -0.54 0.00 0.00 174.62 174.62 3a9t s VAL 485 N -1.71 1.68 -0.15 2.29 -7.23 0.06 0.12 120.40 115.46 3a9t s VAL 485 Ca 0.43 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 3a9t s VAL 485 Cb -0.12 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 3a9t s VAL 485 CO 0.22 -0.45 0.01 -1.81 -0.31 0.00 0.00 175.10 172.75 3a9t s ASP 486 N -2.89 5.18 0.28 4.85 1.01 -1.26 -4.28 116.67 119.56 3a9t s ASP 486 Ca 0.17 -0.00 0.08 0.00 0.71 0.00 0.00 52.55 53.51 3a9t s ASP 486 Cb -0.03 -1.80 -0.04 0.00 1.01 0.00 0.00 42.92 42.06 3a9t s ASP 486 CO 0.06 0.21 0.13 -0.76 0.21 0.00 0.00 175.17 175.02 3a9t s LEU 487 N 0.14 3.49 0.59 1.23 1.43 -1.26 -5.04 118.68 119.26 3a9t s LEU 487 Ca 0.01 -0.50 -0.19 0.00 -1.03 0.00 0.00 54.13 52.43 3a9t s LEU 487 Cb -0.13 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 3a9t s LEU 487 CO 0.02 -0.11 1.23 -2.84 0.23 0.00 0.00 176.35 174.88 3a9t s PRO 488 N -3.81 2.95 0.25 1.29 0.02 -1.26 -4.76 135.00 129.69 3a9t s PRO 488 Ca 0.34 1.90 -0.04 0.00 0.02 0.00 0.00 61.00 63.21 3a9t s PRO 488 Cb -0.06 -1.96 0.50 0.00 0.02 0.00 0.00 34.50 33.00 3a9t s PRO 488 CO 0.23 -1.24 1.66 1.49 -0.33 0.00 0.00 177.00 178.81 3a9t h GLU 489 N 0.93 0.18 -0.28 5.54 4.81 -2.00 -1.47 114.58 122.30 3a9t h GLU 489 Ca -0.51 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.64 3a9t h GLU 489 Cb 1.30 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 3a9t h GLU 489 CO 0.55 0.12 -0.16 0.93 -0.73 0.00 0.00 179.01 179.72 3a9t h GLU 490 N 0.18 0.48 -0.13 1.92 3.07 -2.00 -1.95 114.58 116.16 3a9t h GLU 490 Ca 0.44 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 59.10 3a9t h GLU 490 Cb 0.80 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.66 3a9t h GLU 490 CO -0.60 0.64 -0.12 0.28 -1.40 0.00 0.00 179.01 177.80 3a9t h VAL 491 N 0.44 1.34 -0.01 3.13 2.07 -1.65 -2.61 116.25 118.97 3a9t h VAL 491 Ca 0.08 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.37 3a9t h VAL 491 Cb 0.54 1.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 3a9t h VAL 491 CO 0.04 0.37 -0.21 -0.74 0.02 0.00 0.00 177.57 177.04 3a9t h HIS 492 N -0.06 -0.55 -0.90 1.57 -0.00 -1.26 -1.58 115.15 112.37 3a9t h HIS 492 Ca 0.02 0.02 0.17 0.00 -0.00 0.00 0.00 60.37 60.59 3a9t h HIS 492 Cb 0.63 0.25 -0.10 0.00 -0.00 0.00 0.00 27.41 28.19 3a9t h HIS 492 CO 0.08 -0.30 0.48 -0.44 -0.00 0.00 0.00 177.93 177.76 3a9t h ASP 493 N -0.33 0.56 -0.22 3.26 3.32 -1.32 0.59 116.42 122.27 3a9t h ASP 493 Ca 0.06 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 3a9t h ASP 493 Cb 0.41 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 3a9t h ASP 493 CO -0.20 0.19 -0.14 0.58 -1.72 0.00 0.00 179.24 177.95 3a9t h VAL 494 N 0.62 1.31 -0.41 -1.35 2.07 -0.99 0.11 116.25 117.61 3a9t h VAL 494 Ca 0.52 -1.24 -0.15 0.00 0.82 0.00 0.00 66.70 66.65 3a9t h VAL 494 Cb 0.81 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 3a9t h VAL 494 CO -0.40 0.38 -0.32 -0.07 0.02 0.00 0.00 177.57 177.18 3a9t h LEU 495 N 0.19 0.96 -0.09 2.57 3.38 -0.49 -3.20 115.31 118.63 3a9t h LEU 495 Ca 0.05 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 3a9t h LEU 495 Cb 0.65 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3a9t h LEU 495 CO 0.04 1.20 0.00 -0.78 0.09 0.00 0.00 178.44 178.99 3a9t h ASP 496 N 0.77 0.15 -0.06 -0.43 3.58 0.19 -3.18 116.42 117.44 3a9t h ASP 496 Ca 0.08 -0.30 0.02 0.00 0.42 0.00 0.00 57.03 57.25 3a9t h ASP 496 Cb 0.90 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.91 3a9t h ASP 496 CO 0.08 0.41 0.04 0.11 -2.88 0.00 0.00 179.24 177.00 3a9t h LYS 497 N -0.12 0.00 -0.22 0.28 1.79 -1.02 -1.68 116.57 115.60 3a9t h LYS 497 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3a9t h LYS 497 Cb 0.