#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 4.49 -0.04 0.00 2.47 -1.26 -0.85 119.74 124.55 3a9t s LYS 3 Ca 0.00 1.90 -0.30 0.00 -1.56 0.00 0.00 55.97 56.02 3a9t s LYS 3 Cb 0.00 -3.22 -0.05 0.00 -1.46 0.00 0.00 37.83 33.10 3a9t s LYS 3 CO 0.00 -0.07 1.48 0.34 0.16 0.00 0.00 175.35 177.26 3a9t s ASP 4 N -0.04 6.79 0.11 1.43 -1.08 -1.00 -4.74 116.67 118.13 3a9t s ASP 4 Ca 0.52 2.10 0.14 0.00 -0.52 0.00 0.00 52.55 54.79 3a9t s ASP 4 Cb -0.33 -2.55 0.64 0.00 -1.46 0.00 0.00 42.92 39.22 3a9t s ASP 4 CO 0.38 -0.81 1.45 -0.81 0.52 0.00 0.00 175.17 175.90 3a9t n PRO 5 N 6.21 0.07 0.00 4.34 -0.04 -1.26 -3.89 135.00 140.43 3a9t n PRO 5 Ca 0.15 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 3a9t n PRO 5 Cb 0.43 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 3a9t n PRO 5 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3a9t n ARG 6 N -1.79 2.31 -4.36 0.54 1.74 -1.26 -5.10 116.66 108.74 3a9t n ARG 6 Ca 0.02 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.86 3a9t n ARG 6 Cb 0.13 -0.78 -0.08 0.00 -1.02 0.00 0.00 32.46 30.70 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 -1.52 2.53 0.34 -1.55 1.51 -1.25 -4.91 117.35 112.49 3a9t s TYR 7 Ca 0.00 -0.33 -0.29 0.00 -1.01 0.00 0.00 57.07 55.44 3a9t s TYR 7 Cb 0.00 -1.25 -0.11 0.00 -0.11 0.00 0.00 41.96 40.49 3a9t s TYR 7 CO 0.00 0.59 1.48 0.08 -1.11 0.00 0.00 175.55 176.59 3a9t s VAL 8 N -2.45 2.23 0.00 0.71 1.01 -1.26 -4.49 120.40 116.15 3a9t s VAL 8 Ca 0.32 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.52 3a9t s VAL 8 Cb -0.04 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3a9t s VAL 8 CO 0.18 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3a9t n GLY 9 N 1.11 -1.80 3.73 4.51 0.00 -1.26 -4.95 105.19 106.53 3a9t n GLY 9 Ca 0.03 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 43.98 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 4.57 0.32 1.61 0.01 -1.26 -2.38 114.94 113.80 3a9t s ASN 10 Ca 0.00 -0.90 -0.27 0.00 -0.71 0.00 0.00 52.86 50.99 3a9t s ASN 10 Cb 0.00 -0.61 -0.09 0.00 0.41 0.00 0.00 41.25 40.95 3a9t s ASN 10 CO 0.00 -0.40 1.02 -0.76 -1.51 0.00 0.00 177.10 175.45 3a9t s LEU 11 N -3.87 4.39 0.35 0.60 1.43 -0.03 -4.69 118.68 116.86 3a9t s LEU 11 Ca 0.39 2.03 -0.27 0.00 -1.03 0.00 0.00 54.13 55.26 3a9t s LEU 11 Cb -0.00 -3.90 -0.12 0.00 0.03 0.00 0.00 46.19 42.20 3a9t s LEU 11 CO 0.23 -0.18 1.16 -2.65 0.23 0.00 0.00 176.35 175.13 3a9t n PRO 12 N 0.69 1.75 -4.26 1.29 -0.02 -1.26 -4.61 135.00 128.58 3a9t n PRO 12 Ca 0.01 0.62 -0.27 0.00 -2.02 0.00 0.00 63.50 61.84 3a9t n PRO 12 Cb 0.48 -2.15 -0.09 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.86 2.18 -0.28 -0.52 1.02 -0.86 -4.63 119.74 114.80 3a9t s LYS 13 Ca 0.58 -1.20 -0.11 0.00 0.02 0.00 0.00 55.97 55.27 3a9t s LYS 13 Cb -0.59 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 34.43 3a9t s LYS 13 CO 0.60 0.45 0.18 0.42 -0.92 0.00 0.00 175.35 176.08 3a9t s ILE 14 N -1.68 5.24 -0.02 2.17 1.01 -0.40 0.04 121.20 127.56 3a9t s ILE 14 Ca 0.26 0.15 -0.22 0.00 0.00 0.00 0.00 60.65 60.83 3a9t s ILE 14 Cb -0.09 -3.49 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 3a9t s ILE 14 CO 0.16 0.26 0.64 -0.83 0.00 0.00 0.00 174.94 175.17 3a9t s GLY 15 N 1.74 2.63 -0.21 6.18 0.00 0.20 -0.69 107.32 117.17 3a9t s GLY 15 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 44.72 44.84 3a9t s GLY 15 CO 0.10 0.91 -0.05 -0.42 0.00 0.00 0.00 173.10 173.64 3a9t s ILE 16 N 0.12 3.37 -0.37 0.90 -1.09 0.11 -0.02 121.20 124.23 3a9t s ILE 16 Ca 0.33 -0.50 -0.04 0.00 -2.23 0.00 0.00 60.65 58.22 3a9t s ILE 16 Cb -0.18 -2.52 0.08 0.00 -1.58 0.00 0.00 42.46 38.26 3a9t s ILE 16 CO 0.18 0.44 0.14 -0.13 -1.23 0.00 0.00 174.94 174.33 3a9t s ARG 17 N 1.30 2.29 -0.52 2.79 0.52 0.13 -2.55 118.95 122.91 3a9t s ARG 17 Ca 0.04 -1.52 -0.23 0.00 -0.52 0.00 0.00 55.73 53.50 3a9t s ARG 17 Cb -0.14 -3.47 0.04 0.00 0.52 0.00 0.00 34.95 31.90 3a9t s ARG 17 CO -0.02 -0.86 0.83 -1.25 0.02 0.00 0.00 175.30 174.02 3a9t s PRO 18 N 1.25 3.30 0.16 3.54 0.04 -1.26 -0.18 135.00 141.84 3a9t s PRO 18 Ca 0.02 -0.38 -0.03 0.00 0.04 0.00 0.00 61.00 60.65 3a9t s PRO 18 Cb -0.21 -4.04 -0.05 0.00 0.04 0.00 0.00 34.50 30.24 3a9t s PRO 18 CO -0.01 -1.34 0.37 0.95 0.04 0.00 0.00 177.00 177.00 3a9t s THR 19 N 3.50 5.20 0.22 1.26 -4.23 -0.68 -0.25 115.64 120.66 3a9t s THR 19 Ca 0.27 -0.13 -0.08 0.00 -1.18 0.00 0.00 61.69 60.57 3a9t s THR 19 Cb -0.14 -3.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.02 3a9t s THR 19 CO 0.18 -0.02 0.32 -0.51 -0.54 0.00 0.00 174.62 174.05 3a9t s ILE 20 N -1.72 0.00 0.02 2.99 2.07 -0.14 -4.57 121.20 119.86 3a9t s ILE 20 Ca 0.40 -1.66 -0.30 0.00 -1.41 0.00 0.00 60.65 57.67 3a9t s ILE 20 Cb -0.12 -2.31 -0.05 0.00 0.13 0.00 0.00 42.46 40.11 3a9t s ILE 20 CO 0.26 -0.02 1.25 -0.62 -1.91 0.00 0.00 174.94 173.91 3a9t s ASP 21 N -3.08 7.01 0.52 4.50 -1.08 -1.10 -4.21 116.67 119.23 3a9t s ASP 21 Ca 0.29 2.00 0.26 0.00 -0.52 0.00 0.00 52.55 54.58 3a9t s ASP 21 Cb 0.03 -2.57 1.45 0.00 -1.46 0.00 0.00 42.92 40.37 3a9t s ASP 21 CO 0.10 -0.56 2.09 1.23 0.52 0.00 0.00 175.17 178.55 3a9t h GLY 22 N 7.50 0.00 -6.52 2.66 0.00 -1.84 -3.37 103.07 101.50 3a9t h GLY 22 Ca -0.39 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.36 3a9t h GLY 22 CO 0.85 0.00 1.41 0.54 0.00 0.00 0.00 176.54 179.34 3a9t n ARG 23 N -3.78 2.13 -1.24 4.80 1.74 -1.26 -4.87 116.66 114.19 3a9t n ARG 23 Ca -0.02 0.66 -0.08 0.00 -0.77 0.00 0.00 57.85 57.63 3a9t n ARG 23 Cb 0.21 -3.10 0.05 0.00 -1.02 0.00 0.00 32.46 28.59 3a9t n ARG 23 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3a9t n ARG 24 N 8.32 0.27 -2.27 5.56 1.74 -1.26 -0.91 116.66 128.11 3a9t n ARG 24 Ca 0.28 -0.93 -0.18 0.00 -0.77 0.00 0.00 57.85 56.24 3a9t n ARG 24 Cb 0.42 -0.26 -0.01 0.00 -1.02 0.00 0.00 32.46 31.58 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 -1.69 -1.43 0.00 5.56 4.76 -1.26 -4.43 118.16 119.67 3a9t n LYS 25 Ca 0.06 0.90 0.00 0.00 -2.87 0.00 0.00 58.31 56.40 3a9t n LYS 25 Cb 0.21 -5.39 0.00 0.00 -1.84 0.00 0.00 35.03 28.00 3a9t n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a9t n GLY 26 N -0.99 -1.62 0.48 0.72 0.00 -1.26 -5.04 105.19 97.47 3a9t n GLY 26 Ca -0.21 0.54 -0.18 0.00 0.00 0.00 0.00 46.02 46.17 3a9t n GLY 26 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3a9t h VAL 27 N 0.00 0.00 -0.31 1.61 2.07 -1.77 -3.16 116.25 114.68 3a9t h VAL 27 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 3a9t h VAL 27 Cb 