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 3a9t h LYS 497 CO 0.00 0.00 0.00 2.89 -1.08 0.00 0.00 179.45 181.26 3a9t n ARG 498 N -4.40 1.79 0.00 3.15 1.85 -1.20 -4.65 116.66 113.20 3a9t n ARG 498 Ca -0.02 -1.20 0.00 0.00 -1.00 0.00 0.00 57.85 55.63 3a9t n ARG 498 Cb 0.14 -1.38 0.00 0.00 -1.05 0.00 0.00 32.46 30.18 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 0.43 0.00 -2.90 8.89 -1.04 -0.64 -5.06 114.28 113.96 3a9t n THR 499 Ca 0.16 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.07 3a9t n THR 499 Cb 0.34 -0.08 -0.01 0.00 -1.82 0.00 0.00 70.33 68.76 3a9t n THR 499 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3a9t n ASP 500 N 0.00 -2.68 0.00 8.00 8.00 -1.16 -5.03 116.55 123.68 3a9t n ASP 500 Ca 0.00 -2.85 0.00 0.00 0.71 0.00 0.00 54.79 52.65 3a9t n ASP 500 Cb 0.00 1.22 0.00 0.00 -0.02 0.00 0.00 41.12 42.32 3a9t n ASP 500 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3a9t n PRO 501 N 2.72 0.00 -0.11 -0.24 -0.04 -1.18 -1.79 135.00 134.35 3a9t n PRO 501 Ca 0.19 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 3a9t n PRO 501 Cb 0.55 -1.57 0.17 0.00 -0.04 0.00 0.00 33.50 32.61 3a9t n PRO 501 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3a9t n THR 502 N -1.36 0.30 -4.09 0.52 -2.24 -1.26 -4.94 114.28 101.22 3a9t n THR 502 Ca 0.00 -0.65 -0.22 0.00 -2.27 0.00 0.00 64.05 60.91 3a9t n THR 502 Cb 0.07 1.20 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 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 -1.69 2.97 0.23 4.78 0.51 -0.74 -3.99 118.94 121.02 3a9t s TRP 503 Ca 0.34 -0.19 -0.30 0.00 -2.12 0.00 0.00 56.10 53.84 3a9t s TRP 503 Cb 0.22 -1.46 -0.09 0.00 -0.81 0.00 0.00 33.47 31.32 3a9t s TRP 503 CO 0.31 0.46 1.30 -1.25 -0.51 0.00 0.00 176.95 177.26 3a9t s PRO 504 N -3.84 4.39 -0.03 4.98 0.04 -0.30 -4.33 135.00 135.91 3a9t s PRO 504 Ca 0.35 2.09 0.07 0.00 0.04 0.00 0.00 61.00 63.54 3a9t s PRO 504 Cb -0.07 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 3a9t s PRO 504 CO 0.24 -0.22 -0.25 0.99 0.04 0.00 0.00 177.00 177.81 3a9t s THR 505 N -0.22 2.16 -0.04 1.26 2.01 0.04 -4.05 115.64 116.80 3a9t s THR 505 Ca 0.55 -1.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.48 3a9t s THR 505 Cb -0.37 -1.76 0.03 0.00 0.01 0.00 0.00 72.50 70.40 3a9t s THR 505 CO 0.42 0.58 0.04 -0.89 -0.69 0.00 0.00 174.62 174.07 3a9t s THR 506 N -0.50 0.03 -0.33 -0.82 2.01 -0.46 -1.24 115.64 114.32 3a9t s THR 506 Ca 0.07 0.29 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 3a9t s THR 506 Cb -0.11 -0.23 -0.01 0.00 0.01 0.00 0.00 72.50 72.16 3a9t s THR 506 CO 0.00 0.18 0.41 0.26 -0.69 0.00 0.00 174.62 174.78 3a9t s TRP 507 N 1.80 3.21 -0.08 4.92 0.52 -1.26 -1.24 118.94 126.80 3a9t s TRP 507 Ca 0.01 0.12 0.02 0.00 0.02 0.00 0.00 56.10 56.27 3a9t s TRP 507 Cb -0.12 -2.73 -0.02 0.00 -1.15 0.00 0.00 33.47 29.45 3a9t s TRP 507 CO -0.03 -0.43 -0.15 0.12 0.02 0.00 0.00 176.95 176.48 3a9t s PHE 508 N 2.14 2.73 -0.14 -1.98 5.36 -0.20 -0.76 117.98 125.13 3a9t s PHE 508 Ca 0.14 -0.41 0.01 0.00 -0.96 0.00 0.00 56.93 55.71 3a9t s PHE 508 Cb -0.16 -1.72 0.02 0.00 -0.34 0.00 0.00 43.02 40.82 3a9t s PHE 508 CO 0.12 -0.02 -0.14 0.08 -1.46 0.00 0.00 175.22 173.80 3a9t s VAL 509 N -0.22 1.55 0.26 3.12 1.01 -0.27 -0.66 120.40 125.18 3a9t s VAL 509 Ca 0.01 -0.63 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 3a9t s VAL 509 Cb -0.13 -1.44 -0.08 0.00 0.00 0.00 0.00 36.38 34.72 3a9t s VAL 509 CO 0.03 0.45 0.67 -2.16 0.00 0.00 0.00 175.10 174.10 3a9t s PRO 510 N 1.35 4.02 0.12 2.72 0.04 -1.26 -0.75 135.00 141.25 3a9t s PRO 510 Ca 0.02 0.62 -0.31 0.00 0.04 0.00 0.00 61.00 61.37 3a9t s PRO 510 Cb -0.13 -2.65 -0.08 0.00 0.04 0.00 0.00 34.50 31.68 3a9t s PRO 510 CO -0.08 0.29 1.39 -0.80 0.04 0.00 0.00 177.00 177.84 3a9t s ASN 511 N -2.06 6.82 0.31 6.66 0.01 0.47 -4.93 114.94 122.23 3a9t s ASN 511 Ca 0.48 2.34 -0.01 0.00 -0.71 0.00 0.00 52.86 54.96 3a9t s ASN 511 Cb -0.13 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 38.91 3a9t s ASN 511 CO 0.19 -0.65 0.53 -0.76 -1.51 0.00 0.00 177.10 174.90 3a9t s LEU 512 N 1.03 4.05 0.00 0.60 1.43 -1.26 -4.89 118.68 119.63 3a9t s LEU 512 Ca 0.64 0.53 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 3a9t s LEU 512 Cb -0.37 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.49 3a9t s LEU 512 CO 0.31 -0.24 0.07 0.35 0.23 0.00 0.00 176.35 177.07 3a9t n THR 513 N -1.39 0.00 -1.72 5.49 -2.24 -0.65 -5.01 114.28 108.76 3a9t n THR 513 Ca -0.04 -0.23 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 3a9t n THR 513 Cb 0.55 1.17 -0.04 0.00 -2.10 0.00 0.00 70.33 69.91 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 0.32 0.76 3.46 3.38 0.00 -0.98 -4.94 105.19 107.19 3a9t n GLY 514 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 3a9t n GLY 514 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3a9t s GLU 515 N -3.70 1.33 5.59 1.61 -1.05 -1.26 -4.75 118.70 116.46 3a9t s GLU 515 Ca 0.00 -1.11 0.00 0.00 -0.15 0.00 0.00 54.97 53.71 3a9t s GLU 515 Cb 0.00 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.13 3a9t s GLU 515 CO 0.00 -0.53 0.00 0.41 0.95 0.00 0.00 175.26 176.09 3a9t n GLY 516 N -0.30 3.33 1.52 -3.83 0.00 -1.26 -0.92 105.19 103.73 3a9t n GLY 516 Ca -0.06 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.02 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 10.62 2.85 -1.22 4.61 0.00 -1.26 -4.18 120.51 131.94 3a9t n ALA 517 Ca 0.00 -1.47 0.06 0.00 0.00 0.00 0.00 53.44 52.02 3a9t n ALA 517 Cb 0.00 -1.00 0.20 0.00 0.00 0.00 0.00 19.45 18.65 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 1.32 0.55 -0.16 0.00 3.72 -0.10 -2.62 117.46 120.16 3a9t n PHE 518 Ca 0.25 -1.18 -0.05 0.00 -0.05 0.00 0.00 57.45 56.43 3a9t n PHE 518 Cb 0.80 -0.30 0.14 0.00 -0.94 0.00 0.00 39.48 39.18 3a9t n PHE 518 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3a9t h LYS 519 N 0.93 0.91 -3.49 -1.08 3.64 -1.70 -1.63 116.57 114.15 3a9t h LYS 519 Ca 0.05 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.18 3a9t h LYS 519 Cb 1.29 -0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 32.89 3a9t h LYS 519 CO 0.16 0.84 -0.06 0.16 -2.27 0.00 0.00 179.45 178.28 3a9t s ASP 520 N -6.56 -0.15 0.20 4.20 1.47 -1.26 -4.40 116.67 110.17 3a9t s ASP 520 Ca -0.10 -0.72 -0.10 0.00 1.18 0.00 0.00 52.55 52.80 3a9t s ASP 520 Cb 0.15 0.57 0.21 0.00 -0.34 0.00 0.00 42.92 43.52 3a9t s ASP 520 CO 0.82 -1.09 1.79 0.58 0.68 0.00 0.00 175.17 177.95 3a9t h VAL 521 N 2.25 0.93 -0.72 2.11 2.07 -1.89 -2.58 116.25 118.42 3a9t h VAL 521 Ca -0.27 -0.20 0.10 0.00 0.82 0.00 0.00 66.70 67.15 3a9t h VAL 521 Cb 1.25 0.