0.00 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.71 3a9t h VAL 27 CO 0.00 0.00 -0.07 -0.09 0.02 0.00 0.00 177.57 177.43 3a9t h ARG 28 N -1.18 0.01 -0.32 1.57 2.43 -1.19 -2.05 114.38 113.65 3a9t h ARG 28 Ca -0.12 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.15 3a9t h ARG 28 Cb 0.91 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 3a9t h ARG 28 CO 0.17 0.01 0.31 0.93 -1.51 0.00 0.00 179.97 179.88 3a9t h GLU 29 N 0.01 0.00 -0.15 0.20 3.07 -1.82 0.35 114.58 116.24 3a9t h GLU 29 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3a9t h GLU 29 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 3a9t h GLU 29 CO -0.31 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.17 3a9t n SER 30 N -3.91 1.94 0.00 1.42 3.41 -0.78 -4.07 113.62 111.64 3a9t n SER 30 Ca 0.05 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.94 3a9t n SER 30 Cb 0.47 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 3a9t n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3a9t n LEU 31 N 0.51 0.67 0.07 1.04 4.77 0.06 -4.78 117.00 119.34 3a9t n LEU 31 Ca 0.17 -0.67 -0.12 0.00 -0.03 0.00 0.00 56.01 55.37 3a9t n LEU 31 Cb 0.39 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3a9t n LEU 31 CO 0.14 0.17 0.79 -0.33 -1.33 0.00 0.00 177.39 176.83 3a9t h GLU 32 N 0.00 -0.20 -0.12 3.23 4.39 -1.57 -1.46 114.58 118.84 3a9t h GLU 32 Ca 0.00 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.64 3a9t h GLU 32 Cb 0.17 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.86 3a9t h GLU 32 CO 0.00 -0.14 -0.20 1.49 -1.16 0.00 0.00 179.01 179.00 3a9t h GLU 33 N -0.21 0.35 -0.17 2.33 4.81 -1.88 -2.03 114.58 117.78 3a9t h GLU 33 Ca 0.03 -0.22 0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3a9t h GLU 33 Cb 0.24 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3a9t h GLU 33 CO -0.09 0.80 -0.10 1.15 -0.73 0.00 0.00 179.01 180.05 3a9t h THR 34 N -0.06 0.70 -0.28 0.32 2.02 -1.85 0.30 112.91 114.05 3a9t h THR 34 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 3a9t h THR 34 Cb 0.77 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 3a9t h THR 34 CO 0.05 0.00 0.08 0.74 0.37 0.00 0.00 175.52 176.76 3a9t h THR 35 N -0.09 1.20 -0.69 3.16 2.02 -1.33 -0.78 112.91 116.40 3a9t h THR 35 Ca 0.10 -0.66 -0.05 0.00 0.77 0.00 0.00 66.41 66.57 3a9t h THR 35 Cb 0.24 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 3a9t h THR 35 CO -0.23 0.22 0.23 -0.03 0.37 0.00 0.00 175.52 176.08 3a9t h MET 36 N 0.29 1.07 -0.82 6.66 -1.53 -1.10 -1.80 114.93 117.70 3a9t h MET 36 Ca 0.09 -0.22 -0.03 0.00 -3.44 0.00 0.00 59.70 56.10 3a9t h MET 36 Cb 0.25 -0.16 -0.04 0.00 -0.55 0.00 0.00 31.60 31.11 3a9t h MET 36 CO -0.00 0.91 0.41 -0.91 0.14 0.00 0.00 176.91 177.46 3a9t h ASN 37 N 1.01 1.06 -0.38 1.39 -0.26 -0.26 -1.00 115.58 117.15 3a9t h ASN 37 Ca 0.23 -0.13 0.05 0.00 -0.56 0.00 0.00 56.30 55.89 3a9t h ASN 37 Cb 0.28 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.22 3a9t h ASN 37 CO -0.01 0.89 0.11 -0.03 -1.06 0.00 0.00 177.43 177.33 3a9t h MET 38 N 1.16 0.25 -0.40 0.81 4.05 -0.67 0.16 114.93 120.28 3a9t h MET 38 Ca 0.28 -0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.71 3a9t h MET 38 Cb 0.10 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 3a9t h MET 38 CO -0.04 0.16 0.21 0.00 0.23 0.00 0.00 176.91 177.47 3a9t h ALA 39 N 1.26 0.49 -0.67 0.39 0.00 -0.61 -1.80 119.26 118.32 3a9t h ALA 39 Ca 0.18 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 3a9t h ALA 39 Cb 0.17 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3a9t h ALA 39 CO -0.20 -0.15 0.25 0.87 0.00 0.00 0.00 179.25 180.02 3a9t h LYS 40 N 0.42 1.00 -0.68 0.00 1.57 -0.56 -2.00 116.57 116.32 3a9t h LYS 40 Ca 0.17 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3a9t h LYS 40 Cb 0.06 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 3a9t h LYS 40 CO -0.10 0.83 0.45 0.00 -0.57 0.00 0.00 179.45 180.06 3a9t h ALA 41 N 1.29 1.54 -0.30 3.86 0.00 0.11 0.28 119.26 126.05 3a9t h ALA 41 Ca 0.22 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 3a9t h ALA 41 Cb 0.22 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3a9t h ALA 41 CO -0.02 0.41 -0.49 0.28 0.00 0.00 0.00 179.25 179.43 3a9t h VAL 42 N 0.89 1.28 -0.81 0.00 2.07 -0.85 -1.61 116.25 117.22 3a9t h VAL 42 Ca 0.26 -1.67 0.02 0.00 0.82 0.00 0.00 66.70 66.13 3a9t h VAL 42 Cb -0.05 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 3a9t h VAL 42 CO -0.06 0.55 0.54 0.00 0.02 0.00 0.00 177.57 178.61 3a9t h ALA 43 N 0.69 1.47 0.38 1.67 0.00 -0.62 -1.17 119.26 121.69 3a9t h ALA 43 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3a9t h ALA 43 Cb 1.10 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3a9t h ALA 43 CO 0.11 0.46 -0.18 -0.22 0.00 0.00 0.00 179.25 179.42 3a9t h LYS 44 N 1.04 -0.49 -0.61 0.00 3.64 -0.76 -2.48 116.57 116.91 3a9t h LYS 44 Ca 0.31 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.82 3a9t h LYS 44 Cb -0.03 0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.84 3a9t h LYS 44 CO -0.08 -0.18 0.24 1.25 -2.27 0.00 0.00 179.45 178.40 3a9t h LEU 45 N -0.82 0.26 -0.70 5.20 5.85 -1.01 -2.42 115.31 121.66 3a9t h LEU 45 Ca -0.05 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 3a9t h LEU 45 Cb 0.53 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 3a9t h LEU 45 CO 0.09 0.15 0.25 -0.07 -0.34 0.00 0.00 178.44 178.52 3a9t h LEU 46 N 0.43 1.00 -1.56 2.25 3.38 -1.25 -2.62 115.31 116.94 3a9t h LEU 46 Ca 0.31 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3a9t h LEU 46 Cb 0.36 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3a9t h LEU 46 CO -0.29 0.92 -0.20 -0.33 0.09 0.00 0.00 178.44 178.63 3a9t h GLU 47 N 1.02 0.03 -0.00 1.13 5.08 -0.97 0.33 114.58 121.19 3a9t h GLU 47 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3a9t h GLU 47 Cb 0.25 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3a9t h GLU 47 CO -0.01 0.23 -0.32 0.39 -1.00 0.00 0.00 179.01 178.30 3a9t n GLU 48 N -4.29 0.33 0.00 2.33 1.02 -0.99 -4.36 120.64 114.68 3a9t n GLU 48 Ca -0.02 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 3a9t n GLU 48 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 -1.19 0.03 -3.98 1.62 3.02 -0.90 -5.03 115.26 108.83 3a9t n ASN 49 Ca 0.09 -0.29 -0.29 0.00 -0.03 0.00 0.00 54.58 54.06 3a9t n ASN 49 Cb 0.33 0.46 -0.17 0.00 -0.61 0.00 0.00 39.78 39.80 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 1.37 0.12 2.41 1.01 0.11 -5.06 120.40 119.89 3a9t s VAL 50 Ca 0.00 -0.51 0.09 0.00 0.00 0.00 0.00 61.98 61.56 3a9t s VAL 50 Cb 0.00 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 3a9t s VAL 50 CO 0.00 0.42 -0.23 -0.36 0.00 0.00 0.00 175.10 174.94 3a9t s PHE 51 N 1.50 1.95 0.96 5.22 0.40 -1.26 -0.24 117.98 126.50 3a9t s PHE 51 Ca 0.04 -0.41 -0.12 0.00 -0.60 0.00 0.00 56.93 55.83 3a9t s PHE 51 Cb -0.13 -1.06 0.16 0.00 0.51 0.00 0.00 43.02 42.51 3a9t s PHE 51 CO -0.09 0.26 1.12 0.71 0.70 0.00 0.00 175.22 177.92 3a9t s TYR 52 N -1.20 2.31 -0.18 0.36 1.51 0.19 -4.81 117.35 115.53 3a9t s TYR 52 Ca 0.09 0.89 0.24 0.00 -1.01 0.00 0.00 57.07 57.28 3a9t s TYR 52 Cb -0.10 -3.35 1.23 0.00 -0.11 0.00 0.00 41.96 39.64 3a9t s TYR 52 CO 0.05 -2.63 1.72 0.10 -1.11 0.00 0.00 175.55 173.69 3a9t h TYR 53 N -1.69 0.00 -0.64 2.71 -0.00 -1.93 -1.54 116.97 113.88 3a9t h TYR 53 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.21 3a9t h TYR 53 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.06 3a9t h TYR 53 CO 0.26 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 178.69 3a9t n ASN 54 N -2.33 3.70 0.00 0.10 6.94 -1.26 -4.86 115.26 117.55 3a9t n ASN 54 Ca -0.01 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.45 3a9t n ASN 54 Cb 0.07 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.03 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 1.43 2.94 3.77 4.83 0.00 -0.58 -5.01 105.19 112.58 3a9t n GLY 55 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.12 4.16 0.47 1.61 -0.21 -1.26 -4.62 119.66 119.68 3a9t s GLN 56 Ca 0.00 2.50 -0.23 0.00 0.02 0.00 0.00 55.36 57.65 3a9t s GLN 56 Cb 0.00 -3.00 -0.07 0.00 1.00 0.00 0.00 33.01 30.94 3a9t s GLN 56 CO 0.00 -0.48 1.17 -1.25 -2.12 0.00 0.00 175.29 172.62 3a9t s PRO 57 N -1.84 3.69 0.51 2.91 0.04 -1.26 0.54 135.00 139.58 3a9t s PRO 57 Ca 0.53 1.79 -0.23 0.00 0.04 0.00 0.00 61.00 63.13 3a9t s PRO 57 Cb -0.45 -2.37 -0.07 0.00 0.04 0.00 0.00 34.50 31.65 3a9t s PRO 57 CO 0.59 -0.61 1.32 1.55 0.04 0.00 0.00 177.00 179.90 3a9t n VAL 58 N -0.57 3.37 -4.16 -0.36 3.14 0.66 -4.69 118.33 115.72 3a9t n VAL 58 Ca 0.08 -0.50 -0.36 0.00 -2.96 0.00 0.00 64.34 60.60 3a9t n VAL 58 Cb 0.48 -1.64 -0.08 0.00 -1.06 0.00 0.00 33.84 31.54 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 -2.65 3.29 0.14 1.45 2.02 -1.26 -4.52 118.70 117.17 3a9t s GLU 59 Ca 0.68 -0.31 0.08 0.00 0.02 0.00 0.00 54.97 55.44 3a9t s GLU 59 Cb -0.44 -2.99 -0.04 0.00 0.10 0.00 0.00 34.13 30.76 3a9t s GLU 59 CO 0.52 0.66 -0.08 0.00 0.02 0.00 0.00 175.26 176.38 3a9t s VAL 61 N -1.47 1.71 -0.09 0.00 1.01 0.13 -4.91 120.40 116.77 3a9t s VAL 61 Ca 0.24 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.36 3a9t s VAL 61 Cb -0.10 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 3a9t s VAL 61 CO 0.15 0.48 -0.17 -0.63 0.00 0.00 0.00 175.10 174.94 3a9t s ILE 62 N -0.11 2.77 0.39 2.22 1.01 -1.26 0.08 121.20 126.30 3a9t s ILE 62 Ca -0.02 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.59 3a9t s ILE 62 Cb -0.12 -2.11 -0.12 0.00 0.01 0.00 0.00 42.46 40.13 3a9t s ILE 62 CO 0.02 0.55 0.99 0.00 0.00 0.00 0.00 174.94 176.50 3a9t n ALA 63 N 3.13 0.02 0.32 9.38 0.00 -1.06 -4.84 120.51 127.46 3a9t n ALA 63 Ca -0.18 0.27 0.21 0.00 0.00 0.00 0.00 53.44 53.74 3a9t n ALA 63 Cb 0.52 -2.05 1.10 0.00 0.00 0.00 0.00 19.45 19.02 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 1.63 0.00 -5.10 0.00 3.32 -1.94 -3.44 116.42 110.89 3a9t h ASP 64 Ca -0.43 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.56 3a9t h ASP 64 Cb 1.34 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.76 3a9t h ASP 64 CO 0.57 0.01 -0.17 0.42 -1.72 0.00 0.00 179.24 178.36 3a9t s THR 65 N -4.11 0.09 0.47 0.35 -4.23 -1.26 -5.14 115.64 101.82 3a9t s THR 65 Ca -0.04 -0.78 -0.24 0.00 -1.18 0.00 0.00 61.69 59.46 3a9t s THR 65 Cb 0.13 -1.24 -0.07 0.00 1.34 0.00 0.00 72.50 72.66 3a9t s THR 65 CO 0.45 -0.41 1.30 0.00 -0.54 0.00 0.00 174.62 175.42 3a9t s ILE 67 N -1.34 4.88 -0.53 0.00 1.01 0.66 -4.87 121.20 121.02 3a9t s ILE 67 Ca 0.64 0.15 0.04 0.00 0.00 0.00 0.00 60.65 61.49 3a9t s ILE 67 Cb -0.37 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 37.98 3a9t s ILE 67 CO 0.46 -0.50 0.60 0.61 0.00 0.00 0.00 174.94 176.12 3a9t n GLY 68 N 4.97 -0.91 3.88 6.18 0.00 -1.26 -0.97 105.19 117.08 3a9t n GLY 68 Ca -0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 3a9t n GLY 68 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a9t s GLY 69 N -0.44 0.06 0.30 -0.02 0.00 -1.26 -4.12 107.32 101.85 3a9t s GLY 69 Ca 0.05 -0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.53 3a9t s GLY 69 CO 0.06 2.56 1.89 -0.24 0.00 0.00 0.00 173.10 177.37 3a9t h VAL 70 N 2.00 1.01 -0.01 1.40 3.04 -1.72 -2.06 116.25 119.90 3a9t h VAL 70 Ca -0.27 -0.34 0.02 0.00 -1.01 0.00 0.00 66.70 65.11 3a9t h VAL 70 Cb 1.22 -0.06 -0.03 0.00 -2.01 0.00 0.00 31.29 30.41 3a9t h VAL 70 CO 0.35 0.18 -0.14 0.50 -1.01 0.00 0.00 177.57 177.45 3a9t h LYS 71 N 0.98 -0.21 0.00 4.17 1.63 -1.97 0.20 116.57 121.38 3a9t h LYS 71 Ca 0.42 0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 60.15 3a9t h LYS 71 Cb 0.32 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.98 3a9t h LYS 71 CO -0.18 -0.14 -0.39 0.93 -3.45 0.00 0.00 179.45 176.22 3a9t h GLU 72 N -0.22 0.00 -0.28 1.90 5.08 -1.88 -1.09 114.58 118.09 3a9t h GLU 72 Ca 0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 3a9t h GLU 72 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 3a9t h GLU 72 CO -0.14 0.39 -0.39 0.00 -1.00 0.00 0.00 179.01 177.87 3a9t h ALA 73 N 1.61 0.43 -0.50 3.43 0.00 -0.82 0.38 119.26 123.78 3a9t h ALA 73 Ca -0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 3a9t h ALA 73 Cb 0.80 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3a9t h ALA 73 CO 0.05 0.52 0.19 0.00 0.00 0.00 0.00 179.25 180.02 3a9t h ALA 74 N 0.68 0.66 -0.79 0.00 0.00 -0.32 0.11 119.26 119.60 3a9t h ALA 74 Ca 0.03 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.84 3a9t h ALA 74 Cb 0.98 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 3a9t h ALA 74 CO 0.09 0.27 0.48 0.93 0.00 0.00 0.00 179.25 181.02 3a9t h GLU 75 N 0.68 0.85 -0.63 0.00 4.39 -1.00 -0.13 114.58 118.74 3a9t h GLU 75 Ca 0.17 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.72 3a9t h GLU 75 Cb 0.21 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3a9t h GLU 75 CO -0.01 0.56 0.03 0.00 -1.16 0.00 0.00 179.01 178.43 3a9t h ALA 76 N 1.38 0.84 -0.61 3.43 0.00 -0.19 -1.53 119.26 122.58 3a9t h ALA 76 Ca 0.34 