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.25 3a9t h VAL 521 CO 0.37 0.10 0.34 0.22 0.02 0.00 0.00 177.57 178.63 3a9t h TYR 522 N 0.57 0.61 -0.14 1.57 3.20 -1.95 -2.17 116.97 118.67 3a9t h TYR 522 Ca 0.28 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.13 3a9t h TYR 522 Cb 0.21 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 3a9t h TYR 522 CO -0.10 0.20 -0.14 0.77 -1.64 0.00 0.00 178.16 177.24 3a9t h SER 523 N 0.57 0.20 -0.50 -2.11 0.02 -1.71 0.23 113.55 110.25 3a9t h SER 523 Ca 0.36 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.25 3a9t h SER 523 Cb 0.42 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 3a9t h SER 523 CO -0.29 0.37 0.22 0.58 -1.14 0.00 0.00 176.83 176.56 3a9t h VAL 524 N 0.20 1.20 0.04 2.27 2.07 -1.14 -1.14 116.25 119.75 3a9t h VAL 524 Ca 0.04 -0.59 -0.25 0.00 0.82 0.00 0.00 66.70 66.71 3a9t h VAL 524 Cb 0.38 0.67 0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3a9t h VAL 524 CO 0.02 0.23 -1.02 -0.03 0.02 0.00 0.00 177.57 176.79 3a9t h MET 525 N 0.66 0.62 -0.12 1.57 1.85 -1.39 -2.94 114.93 115.18 3a9t h MET 525 Ca 0.17 -0.72 0.04 0.00 -0.61 0.00 0.00 59.70 58.57 3a9t h MET 525 Cb 0.15 0.22 -0.00 0.00 0.43 0.00 0.00 31.60 32.39 3a9t h MET 525 CO -0.02 1.30 0.10 -0.97 -0.40 0.00 0.00 176.91 176.93 3a9t h ASN 526 N 0.25 0.00 0.24 1.39 -1.24 -0.42 -0.93 115.58 114.87 3a9t h ASN 526 Ca -0.14 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.87 3a9t h ASN 526 Cb 1.69 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.74 3a9t h ASN 526 CO 0.20 0.00 -0.46 0.59 -1.29 0.00 0.00 177.43 176.47 3a9t n ASN 527 N -4.21 1.03 -4.72 1.15 3.02 -0.44 -4.91 115.26 106.18 3a9t n ASN 527 Ca 0.00 -0.82 -0.42 0.00 -0.03 0.00 0.00 54.58 53.31 3a9t n ASN 527 Cb 0.22 0.33 -0.03 0.00 -0.61 0.00 0.00 39.78 39.70 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 -2.71 2.83 -2.06 3.10 -0.11 -0.35 -4.87 118.94 114.76 3a9t s TRP 528 Ca 0.17 0.35 0.14 0.00 1.22 0.00 0.00 56.10 57.98 3a9t s TRP 528 Cb 0.18 -4.10 0.69 0.00 -1.50 0.00 0.00 33.47 28.74 3a9t s TRP 528 CO 0.63 -4.21 1.46 0.41 -4.62 0.00 0.00 176.95 170.62 3a9t n GLY 529 N 3.97 -0.52 3.71 5.86 0.00 -1.26 -4.90 105.19 112.04 3a9t n GLY 529 Ca 0.16 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.90 -1.23 0.08 4.61 0.00 -1.26 -5.03 121.76 117.03 3a9t s ALA 530 Ca 0.22 -0.14 0.22 0.00 0.00 0.00 0.00 51.96 52.26 3a9t s ALA 530 Cb 0.11 0.87 0.75 0.00 0.00 0.00 0.00 23.12 24.85 3a9t s ALA 530 CO 0.17 -0.94 1.75 -2.95 0.00 0.00 0.00 175.76 173.79 3a9t h ASN 531 N 2.03 0.00 -1.94 0.00 -0.00 -1.93 -3.46 115.58 110.28 3a9t h ASN 531 Ca -0.24 0.00 -0.49 0.00 -0.00 0.00 0.00 56.30 55.57 3a9t h ASN 531 Cb 1.27 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.55 3a9t h ASN 531 CO 0.29 0.28 -0.46 -1.00 -0.00 0.00 0.00 177.43 176.54 3a9t s HIS 532 N -3.54 3.00 0.28 4.14 3.76 -1.26 -0.14 115.29 121.52 3a9t s HIS 532 Ca 0.01 -0.24 -0.17 0.00 -0.15 0.00 0.00 55.06 54.51 3a9t s HIS 532 Cb 0.10 -1.71 0.01 0.00 1.11 0.00 0.00 32.58 32.09 3a9t s HIS 532 CO 0.66 0.26 0.63 0.00 -0.85 0.00 0.00 174.74 175.44 3a9t s SER 534 N -2.97 2.78 -0.19 0.00 0.15 -0.39 -2.45 113.70 110.63 3a9t s SER 534 Ca 0.16 -0.49 -0.07 0.00 0.70 0.00 0.00 55.95 56.25 3a9t s SER 534 Cb -0.04 -1.14 -0.04 0.00 -1.71 0.00 0.00 66.02 63.09 3a9t s SER 534 CO 0.08 0.15 0.05 -0.63 1.20 0.00 0.00 173.24 174.10 3a9t s ILE 535 N 0.28 4.64 -0.01 6.45 1.01 0.09 -1.73 121.20 131.95 3a9t s ILE 535 Ca -0.14 -0.08 0.06 0.00 0.00 0.00 0.00 60.65 60.48 3a9t s ILE 535 Cb -0.16 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 3a9t s ILE 535 CO 0.07 0.45 -0.18 -0.55 0.00 0.00 0.00 174.94 174.72 3a9t s SER 536 N 0.53 2.14 0.65 3.58 0.15 -0.28 -0.65 113.70 119.81 3a9t s SER 536 Ca 0.03 -0.35 -0.17 0.00 0.70 0.00 0.00 55.95 56.16 3a9t s SER 536 Cb -0.13 -0.23 -0.00 0.00 -1.71 0.00 0.00 66.02 63.95 3a9t s SER 536 CO 0.01 0.21 1.18 -0.47 1.20 0.00 0.00 173.24 175.37 3a9t s TYR 537 N -0.48 2.35 0.00 3.44 6.14 -1.26 -1.11 117.35 126.43 3a9t s TYR 537 Ca 0.07 1.55 0.00 0.00 0.64 0.00 0.00 57.07 59.33 3a9t s TYR 537 Cb -0.07 -3.40 0.00 0.00 0.42 0.00 0.00 41.96 38.91 3a9t s TYR 537 CO -0.00 -2.18 0.00 0.41 0.64 0.00 0.00 175.55 174.41 3a9t n GLY 538 N 0.21 -1.23 3.09 8.97 0.00 0.72 -4.71 105.19 112.24 3a9t n GLY 538 Ca 0.13 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 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 -1.33 3.80 -1.07 1.61 3.76 -1.26 -2.62 115.29 118.17 3a9t s HIS 539 Ca 0.00 -3.01 0.14 0.00 -0.15 0.00 0.00 55.06 52.05 3a9t s HIS 539 Cb 0.00 -3.19 0.61 0.00 1.11 0.00 0.00 32.58 31.10 3a9t s HIS 539 CO 0.00 -0.74 1.48 0.44 -0.85 0.00 0.00 174.74 175.07 3a9t n ILE 540 N 2.48 1.62 -0.13 0.60 -5.35 -1.26 -4.57 119.36 112.75 3a9t n ILE 540 Ca 0.19 -0.99 -0.05 0.00 -0.27 0.00 0.00 62.75 61.63 3a9t n ILE 540 Cb 0.37 -0.02 0.03 0.00 -1.74 0.00 0.00 39.64 38.28 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 4.42 0.53 1.05 3.28 0.00 -1.97 0.14 103.07 110.53 3a9t h GLY 541 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.24 3a9t h GLY 541 CO 0.23 0.03 0.60 0.00 0.00 0.00 0.00 176.54 177.40 3a9t h ALA 542 N 1.26 1.27 -0.31 3.60 0.00 -1.91 -0.64 119.26 122.53 3a9t h ALA 542 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3a9t h ALA 542 Cb 0.17 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3a9t h ALA 542 CO -0.19 0.65 0.14 -0.44 0.00 0.00 0.00 179.25 179.40 3a9t h ASP 543 N 1.29 0.41 -0.79 0.00 3.32 -1.66 -2.41 116.42 116.59 3a9t h ASP 543 Ca 0.34 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 3a9t h ASP 543 Cb -0.10 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 3a9t h ASP 543 CO -0.07 0.44 0.49 -0.07 -1.72 0.00 0.00 179.24 178.31 3a9t h LEU 544 N 0.36 0.95 -0.44 1.55 3.38 -0.07 -1.61 115.31 119.43 3a9t h LEU 544 Ca 0.10 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3a9t h LEU 544 Cb 0.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3a9t h LEU 544 CO -0.01 0.72 0.20 0.40 0.09 0.00 0.00 178.44 179.84 3a9t h ILE 545 N 1.09 1.19 0.07 1.22 2.04 -0.91 -0.42 117.51 121.80 3a9t h ILE 545 Ca 0.29 -0.56 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 3a9t h ILE 545 Cb -0.06 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 3a9t h ILE 545 CO -0.06 0.21 -0.04 0.74 0.00 0.00 0.00 178.15 179.01 3a9t h THR 546 N 0.56 0.96 -0.37 -0.27 2.02 -1.02 -1.83 112.91 112.97 3a9t h THR 546 Ca 0.15 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.30 3a9t h THR 546 Cb 0.15 1.02 -0.06 0.00 -1.74 0.00 0.00 68.15 67.52 3a9t h THR 546 CO -0.02 0.02 0.02 0.25 0.37 0.00 0.00 175.52 176.16 3a9t h LEU 547 N -0.14 -0.11 -0.40 2.58 6.46 -1.12 -2.15 115.31 120.42 3a9t h LEU 547 Ca -0.01 0.08 0.04 0.00 -0.12 0.00 0.00 57.88 57.87 3a9t h LEU 547 Cb 0.12 0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.14 3a9t h LEU 547 CO 0.02 -0.02 0.17 0.00 -0.62 0.00 0.00 178.44 177.98 3a9t h ALA 548 N 1.31 0.49 -0.78 1.25 0.00 -0.89 -1.43 119.26 119.22 3a9t h ALA 548 Ca 0.18 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.18 3a9t h ALA 548 Cb 0.24 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3a9t h ALA 548 CO -0.28 -0.21 0.51 0.66 0.00 0.00 0.00 179.25 179.93 3a9t h SER 549 N 0.35 0.74 -0.45 0.00 4.64 -0.86 0.17 113.55 118.14 3a9t h SER 549 Ca 0.18 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.45 3a9t h SER 549 Cb 0.13 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 3a9t h SER 549 CO -0.16 0.48 0.08 0.40 -0.87 0.00 0.00 176.83 176.76 3a9t h ILE 550 N 0.84 1.24 0.00 0.95 2.04 -0.70 -2.40 