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3a9t h ALA 76 Cb 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3a9t h ALA 76 CO -0.17 0.66 0.19 0.00 0.00 0.00 0.00 179.25 179.93 3a9t h ALA 77 N 1.01 0.80 0.21 0.00 0.00 0.06 -1.59 119.26 119.74 3a9t h ALA 77 Ca 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3a9t h ALA 77 Cb 0.53 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3a9t h ALA 77 CO 0.03 0.47 -0.10 1.49 0.00 0.00 0.00 179.25 181.14 3a9t h GLU 78 N 0.88 -0.27 -0.09 0.00 4.57 -0.87 -1.55 114.58 117.25 3a9t h GLU 78 Ca 0.20 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.43 3a9t h GLU 78 Cb 0.29 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.91 3a9t h GLU 78 CO -0.01 -0.11 -0.12 -0.22 -1.18 0.00 0.00 179.01 177.38 3a9t h LYS 79 N -0.37 -0.15 -0.69 1.92 3.64 -1.17 -2.45 116.57 117.30 3a9t h LYS 79 Ca -0.03 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 3a9t h LYS 79 Cb 0.29 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 3a9t h LYS 79 CO 0.05 -0.10 0.45 0.74 -2.27 0.00 0.00 179.45 178.32 3a9t h PHE 80 N -0.15 0.85 -0.48 1.91 0.05 -1.26 -0.36 116.94 117.49 3a9t h PHE 80 Ca 0.07 0.02 0.05 0.00 3.82 0.00 0.00 57.97 61.93 3a9t h PHE 80 Cb 0.26 -0.28 -0.04 0.00 2.00 0.00 0.00 35.95 37.88 3a9t h PHE 80 CO -0.22 0.51 0.23 0.00 -0.18 0.00 0.00 178.31 178.66 3a9t h ALA 81 N 1.27 0.61 0.00 2.45 0.00 -0.99 -1.66 119.26 120.95 3a9t h ALA 81 Ca 0.26 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3a9t h ALA 81 Cb -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3a9t h ALA 81 CO -0.08 -0.13 -0.06 0.07 0.00 0.00 0.00 179.25 179.06 3a9t h ARG 82 N 0.46 0.00 -0.01 0.00 0.11 -1.12 -3.14 114.38 110.68 3a9t h ARG 82 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 3a9t h ARG 82 Cb 0.14 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.22 3a9t h ARG 82 CO -0.16 0.00 -0.22 0.39 0.10 0.00 0.00 179.97 180.08 3a9t n GLU 83 N -2.32 0.87 -2.34 0.08 -0.58 -0.17 -4.95 120.64 111.22 3a9t n GLU 83 Ca 0.05 -0.49 -0.03 0.00 -0.42 0.00 0.00 57.16 56.28 3a9t n GLU 83 Cb 0.44 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3a9t n GLU 83 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3a9t n GLY 84 N 1.32 0.52 3.72 0.62 0.00 -0.71 -4.85 105.19 105.82 3a9t n GLY 84 Ca 0.13 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.59 4.35 -0.09 1.61 1.01 -0.71 -2.02 120.40 121.96 3a9t s VAL 85 Ca 0.04 1.80 0.02 0.00 0.00 0.00 0.00 61.98 63.84 3a9t s VAL 85 Cb -0.02 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 3a9t s VAL 85 CO 0.05 0.20 0.09 0.61 0.00 0.00 0.00 175.10 176.05 3a9t n GLY 86 N 2.67 0.72 2.91 4.51 0.00 0.11 -4.82 105.19 111.29 3a9t n GLY 86 Ca 0.05 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 3a9t n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a9t s VAL 87 N -1.29 0.23 0.04 1.61 1.01 -1.13 -4.08 120.40 116.79 3a9t s VAL 87 Ca 0.01 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 61.95 3a9t s VAL 87 Cb 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 3a9t s VAL 87 CO 0.09 0.07 -0.20 -0.94 0.00 0.00 0.00 175.10 174.12 3a9t s SER 88 N 0.01 2.41 -0.07 3.32 1.04 -0.47 0.62 113.70 120.56 3a9t s SER 88 Ca 0.00 -0.52 -0.01 0.00 0.48 0.00 0.00 55.95 55.90 3a9t s SER 88 Cb -0.02 -0.20 0.03 0.00 0.10 0.00 0.00 66.02 65.93 3a9t s SER 88 CO -0.00 0.15 -0.01 -0.63 0.98 0.00 0.00 173.24 173.73 3a9t s ILE 89 N -0.81 0.43 -0.09 -1.02 1.01 0.97 -1.58 121.20 120.11 3a9t s ILE 89 Ca 0.07 0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.70 3a9t s ILE 89 Cb -0.09 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 3a9t s ILE 89 CO 0.02 0.26 0.21 -0.89 0.00 0.00 0.00 174.94 174.54 3a9t s THR 90 N 1.86 5.38 0.01 2.92 2.01 -0.01 0.17 115.64 127.98 3a9t s THR 90 Ca 0.04 0.38 0.01 0.00 0.31 0.00 0.00 61.69 62.43 3a9t s THR 90 Cb -0.12 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.89 3a9t s THR 90 CO -0.05 0.60 -0.05 0.68 -0.69 0.00 0.00 174.62 175.11 3a9t s VAL 91 N -0.97 0.38 -0.12 3.82 -7.23 0.74 0.03 120.40 117.05 3a9t s VAL 91 Ca 0.17 -0.52 -0.30 0.00 -1.81 0.00 0.00 61.98 59.52 3a9t s VAL 91 Cb -0.13 -0.38 0.11 0.00 0.56 0.00 0.00 36.38 36.54 3a9t s VAL 91 CO 0.06 -0.10 0.91 0.28 -0.31 0.00 0.00 175.10 175.94 3a9t s THR 92 N -0.61 0.00 -1.48 5.32 -1.32 -0.88 -1.69 115.64 114.98 3a9t s THR 92 Ca -0.03 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 60.57 3a9t s THR 92 Cb -0.05 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.03 3a9t s THR 92 CO -0.00 0.00 0.87 -0.81 -2.21 0.00 0.00 174.62 172.47 3a9t n PRO 93 N 0.73 0.80 -3.35 7.08 -0.04 -1.26 -0.84 135.00 138.12 3a9t n PRO 93 Ca -0.12 -1.18 -0.13 0.00 -0.04 0.00 0.00 63.50 62.03 3a9t n PRO 93 Cb 0.58 -1.22 -0.04 0.00 -0.04 0.00 0.00 33.50 32.77 3a9t n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3a9t s TRP 95 N -2.63 3.91 0.16 0.00 -0.11 -1.23 -3.94 118.94 115.11 3a9t s TRP 95 Ca 0.18 1.76 0.01 0.00 1.22 0.00 0.00 56.10 59.28 3a9t s TRP 95 Cb 0.01 -2.87 -0.04 0.00 -1.50 0.00 0.00 33.47 29.06 3a9t s TRP 95 CO 0.13 0.45 0.02 0.00 -4.62 0.00 0.00 176.95 172.93 3a9t n TYR 97 N -0.20 3.22 0.00 0.00 4.01 -1.26 -4.91 117.16 118.02 3a9t n TYR 97 Ca -0.06 -2.93 0.00 0.00 -0.16 0.00 0.00 57.90 54.75 3a9t n TYR 97 Cb 0.63 -2.36 0.00 0.00 -0.31 0.00 0.00 39.34 37.31 3a9t n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a9t n GLY 98 N 3.59 0.00 0.49 2.72 0.00 -1.26 0.27 105.19 111.00 3a9t n GLY 98 Ca 0.52 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.82 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 0.19 0.00 2.61 1.35 -1.91 0.36 112.91 115.50 3a9t h THR 99 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 3a9t h THR 99 Cb 0.00 0.30 -0.00 0.00 -1.73 0.00 0.00 68.15 66.71 3a9t h THR 99 CO 0.00 0.00 -0.14 -0.33 -0.25 0.00 0.00 175.52 174.80 3a9t h GLU 100 N 0.00 0.00 -0.01 4.72 5.08 -0.59 -3.20 114.58 120.59 3a9t h GLU 100 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 3a9t h GLU 100 Cb 2.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.45 3a9t h GLU 100 CO -0.00 0.14 -0.11 0.25 -1.00 0.00 0.00 179.01 178.29 3a9t n THR 101 N -3.36 0.00 -1.01 1.13 -2.24 0.12 -1.77 114.28 107.15 3a9t n THR 101 Ca -0.00 -0.45 -0.33 0.00 -2.27 0.00 0.00 64.05 61.00 3a9t n THR 101 Cb 0.35 1.11 0.13 0.00 -2.10 0.00 0.00 70.33 69.81 3a9t n THR 101 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3a9t n MET 102 N -0.10 0.03 -3.33 -0.78 2.81 -1.02 -4.95 117.12 109.79 3a9t n MET 102 Ca 0.03 0.08 -0.43 0.00 -1.81 0.00 0.00 57.70 55.57 3a9t n MET 102 Cb 0.16 -2.28 -0.08 0.00 -0.71 0.00 0.00 33.22 30.31 3a9t n MET 102 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3a9t s ASP 103 N -2.11 6.18 0.00 7.83 -1.08 -1.26 -4.95 116.67 121.28 3a9t s ASP 103 Ca 0.69 -0.92 0.13 0.00 -0.52 0.00 0.00 52.55 51.93 3a9t s ASP 103 Cb -0.28 -2.22 0.51 0.00 -1.46 0.00 0.00 42.92 39.47 3a9t s ASP 103 CO 0.55 -0.64 1.36 0.23 0.52 0.00 0.00 175.17 177.20 3a9t n MET 104 N 5.54 1.48 -2.54 4.34 2.81 -1.26 -4.81 117.12 122.67 3a9t n MET 104 Ca -0.09 -0.73 -0.43 0.00 -1.81 0.00 0.00 57.70 54.64 3a9t n MET 104 Cb 0.46 -1.25 -0.02 0.00 -0.71 0.00 0.00 33.22 31.70 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 -1.26 6.53 0.26 7.83 -1.08 -1.26 -4.88 116.67 122.81 3a9t s ASP 105 Ca 0.22 0.48 0.25 0.00 -0.52 0.00 0.00 52.55 52.98 3a9t s ASP 105 Cb 0.11 -2.55 0.93 0.00 -1.46 0.00 0.00 42.92 39.95 3a9t s ASP 105 CO 0.16 -1.34 1.74 -0.81 0.52 0.00 0.00 175.17 175.45 3a9t n PRO 106 N 8.00 0.23 -0.49 4.34 -0.04 -1.26 -3.72 135.00 142.06 3a9t n PRO 106 Ca 0.12 0.36 0.06 0.00 -0.04 0.00 0.00 63.50 64.00 3a9t n PRO 106 Cb 0.49 -1.87 0.25 0.00 -0.04 0.00 0.00 33.50 32.33 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 -2.29 1.17 -3.86 0.54 8.25 -1.26 -4.88 115.22 112.88 3a9t n HIS 107 Ca 0.03 -0.43 -0.12 0.00 -0.26 0.00 0.00 57.72 56.94 3a9t n HIS 107 Cb 0.31 -0.27 -0.13 0.00 1.12 0.00 0.00 29.99 31.02 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 -1.93 0.00 0.34 1.59 -4.36 -1.24 -5.05 121.20 110.55 3a9t s ILE 108 Ca 0.35 -0.04 -0.29 0.00 -0.26 0.00 0.00 60.65 60.41 3a9t s ILE 108 Cb 0.24 -0.08 -0.11 0.00 1.25 0.00 0.00 42.46 43.76 3a9t s ILE 108 CO 0.14 -0.02 1.54 -2.84 0.24 0.00 0.00 174.94 174.00 3a9t s PRO 109 N -0.05 4.10 0.01 0.37 0.02 -1.26 -4.82 135.00 133.37 3a9t s PRO 109 Ca -0.01 2.60 0.01 0.00 0.02 0.00 0.00 61.00 63.62 3a9t s PRO 109 Cb -0.01 -2.98 -0.01 0.00 0.02 0.00 0.00 34.50 31.52 3a9t s PRO 109 CO 0.00 -0.60 -0.03 -1.59 -0.33 0.00 0.00 177.00 174.45 3a9t s LYS 110 N -1.43 0.24 0.17 5.54 -2.85 -1.26 -1.36 119.74 118.79 3a9t s LYS 110 Ca 0.58 -0.33 0.02 0.00 -1.00 0.00 0.00 55.97 55.23 3a9t s LYS 110 Cb -0.48 -0.07 -0.05 0.00 -2.06 0.00 0.00 37.83 35.18 3a9t s LYS 110 CO 0.57 0.01 -0.02 0.00 0.10 0.00 0.00 175.35 176.02 3a9t s ALA 111 N -0.69 1.39 -0.01 0.59 0.00 -0.61 -0.78 121.76 121.65 3a9t s ALA 111 Ca -0.06 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.33 3a9t s ALA 111 Cb -0.05 0.45 0.01 0.00 0.00 0.00 0.00 23.12 23.53 3a9t s ALA 111 CO -0.00 -0.28 -0.04 0.08 0.00 0.00 0.00 175.76 175.52 3a9t s VAL 112 N -3.59 0.38 -0.20 0.00 1.01 0.67 -0.83 120.40 117.85 3a9t s VAL 112 Ca 0.23 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.07 3a9t s VAL 112 Cb 0.06 -0.36 0.04 0.00 0.00 0.00 0.00 36.38 36.11 3a9t s VAL 112 CO 0.03 0.14 -0.12 0.86 0.00 0.00 0.00 175.10 176.01 3a9t s TRP 113 N 0.24 2.53 -0.33 5.22 -0.00 0.10 -0.52 118.94 126.19 3a9t s TRP 113 Ca -0.02 -1.65 -0.11 0.00 -0.00 0.00 0.00 56.10 54.32 3a9t s TRP 113 Cb -0.06 -1.70 -0.00 0.00 -0.00 0.00 0.00 33.47 31.71 3a9t s TRP 113 CO -0.00 -0.76 0.19 0.20 -0.00 0.00 0.00 176.95 176.58 3a9t s GLY 114 N 1.36 1.91 0.19 5.86 0.00 -1.02 -2.08 107.32 113.53 3a9t s GLY 114 Ca -0.01 -1.45 -0.33 0.00 0.00 0.00 0.00 44.72 42.93 3a9t s GLY 114 CO -0.09 0.75 1.54 0.33 0.00 0.00 0.00 173.10 175.63 3a9t n PHE 115 N 5.02 2.29 -2.53 1.90 7.35 -0.02 -4.50 117.46 126.98 3a9t n PHE 115 Ca -0.13 0.30 -0.43 0.00 -0.76 0.00 0.00 57.45 56.43 3a9t n PHE 115 Cb 0.49 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.79 3a9t n PHE 115 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3a9t n ASN 116 N 3.04 4.90 -4.47 -2.13 2.85 -1.26 -3.94 115.26 114.25 3a9t n ASN 116 Ca 0.15 -2.96 -0.24 0.00 -0.11 0.00 0.00 54.58 51.42 3a9t n ASN 116 Cb 0.30 -1.62 -0.10 0.00 1.24 0.00 0.00 39.78 39.60 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 2.94 1.89 -0.15 8.20 0.00 -1.26 -0.89 107.32 118.05 3a9t s GLY 117 Ca 0.46 -1.89 0.18 0.00 0.00 0.00 0.00 44.72 43.48 3a9t s GLY 117 CO 0.01 -1.96 0.20 -1.30 0.00 0.00 0.00 173.10 170.05 3a9t n THR 118 N -0.62 1.16 0.24 0.90 -2.24 -1.26 -4.48 114.28 107.97 3a9t n THR 118 Ca -0.05 -0.79 0.09 0.00 -2.27 0.00 0.00 64.05 61.03 3a9t n THR 118 Cb 0.60 -0.42 0.63 0.00 -2.10 0.00 0.00 70.33 69.04 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 0.00 0.00 -4.89 -0.78 3.07 -1.95 -3.44 114.58 106.59 3a9t h GLU 119 Ca -0.43 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.13 3a9t h GLU 119 Cb 2.00 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 29.74 3a9t h GLU 119 CO 0.03 0.15 -0.72 1.03 -1.40 0.00 0.00 179.01 178.09 3a9t s ARG 120 N -4.43 0.85 -1.08 2.33 1.81 -1.26 -5.06 118.95 112.12 3a9t s ARG 120 Ca -0.03 -1.21 -0.08 0.00 -1.72 0.00 0.00 55.73 52.69 3a9t s ARG 120 Cb 0.14 -0.47 -0.12 0.00 -0.45 0.00 0.00 34.95 34.06 3a9t s ARG 120 CO 0.64 0.06 2.88 -2.30 -0.68 0.00 0.00 175.30 175.90 3a9t n PRO 121 N 0.40 2.91 -0.06 3.54 -0.02 -1.26 -4.62 135.00 135.89 3a9t n PRO 121 Ca -0.15 -1.72 -0.11 0.00 -2.02 0.00 0.00 63.50 59.50 3a9t n PRO 121 Cb 0.58 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.51 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 6.77 0.33 2.00 -1.23 0.00 -1.68 -1.91 103.07 107.35 3a9t h GLY 122 Ca 0.63 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 3a9t h GLY 122 CO 1.33 0.17 -0.09 0.00 0.00 0.00 0.00 176.54 177.96 3a9t h ALA 123 N 0.92 1.11 -0.00 3.60 0.00 -1.82 -1.89 119.26 121.17 3a9t h ALA 123 Ca 0.07 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 3a9t h ALA 123 Cb 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3a9t h ALA 123 CO -0.00 0.11 -0.90 0.28 0.00 0.00 0.00 179.25 178.74 3a9t h VAL 124 N 0.00 1.44 -0.19 0.00 2.07 -1.81 -2.64 116.25 115.13 3a9t h VAL 124 Ca -0.00 -2.50 -0.04 0.00 0.82 0.00 0.00 66.70 64.98 3a9t h VAL 124 Cb 0.42 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 3a9t h VAL 124 CO 0.01 0.74 -0.02 0.22 0.02 0.00 0.00 177.57 178.54 3a9t h TYR 125 N 0.18 0.39 -0.21 1.57 3.20 -0.58 -1.13 116.97 120.38 3a9t h TYR 125 Ca -0.06 -0.08 0.06 0.00 3.14 0.00 0.00 58.73 61.79 3a9t h TYR 125 Cb 1.52 -0.10 -0.07 0.00 1.54 0.00 0.00 36.73 39.63 3a9t h TYR 125 CO 0.04 0.58 -0.31 1.25 -1.64 0.00 0.00 178.16 178.08 3a9t h LEU 126 N 0.08 -1.00 -0.74 2.82 5.85 -1.42 0.50 115.31 121.41 3a9t h LEU 126 Ca 0.05 0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 3a9t h LEU 126 Cb 0.44 0.44 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 3a9t h LEU 126 CO 0.01 -0.34 0.15 0.00 -0.34 0.00 0.00 178.44 177.92 3a9t h ALA 127 N 0.54 0.96 -0.37 1.25 0.00 -1.47 -1.36 119.26 118.81 3a9t h ALA 127 Ca 0.12 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 3a9t h ALA 127 Cb 0.53 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3a9t h ALA 127 CO -0.40 0.66 -0.15 0.00 0.00 0.00 0.00 179.25 179.36 3a9t h ALA 128 N 1.10 0.52 -0.23 0.00 0.00 -0.46 -1.90 119.26 118.30 3a9t h ALA 128 Ca 0.22 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 3a9t h ALA 128 Cb 0.