117.51 119.48 3a9t h ILE 550 Ca 0.33 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 65.30 3a9t h ILE 550 Cb 0.24 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 3a9t h ILE 550 CO -0.12 0.31 0.00 0.18 0.00 0.00 0.00 178.15 178.53 3a9t n LEU 551 N -4.47 0.00 -0.89 1.44 4.77 -0.46 -4.89 117.00 112.49 3a9t n LEU 551 Ca 0.00 0.45 -0.08 0.00 -0.03 0.00 0.00 56.01 56.36 3a9t n LEU 551 Cb 0.24 -0.45 -0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3a9t n LEU 551 CO 0.40 -0.09 -0.10 0.54 -1.33 0.00 0.00 177.39 176.80 3a9t n ARG 552 N -1.45 -0.63 -3.67 3.23 3.00 0.46 -4.93 116.66 112.67 3a9t n ARG 552 Ca 0.07 0.38 -0.39 0.00 -0.01 0.00 0.00 57.85 57.90 3a9t n ARG 552 Cb 0.25 -4.32 -0.12 0.00 0.00 0.00 0.00 32.46 28.28 3a9t n ARG 552 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 3a9t s ILE 553 N -2.39 4.23 0.76 0.55 1.01 -0.42 -4.82 121.20 120.12 3a9t s ILE 553 Ca 0.00 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.56 3a9t s ILE 553 Cb 0.00 -3.36 0.06 0.00 0.01 0.00 0.00 42.46 39.17 3a9t s ILE 553 CO 0.00 -0.19 1.18 -2.16 0.00 0.00 0.00 174.94 173.77 3a9t s PRO 554 N 1.49 2.00 -0.41 2.79 0.04 -1.26 -4.29 135.00 135.36 3a9t s PRO 554 Ca 0.01 1.63 -0.05 0.00 0.04 0.00 0.00 61.00 62.63 3a9t s PRO 554 Cb -0.19 -1.83 0.10 0.00 0.04 0.00 0.00 34.50 32.62 3a9t s PRO 554 CO 0.05 -1.92 0.22 0.08 0.04 0.00 0.00 177.00 175.47 3a9t s VAL 555 N -2.23 3.57 -0.35 -0.36 1.01 -1.26 -1.74 120.40 119.05 3a9t s VAL 555 Ca 0.71 -1.83 0.27 0.00 0.00 0.00 0.00 61.98 61.12 3a9t s VAL 555 Cb -0.26 -3.35 0.30 0.00 0.00 0.00 0.00 36.38 33.07 3a9t s VAL 555 CO 0.48 -0.62 1.79 -0.55 0.00 0.00 0.00 175.10 176.20 3a9t h ASN 556 N 8.17 0.00 -3.00 3.32 -1.07 -1.73 -3.45 115.58 117.83 3a9t h ASN 556 Ca -0.17 0.00 0.04 0.00 0.07 0.00 0.00 56.30 56.24 3a9t h ASN 556 Cb 1.06 0.00 -0.23 0.00 -2.07 0.00 0.00 38.32 37.08 3a9t h ASN 556 CO 0.72 0.00 0.15 -0.32 0.07 0.00 0.00 177.43 178.05 3a9t s MET 557 N -3.38 0.63 -0.14 4.14 0.00 -1.25 -5.03 119.30 114.26 3a9t s MET 557 Ca 0.04 1.02 -0.31 0.00 0.00 0.00 0.00 55.69 56.44 3a9t s MET 557 Cb 0.09 0.16 0.13 0.00 0.00 0.00 0.00 34.83 35.21 3a9t s MET 557 CO 0.47 -0.12 1.06 -3.38 0.00 0.00 0.00 175.02 173.05 3a9t s HIS 558 N 1.34 -0.27 -0.30 4.11 -3.43 -1.23 0.85 115.29 116.36 3a9t s HIS 558 Ca -0.08 0.32 0.08 0.00 -0.80 0.00 0.00 55.06 54.57 3a9t s HIS 558 Cb -0.05 0.50 0.46 0.00 -1.43 0.00 0.00 32.58 32.06 3a9t s HIS 558 CO -0.16 -0.33 1.18 0.27 -2.00 0.00 0.00 174.74 173.70 3a9t n ASN 559 N 0.23 4.76 -4.77 7.38 6.94 -1.25 -4.99 115.26 123.57 3a9t n ASN 559 Ca -0.06 -3.67 -0.39 0.00 -0.02 0.00 0.00 54.58 50.44 3a9t n ASN 559 Cb 0.59 -0.35 -0.06 0.00 -2.36 0.00 0.00 39.78 37.60 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 -4.63 4.84 0.35 3.53 1.01 -1.26 -4.83 120.40 119.41 3a9t s VAL 560 Ca 0.50 1.31 -0.28 0.00 0.00 0.00 0.00 61.98 63.51 3a9t s VAL 560 Cb 0.41 -3.96 -0.12 0.00 0.00 0.00 0.00 36.38 32.71 3a9t s VAL 560 CO 0.02 0.43 1.39 -2.65 0.00 0.00 0.00 175.10 174.29 3a9t n PRO 561 N 2.56 2.38 0.03 2.72 -0.02 -1.26 -4.86 135.00 136.55 3a9t n PRO 561 Ca -0.07 0.84 0.19 0.00 -2.02 0.00 0.00 63.50 62.44 3a9t n PRO 561 Cb 0.51 -2.49 0.70 0.00 -0.02 0.00 0.00 33.50 32.20 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 2.87 0.00 0.00 -0.52 4.39 -1.98 -1.60 114.58 117.74 3a9t h GLU 562 Ca -0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.22 3a9t h GLU 562 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3a9t h GLU 562 CO 0.64 0.00 0.00 1.05 -1.16 0.00 0.00 179.01 179.54 3a9t h GLU 563 N 0.00 