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3a9t h ALA 128 CO 0.01 0.43 -0.58 -0.24 0.00 0.00 0.00 179.25 178.87 3a9t h VAL 129 N 0.56 1.30 -0.85 0.00 3.04 0.01 -2.78 116.25 117.52 3a9t h VAL 129 Ca 0.09 -1.80 -0.00 0.00 -1.01 0.00 0.00 66.70 63.98 3a9t h VAL 129 Cb 0.69 1.73 -0.04 0.00 -2.01 0.00 0.00 31.29 31.66 3a9t h VAL 129 CO 0.05 0.57 0.52 -0.07 -1.01 0.00 0.00 177.57 177.63 3a9t h LEU 130 N 0.55 1.02 -1.14 3.16 3.38 -1.21 -0.03 115.31 121.05 3a9t h LEU 130 Ca 0.00 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.00 3a9t h LEU 130 Cb 1.16 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.59 3a9t h LEU 130 CO 0.12 0.78 0.60 0.00 0.09 0.00 0.00 178.44 180.03 3a9t h ALA 131 N 1.28 1.57 -0.55 1.53 0.00 -1.20 0.13 119.26 122.02 3a9t h ALA 131 Ca 0.31 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 3a9t h ALA 131 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3a9t h ALA 131 CO -0.06 0.26 -0.03 0.78 0.00 0.00 0.00 179.25 180.20 3a9t h GLY 132 N 0.97 1.05 1.48 0.00 0.00 -0.79 0.72 103.07 106.50 3a9t h GLY 132 Ca 0.42 -0.77 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 3a9t h GLY 132 CO -0.18 0.71 -0.33 -0.97 0.00 0.00 0.00 176.54 175.77 3a9t h TYR 133 N 0.89 0.67 -0.02 5.60 -1.99 0.43 -0.22 116.97 122.33 3a9t h TYR 133 Ca 0.16 -0.17 -0.18 0.00 2.00 0.00 0.00 58.73 60.54 3a9t h TYR 133 Cb 0.56 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 39.12 3a9t h TYR 133 CO 0.04 0.84 -0.78 -0.91 -0.00 0.00 0.00 178.16 177.35 3a9t h ASN 134 N 0.50 0.26 -0.01 3.88 2.35 -0.56 0.13 115.58 122.11 3a9t h ASN 134 Ca 0.06 -0.19 -0.23 0.00 -0.55 0.00 0.00 56.30 55.39 3a9t h ASN 134 Cb 0.81 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 39.11 3a9t h ASN 134 CO 0.07 0.93 -0.85 -0.61 -1.65 0.00 0.00 177.43 175.32 3a9t h GLN 135 N 0.13 0.69 -0.00 0.81 4.15 -0.64 -3.22 115.11 117.03 3a9t h GLN 135 Ca -0.03 -0.61 0.00 0.00 0.77 0.00 0.00 58.65 58.78 3a9t h GLN 135 Cb 1.36 0.14 0.00 0.00 0.21 0.00 0.00 27.48 29.19 3a9t h GLN 135 CO 0.12 1.22 -0.24 1.63 -1.93 0.00 0.00 178.83 179.62 3a9t n LYS 136 N -3.89 0.22 -1.97 1.69 5.02 -0.11 -4.95 118.16 114.17 3a9t n LYS 136 Ca -0.08 -0.09 -0.01 0.00 -2.02 0.00 0.00 58.31 56.11 3a9t n LYS 136 Cb 0.78 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 34.29 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 1.44 0.32 3.08 0.72 0.00 -0.62 -5.03 105.19 105.10 3a9t n GLY 137 Ca 0.09 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.39 5.11 0.24 0.99 1.43 0.34 -5.03 118.68 121.37 3a9t s LEU 138 Ca 0.00 -2.54 -0.29 0.00 -1.03 0.00 0.00 54.13 50.27 3a9t s LEU 138 Cb 0.00 -1.81 -0.15 0.00 0.03 0.00 0.00 46.19 44.26 3a9t s LEU 138 CO 0.00 -0.42 0.86 -2.65 0.23 0.00 0.00 176.35 174.37 3a9t n PRO 139 N 3.88 0.82 -3.62 1.29 -0.02 -1.26 -4.56 135.00 131.54 3a9t n PRO 139 Ca 0.04 0.29 -0.14 0.00 -2.02 0.00 0.00 63.50 61.66 3a9t n PRO 139 Cb 0.39 -1.55 -0.07 0.00 -0.02 0.00 0.00 33.50 32.25 3a9t n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9t s ALA 140 N -0.91 -1.79 0.26 3.55 0.00 -1.26 -4.46 121.76 117.15 3a9t s ALA 140 Ca 0.63 1.93 -0.12 0.00 0.00 0.00 0.00 51.96 54.40 3a9t s ALA 140 Cb -0.81 -1.04 -0.08 0.00 0.00 0.00 0.00 23.12 21.19 3a9t s ALA 140 CO 0.58 -0.34 0.62 -0.06 0.00 0.00 0.00 175.76 176.56 3a9t s PHE 141 N 0.16 3.43 -0.10 0.00 0.40 0.04 -1.71 117.98 120.19 3a9t s PHE 141 Ca -0.01 1.03 0.03 0.00 -0.60 0.00 0.00 56.93 57.37 3a9t s PHE 141 Cb -0.04 -2.38 -0.01 0.00 0.51 0.00 0.00 43.02 41.10 3a9t s PHE 141 CO 0.02 0.22 -0.19 0.20 0.70 0.00 0.00 175.22 176.17 3a9t s GLY 142 N -2.26 1.43 -0.17 4.36 0.00 -1.26 -0.24 107.32 109.18 3a9t s GLY 142 Ca 0.49 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 44.27 3a9t s GLY 142 CO 0.20 -0.35 -0.14 -0.42 0.00 0.00 0.00 173.10 172.39 3a9t s ILE 143 N 0.20 1.70 -0.11 0.90 1.01 0.32 -4.95 121.20 120.27 3a9t s ILE 143 Ca -0.11 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 3a9t s ILE 143 Cb -0.16 -1.65 0.03 0.00 0.01 0.00 0.00 42.46 40.69 3a9t s ILE 143 CO 0.06 0.36 -0.02 -0.47 0.00 0.00 0.00 174.94 174.87 3a9t s TYR 144 N 1.41 1.05 0.62 3.97 5.04 -1.26 -2.44 117.35 125.73 3a9t s TYR 144 Ca 0.02 -0.51 -0.17 0.00 -2.44 0.00 0.00 57.07 53.97 3a9t s TYR 144 Cb -0.14 -1.00 -0.02 0.00 0.35 0.00 0.00 41.96 41.15 3a9t s TYR 144 CO -0.10 -0.45 1.17 0.20 -1.34 0.00 0.00 175.55 175.03 3a9t s GLY 145 N 1.85 2.51 0.10 8.97 0.00 -1.26 -4.93 107.32 114.56 3a9t s GLY 145 Ca 0.04 0.85 0.25 0.00 0.00 0.00 0.00 44.72 45.85 3a9t s GLY 145 CO -0.07 1.23 1.39 0.58 0.00 0.00 0.00 173.10 176.23 3a9t n LYS 146 N -1.93 0.23 -4.36 2.90 2.85 -1.26 -4.83 118.16 111.75 3a9t n LYS 146 Ca 0.12 0.08 -0.33 0.00 -1.05 0.00 0.00 58.31 57.13 3a9t n LYS 146 Cb 0.50 -1.66 -0.16 0.00 -0.65 0.00 0.00 35.03 33.07 3a9t n LYS 146 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3a9t s ASP 147 N -4.00 3.26 -0.05 -5.58 1.01 -1.26 -5.08 116.67 104.97 3a9t s ASP 147 Ca 0.08 -0.60 -0.35 0.00 0.71 0.00 0.00 52.55 52.39 3a9t s ASP 147 Cb 0.14 -1.49 -0.13 0.00 1.01 0.00 0.00 42.92 42.45 3a9t s ASP 147 CO 0.70 0.04 1.78 0.52 0.21 0.00 0.00 175.17 178.42 3a9t n VAL 148 N 4.36 0.41 -3.99 -1.27 0.31 -1.26 -4.86 118.33 112.02 3a9t n VAL 148 Ca -0.20 -0.07 -0.27 0.00 -0.01 0.00 0.00 64.34 63.78 3a9t n VAL 148 Cb 0.51 -1.69 -0.04 0.00 -0.91 0.00 0.00 33.84 31.71 3a9t n VAL 148 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3a9t s GLN 149 N 3.22 3.22 0.47 5.55 -0.21 -0.07 -5.04 119.66 126.80 3a9t s GLN 149 Ca 0.90 -0.67 -0.17 0.00 0.02 0.00 0.00 55.36 55.44 3a9t s GLN 149 Cb -0.74 -2.85 -0.09 0.00 1.00 0.00 0.00 33.01 30.33 3a9t s GLN 149 CO 0.50 0.53 0.94 -0.51 -2.12 0.00 0.00 175.29 174.63 3a9t s ASP 150 N -3.02 6.72 0.05 5.90 1.01 -1.26 -4.42 116.67 121.65 3a9t s ASP 150 Ca 0.33 1.56 -0.35 0.00 0.71 0.00 0.00 52.55 54.80 3a9t s ASP 150 Cb -0.11 -2.50 -0.14 0.00 1.01 0.00 0.00 42.92 41.18 3a9t s ASP 150 CO 0.26 -0.48 1.62 0.00 0.21 0.00 0.00 175.17 176.78 3a9t n ALA 151 N -1.21 0.71 0.00 5.23 0.00 -1.26 -1.61 120.51 122.38 3a9t n ALA 151 Ca 0.06 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.92 3a9t n ALA 151 Cb 0.54 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.66 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 3.56 2.57 3.68 0.00 0.00 -1.26 -5.01 105.19 108.72 3a9t n GLY 152 Ca 0.19 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.71 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 2.94 0.01 1.61 -0.08 -0.63 -4.82 116.55 115.58 3a9t n ASP 153 Ca 0.00 1.03 0.11 0.00 -1.51 0.00 0.00 54.79 54.42 3a9t n ASP 153 Cb 0.00 -1.31 0.06 0.00 2.34 0.00 0.00 41.12 42.21 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 4.41 0.05 -2.31 5.18 -2.24 -1.26 -4.92 114.28 113.20 3a9t n THR 154 Ca 0.22 -0.08 -0.37 0.00 -2.27 0.00 0.00 64.05 61.55 3a9t n THR 154 Cb 0.24 0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.93 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 -3.30 6.33 -0.24 3.42 0.02 -1.26 -4.95 114.94 114.96 3a9t s ASN 155 Ca 0.08 2.27 -0.06 0.00 -1.02 0.00 0.00 52.86 54.13 3a9t s ASN 155 Cb 0.16 -2.60 -0.02 0.00 0.02 0.00 0.00 41.25 38.81 3a9t s ASN 155 CO 0.79 -0.80 0.03 -0.63 0.02 0.00 0.00 177.10 176.51 3a9t s ILE 156 N -1.54 4.01 0.97 0.60 1.01 -1.26 -5.09 121.20 119.91 3a9t s ILE 156 Ca 0.61 -0.28 -0.13 0.00 0.00 0.00 0.00 60.65 60.85 3a9t s ILE 156 Cb -0.28 -2.86 0.05 0.00 0.01 0.00 0.00 42.46 39.38 3a9t s ILE 156 CO 0.34 0.37 0.38 -2.65 0.00 0.00 0.00 174.94 173.39 3a9t n PRO 157 N 4.81 -0.49 -0.05 2.79 -0.02 -1.26 -4.70 135.00 136.08 3a9t n PRO 157 Ca -0.17 -0.10 -0.08 0.00 -2.02 0.00 0.00 63.50 61.13 3a9t n PRO 157 Cb 0.51 -1.85 0.10 0.00 -0.02 0.00 0.00 33.50 32.23 3a9t n PRO 157 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3a9t h GLU 158 N -1.65 0.69 -0.07 -0.52 4.39 -1.99 -1.05 114.58 114.39 3a9t h GLU 158 Ca -0.45 -0.31 -0.11 0.00 0.34 0.00 0.00 59.36 58.83 3a9t h GLU 158 Cb 1.29 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.91 3a9t h GLU 158 CO 0.35 0.91 -0.46 0.38 -1.16 0.00 0.00 179.01 179.03 3a9t h ASP 159 N 0.59 0.17 -0.06 1.42 -0.00 -1.99 -2.01 116.42 114.53 3a9t h ASP 159 Ca 0.07 -0.07 -0.16 0.00 -0.00 0.00 0.00 57.03 56.87 3a9t h ASP 159 Cb 0.80 -0.05 0.01 0.00 -0.00 0.00 0.00 39.33 40.10 3a9t h ASP 159 CO 0.07 0.61 -0.58 0.58 -0.00 0.00 0.00 179.24 179.92 3a9t h VAL 160 N 0.13 1.38 -0.05 4.15 2.07 -1.88 -3.08 116.25 118.96 3a9t h VAL 160 Ca 0.01 -1.94 0.03 0.00 0.82 0.00 0.00 66.70 65.62 3a9t h VAL 160 Cb 0.87 2.33 -0.04 0.00 -1.52 0.00 0.00 31.29 32.93 3a9t h VAL 160 CO 0.07 0.58 -0.18 0.11 0.02 0.00 0.00 177.57 178.17 3a9t h LYS 161 N 0.07 -0.26 -0.77 1.57 1.57 -1.03 -0.10 116.57 117.62 3a9t h LYS 161 Ca -0.05 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 58.86 3a9t h LYS 161 Cb 1.24 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.53 3a9t h LYS 161 CO 0.12 -0.17 0.38 1.49 -0.57 0.00 0.00 179.45 180.69 3a9t h GLU 162 N -0.26 0.57 -0.33 3.15 4.81 -1.44 0.12 114.58 121.20 3a9t h GLU 162 Ca 0.07 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.15 3a9t h GLU 162 Cb 0.37 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3a9t h GLU 162 CO -0.21 0.38 -0.27 0.87 -0.73 0.00 0.00 179.01 179.05 3a9t h LYS 163 N 0.59 0.77 -0.08 1.92 1.57 -1.34 -1.13 116.57 118.86 3a9t h LYS 163 Ca 0.40 -0.38 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3a9t h LYS 163 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 3a9t h LYS 163 CO -0.33 1.01 0.04 -0.07 -0.57 0.00 0.00 179.45 179.53 3a9t h LEU 164 N 0.54 0.11 -0.61 2.94 3.38 -0.39 -1.19 115.31 120.10 3a9t h LEU 164 Ca 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3a9t h LEU 164 Cb 0.84 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 3a9t h LEU 164 CO 0.07 0.23 0.32 0.40 0.09 0.00 0.00 178.44 179.54 3a9t h ILE 165 N -0.01 1.20 -0.22 1.22 2.04 -0.77 -0.14 117.51 120.84 3a9t h ILE 165 Ca 0.03 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3a9t h ILE 165 Cb 0.15 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3a9t h ILE 165 CO -0.00 0.22 0.05 -0.09 0.00 0.00 0.00 178.15 178.33 3a9t h ARG 166 N 0.82 0.35 -0.14 2.37 2.43 -1.15 -0.60 114.38 118.46 3a9t h ARG 166 Ca 0.21 -0.09 0.03 0.00 -0.81 0.00 0.00 59.98 59.33 3a9t h ARG 166 Cb 0.07 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3a9t h ARG 166 CO -0.03 0.47 -0.07 0.35 -1.51 0.00 0.00 179.97 179.18 3a9t h PHE 167 N 0.16 -0.17 0.02 2.20 3.57 -0.98 -0.11 116.94 121.64 3a9t h PHE 167 Ca 0.07 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3a9t h PHE 167 Cb 0.29 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 3a9t h PHE 167 CO 0.01 -0.11 -0.13 0.00 -2.23 0.00 0.00 178.31 175.85 3a9t h ALA 168 N 1.07 -0.17 -0.24 2.41 0.00 -0.87 0.65 119.26 122.12 3a9t h ALA 168 Ca 0.08 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3a9t h ALA 168 Cb 0.18 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3a9t h ALA 168 CO -0.18 -0.63 0.04 0.87 0.00 0.00 0.00 179.25 179.34 3a9t h LYS 169 N -0.24 0.12 -0.07 0.00 1.57 -0.86 0.17 116.57 117.26 3a9t h LYS 169 Ca 0.04 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3a9t h LYS 169 Cb 0.28 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 3a9t h LYS 169 CO -0.12 0.08 0.03 0.00 -0.57 0.00 0.00 179.45 178.87 3a9t h ALA 170 N 1.18 0.10 -0.65 3.86 0.00 -0.71 -1.41 119.26 121.62 3a9t h ALA 170 Ca 0.11 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.99 3a9t h ALA 170 Cb 0.11 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 3a9t h ALA 170 CO -0.15 -0.32 0.36 0.78 0.00 0.00 0.00 179.25 179.92 3a9t h GLY 171 N -0.03 0.95 1.26 0.00 0.00 0.56 -2.17 103.07 103.64 3a9t h GLY 171 Ca 0.02 -0.25 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 3a9t h GLY 171 CO -0.00 0.15 0.07 -2.00 0.00 0.00 0.00 176.54 174.77 3a9t h LEU 172 N 0.67 0.87 -0.82 3.11 5.85 -0.51 -0.67 115.31 123.80 3a9t h LEU 172 Ca 0.29 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3a9t h LEU 172 Cb 0.18 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3a9t h LEU 172 CO -0.18 0.89 0.43 0.00 -0.34 0.00 0.00 178.44 179.24 3a9t h ALA 173 N 1.22 1.06 -0.19 1.25 0.00 -0.80 -0.17 119.26 121.63 3a9t h ALA 173 Ca 0.17 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3a9t h ALA 173 Cb 0.40 