0.00 0.00 2.33 9.09 -2.05 -2.84 114.58 121.11 3a9t h GLU 563 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.64 3a9t h GLU 563 Cb 0.94 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.04 3a9t h GLU 563 CO -0.00 0.00 -0.67 0.87 0.05 0.00 0.00 179.01 179.25 3a9t h LYS 564 N 0.00 0.00 -6.27 1.06 1.79 -1.64 -3.46 116.57 108.05 3a9t h LYS 564 Ca 0.00 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.90 3a9t h LYS 564 Cb 0.50 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.17 3a9t h LYS 564 CO 0.00 0.00 1.25 -0.89 -1.08 0.00 0.00 179.45 178.73 3a9t n ILE 565 N -2.39 0.64 -3.91 1.86 5.41 -1.07 -4.92 119.36 114.99 3a9t n ILE 565 Ca 0.02 -0.18 -0.30 0.00 1.00 0.00 0.00 62.75 63.29 3a9t n ILE 565 Cb 0.48 -2.22 -0.16 0.00 -0.71 0.00 0.00 39.64 37.04 3a9t n ILE 565 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 3a9t s PHE 566 N 5.03 2.24 0.17 1.39 5.36 -1.26 -5.09 117.98 125.82 3a9t s PHE 566 Ca 0.92 -1.67 0.04 0.00 -0.96 0.00 0.00 56.93 55.26 3a9t s PHE 566 Cb -0.50 -1.54 -0.05 0.00 -0.34 0.00 0.00 43.02 40.59 3a9t s PHE 566 CO 0.44 -0.76 -0.06 1.03 -1.46 0.00 0.00 175.22 174.41 3a9t s ARG 567 N 1.45 1.12 0.46 10.12 0.52 -1.26 -4.10 118.95 127.26 3a9t s ARG 567 Ca -0.05 -1.51 -0.22 0.00 -0.52 0.00 0.00 55.73 53.43 3a9t s ARG 567 Cb -0.19 -0.53 -0.10 0.00 0.52 0.00 0.00 34.95 34.65 3a9t s ARG 567 CO -0.07 -0.01 0.77 -2.30 0.02 0.00 0.00 175.30 173.71 3a9t n PRO 568 N -0.25 0.89 -0.33 3.54 -0.02 -1.26 -4.76 135.00 132.81 3a9t n PRO 568 Ca -0.08 0.33 0.17 0.00 -2.02 0.00 0.00 63.50 61.89 3a9t n PRO 568 Cb 0.62 -1.81 0.41 0.00 -0.02 0.00 0.00 33.50 32.69 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 0.96 0.63 -0.79 2.55 3.58 -0.89 -1.24 116.42 121.21 3a9t h ASP 569 Ca -0.44 0.10 0.18 0.00 0.42 0.00 0.00 57.03 57.29 3a9t h ASP 569 Cb 1.37 -0.01 -0.05 0.00 1.72 0.00 0.00 39.33 42.36 3a9t h ASP 569 CO 0.53 0.17 0.53 0.00 -2.88 0.00 0.00 179.24 177.59 3a9t h ALA 570 N 1.66 2.28 -0.73 -0.78 0.00 -1.88 -2.37 119.26 117.43 3a9t h ALA 570 Ca 0.59 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.60 3a9t h ALA 570 Cb 1.17 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 3a9t h ALA 570 CO -0.36 -0.51 0.36 -1.49 0.00 0.00 0.00 179.25 177.25 3a9t h TRP 571 N 0.31 0.64 -0.35 0.00 6.55 -1.55 -1.58 115.95 119.97 3a9t h TRP 571 Ca 0.39 0.03 0.10 0.00 0.95 0.00 0.00 58.89 60.37 3a9t h TRP 571 Cb 1.07 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 29.18 3a9t h TRP 571 CO -0.00 0.21 0.29 0.66 -1.05 0.00 0.00 178.44 178.55 3a9t h SER 572 N 0.59 0.00 1.05 -3.49 4.64 -1.61 0.14 113.55 114.87 3a9t h SER 572 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3a9t h SER 572 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3a9t h SER 572 CO -0.29 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 175.91 3a9t h MET 573 N 0.00 0.00 -0.49 4.77 2.86 -1.43 -2.52 114.93 118.12 3a9t h MET 573 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3a9t h MET 573 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 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 -2.67 0.65 0.00 -0.22 3.01 0.50 -4.98 117.46 113.74 3a9t n PHE 574 Ca 0.02 -0.32 0.00 0.00 1.01 0.00 0.00 57.45 58.16 3a9t n PHE 574 Cb 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.78 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 1.43 4.90 0.00 1.37 0.00 -0.95 -4.22 105.19 107.72 3a9t n GLY 575 Ca 0.19 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.90 0.00 0.01 2.61 -2.24 -1.26 -4.39 114.28 107.12 3a9t n THR 576 Ca 0.00 -0.10 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 3a9t n THR 576 Cb 0.00 0.54 -0.14 0.00 -2.10 0.00 0.00 70.33 68.63 3a9t n THR 576 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3a9t h LYS 577 N 0.00 0.12 -3.12 -0.78 1.57 -1.97 -3.41 116.57 108.98 3a9t h LYS 577 Ca 0.00 -0.21 -0.62 0.00 -1.87 0.00 0.00 60.65 57.95 3a9t h LYS 577 Cb 0.00 0.08 -0.41 0.00 0.08 0.00 0.00 32.23 31.98 3a9t h LYS 577 CO 0.00 0.85 -0.67 0.34 -0.57 0.00 0.00 179.45 179.40 3a9t s ASP 578 N -6.58 4.05 0.33 0.86 2.15 -1.26 -4.97 116.67 111.25 3a9t s ASP 578 Ca -0.09 -3.10 0.04 0.00 0.43 0.00 0.00 52.55 49.83 3a9t s ASP 578 Cb 0.08 -1.38 0.66 0.00 -0.30 0.00 0.00 42.92 41.98 3a9t s ASP 578 CO 0.82 -0.20 1.92 -0.07 -0.17 0.00 0.00 175.17 177.47 3a9t h LEU 579 N 6.25 0.77 -0.35 -1.34 3.38 -1.85 -0.60 115.31 121.57 3a9t h LEU 579 Ca 0.02 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3a9t h LEU 579 Cb 0.87 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3a9t h LEU 579 CO 0.61 0.48 0.17 -0.08 0.09 0.00 0.00 178.44 179.71 3a9t h GLU 580 N 0.87 0.51 -0.61 1.13 4.81 -1.94 0.23 114.58 119.57 3a9t h GLU 580 Ca 0.37 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 3a9t h GLU 580 Cb 0.31 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3a9t h GLU 580 CO -0.14 0.46 0.31 0.78 -0.73 0.00 0.00 179.01 179.68 3a9t h GLY 581 N 0.43 0.94 1.66 1.92 0.00 -1.72 -2.20 103.07 104.09 3a9t h GLY 581 Ca 0.12 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 3a9t h GLY 581 CO -0.01 0.43 -0.16 0.00 0.00 0.00 0.00 176.54 176.80 3a9t h ALA 582 N 1.13 1.29 0.03 3.60 0.00 -0.81 -1.87 119.26 122.64 3a9t h ALA 582 Ca 0.21 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3a9t h ALA 582 Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3a9t h ALA 582 CO -0.03 0.47 -0.02 0.22 0.00 0.00 0.00 179.25 179.90 3a9t h ASP 583 N 0.38 -0.04 -0.35 0.00 3.58 0.05 0.18 116.42 120.21 3a9t h ASP 583 Ca 0.07 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 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 0.04 0.20 1.88 -2.88 0.00 0.00 179.24 178.52 3a9t h TYR 584 N -0.12 0.47 -0.78 0.28 -1.99 -1.23 -0.96 116.97 112.64 3a9t h TYR 584 Ca -0.00 -0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.70 3a9t h TYR 584 Cb 0.10 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 38.64 3a9t h TYR 584 CO -0.05 0.35 0.39 0.00 -0.00 0.00 0.00 178.16 178.85 3a9t h ARG 585 N 0.45 1.12 -0.29 4.88 3.08 -1.14 -2.29 114.38 120.19 3a9t h ARG 585 Ca 0.12 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 3a9t h ARG 585 Cb 0.02 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 3a9t h ARG 585 CO -0.02 0.85 -0.19 0.00 -1.07 0.00 0.00 179.97 179.54 3a9t h ALA 586 N 1.20 0.42 -0.28 0.04 0.00 -0.47 -2.41 119.26 117.76 3a9t h ALA 586 Ca 0.27 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3a9t h ALA 586 Cb 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3a9t h ALA 586 CO -0.04 0.35 0.16 0.00 0.00 0.00 0.00 179.25 179.72 3a9t h LYS 588 N 0.34 -0.08 -0.13 0.00 3.64 -1.46 -3.31 116.57 115.56 3a9t h LYS 588 Ca 0.10 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3a9t h LYS 588 Cb 0.05 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 3a9t h LYS 588 CO -0.02 0.22 0.03 0.87 -2.27 0.00 0.00 179.45 178.28 3a9t h LYS 589 N -0.39 0.21 0.00 1.90 1.79 -1.45 -3.52 116.57 115.12 3a9t h LYS 589 Ca -0.01 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 3a9t h LYS 589 Cb 0.34 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 3a9t h LYS 589 CO 0.01 0.39 0.00 1.28 -1.08 0.00 0.00 179.45 180.06