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3a9t h ALA 173 CO 0.01 0.59 -0.01 0.28 0.00 0.00 0.00 179.25 180.12 3a9t h VAL 174 N 1.15 1.26 -0.92 0.00 2.07 -1.01 -2.97 116.25 115.83 3a9t h VAL 174 Ca 0.29 -0.89 0.02 0.00 0.82 0.00 0.00 66.70 66.94 3a9t h VAL 174 Cb 0.06 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.26 3a9t h VAL 174 CO -0.04 0.27 0.61 0.00 0.02 0.00 0.00 177.57 178.43 3a9t h ALA 175 N 0.77 1.36 -0.85 1.67 0.00 -0.83 -2.81 119.26 118.58 3a9t h ALA 175 Ca 0.05 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3a9t h ALA 175 Cb 0.41 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 3a9t h ALA 175 CO 0.01 0.58 0.56 0.52 0.00 0.00 0.00 179.25 180.91 3a9t h MET 176 N 1.22 0.87 -0.01 0.00 2.86 -0.87 -2.96 114.93 116.04 3a9t h MET 176 Ca 0.35 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 57.76 3a9t h MET 176 Cb -0.10 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.35 3a9t h MET 176 CO -0.08 0.58 -0.78 0.52 1.06 0.00 0.00 176.91 178.21 3a9t h MET 177 N 0.90 0.11 -6.57 1.72 2.86 -1.43 -3.44 114.93 109.08 3a9t h MET 177 Ca 0.38 -0.11 -0.57 0.00 -2.06 0.00 0.00 59.70 57.34 3a9t h MET 177 Cb 0.30 0.03 0.07 0.00 0.06 0.00 0.00 31.60 32.06 3a9t h MET 177 CO -0.15 0.83 0.77 1.63 1.06 0.00 0.00 176.91 181.05 3a9t n LYS 178 N -3.69 2.22 0.00 1.72 5.02 -1.12 -1.73 118.16 120.58 3a9t n LYS 178 Ca -0.02 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 3a9t n LYS 178 Cb 0.74 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.21 3a9t n LYS 178 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a9t n GLY 179 N 2.98 2.58 3.92 0.72 0.00 0.56 -4.99 105.19 110.96 3a9t n GLY 179 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.19 2.75 0.16 1.61 -0.14 -0.71 -4.74 119.74 118.48 3a9t s LYS 180 Ca 0.00 -0.03 0.09 0.00 -1.36 0.00 0.00 55.97 54.67 3a9t s LYS 180 Cb 0.00 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.88 3a9t s LYS 180 CO 0.00 -0.85 -0.14 -1.12 -0.76 0.00 0.00 175.35 172.49 3a9t s SER 181 N -4.36 4.06 -0.21 2.83 0.01 -0.81 -0.70 113.70 114.53 3a9t s SER 181 Ca 0.56 -0.60 -0.06 0.00 1.31 0.00 0.00 55.95 57.15 3a9t s SER 181 Cb -0.11 -0.62 -0.03 0.00 0.21 0.00 0.00 66.02 65.47 3a9t s SER 181 CO 0.46 0.13 0.03 -0.47 0.41 0.00 0.00 173.24 173.79 3a9t s TYR 182 N -1.54 3.10 -0.32 2.43 5.04 -0.28 -2.54 117.35 123.23 3a9t s TYR 182 Ca 0.22 -0.30 -0.12 0.00 -2.44 0.00 0.00 57.07 54.44 3a9t s TYR 182 Cb -0.09 -2.12 -0.02 0.00 0.35 0.00 0.00 41.96 40.08 3a9t s TYR 182 CO 0.13 -0.16 0.21 -1.17 -1.34 0.00 0.00 175.55 173.22 3a9t s LEU 183 N 0.97 4.34 -0.32 6.97 2.96 -0.58 -1.46 118.68 131.56 3a9t s LEU 183 Ca 0.03 -0.41 -0.18 0.00 -0.22 0.00 0.00 54.13 53.35 3a9t s LEU 183 Cb -0.14 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.44 3a9t s LEU 183 CO 0.02 -0.20 0.51 -0.55 -1.32 0.00 0.00 176.35 174.81 3a9t s SER 184 N 1.69 6.35 -0.40 3.68 0.15 0.38 -1.51 113.70 124.04 3a9t s SER 184 Ca 0.06 0.16 -0.08 0.00 0.70 0.00 0.00 55.95 56.79 3a9t s SER 184 Cb -0.17 -2.27 0.07 0.00 -1.71 0.00 0.00 66.02 61.94 3a9t s SER 184 CO 0.09 -0.41 0.22 -0.63 1.20 0.00 0.00 173.24 173.71 3a9t s ILE 185 N 2.37 4.02 0.00 6.45 1.01 -0.64 -1.33 121.20 133.08 3a9t s ILE 185 Ca 0.20 -1.42 0.00 0.00 0.00 0.00 0.00 60.65 59.42 3a9t s ILE 185 Cb -0.15 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.86 3a9t s ILE 185 CO 0.12 -0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.21 3a9t n GLY 186 N 4.86 -1.81 0.00 6.18 0.00 -0.20 -0.95 105.19 113.27 3a9t n GLY 186 Ca -0.10 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.93 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 0.03 0.00 -4.74 1.61 2.88 -1.26 -4.78 113.62 107.35 3a9t n SER 187 Ca 0.00 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.17 3a9t n SER 187 Cb 0.00 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.51 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 2.78 2.20 -0.21 2.46 1.01 -1.26 -4.58 120.40 122.81 3a9t s VAL 188 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.12 3a9t s VAL 188 Cb 0.00 -3.06 0.03 0.00 0.00 0.00 0.00 36.38 33.35 3a9t s VAL 188 CO 0.00 -0.02 -0.15 -0.55 0.00 0.00 0.00 175.10 174.38 3a9t s SER 189 N -1.27 3.68 -1.69 3.32 0.15 -1.26 -4.79 113.70 111.84 3a9t s SER 189 Ca 0.77 -0.83 -0.14 0.00 0.70 0.00 0.00 55.95 56.45 3a9t s SER 189 Cb -0.37 -1.54 0.13 0.00 -1.71 0.00 0.00 66.02 62.53 3a9t s SER 189 CO 0.41 -0.06 0.53 0.23 1.20 0.00 0.00 173.24 175.55 3a9t n MET 190 N 4.60 -2.02 -1.51 5.44 2.81 -1.26 -1.07 117.12 124.10 3a9t n MET 190 Ca -0.19 0.25 -0.18 0.00 -1.81 0.00 0.00 57.70 55.78 3a9t n MET 190 Cb 0.48 -4.61 -0.08 0.00 -0.71 0.00 0.00 33.22 28.30 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 -1.61 1.73 3.63 3.03 0.00 -1.26 -4.94 105.19 105.76 3a9t n GLY 191 Ca -0.05 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 3a9t n GLY 191 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a9t s ILE 192 N -2.63 3.99 0.42 -0.61 1.01 -0.24 -4.91 121.20 118.24 3a9t s ILE 192 Ca 0.00 1.12 0.22 0.00 0.00 0.00 0.00 60.65 61.99 3a9t s ILE 192 Cb 0.00 -4.00 0.42 0.00 0.01 0.00 0.00 42.46 38.90 3a9t s ILE 192 CO 0.00 -0.40 1.77 0.00 0.00 0.00 0.00 174.94 176.31 3a9t h ALA 193 N 9.75 2.41 0.00 9.38 0.00 -1.92 0.13 119.26 139.01 3a9t h ALA 193 Ca -0.29 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3a9t h ALA 193 Cb 1.12 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3a9t h ALA 193 CO 1.02 -0.81 0.00 0.41 0.00 0.00 0.00 179.25 179.87 3a9t n GLY 194 N -1.52 -1.17 0.53 0.00 0.00 -1.26 -2.70 105.19 99.06 3a9t n GLY 194 Ca 0.26 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.34 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 -1.47 1.64 -4.73 1.61 3.41 0.47 -1.84 113.62 112.71 3a9t n SER 195 Ca 0.06 -1.55 -0.39 0.00 -0.26 0.00 0.00 58.87 56.72 3a9t n SER 195 Cb 0.23 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.12 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 -1.99 5.01 -0.37 -3.33 1.01 -1.10 -4.13 120.40 115.51 3a9t s VAL 196 Ca 0.37 1.30 -0.20 0.00 0.00 0.00 0.00 61.98 63.45 3a9t s VAL 196 Cb 0.21 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.62 3a9t s VAL 196 CO 0.33 0.33 0.60 -0.69 0.00 0.00 0.00 175.10 175.66 3a9t s VAL 197 N 0.40 4.92 -0.65 2.92 1.01 -1.26 -4.90 120.40 122.83 3a9t s VAL 197 Ca 0.33 0.39 -0.13 0.00 0.00 0.00 0.00 61.98 62.58 3a9t s VAL 197 Cb -0.18 -4.07 0.17 0.00 0.00 0.00 0.00 36.38 32.30 3a9t s VAL 197 CO 0.17 -0.34 0.58 -1.10 0.00 0.00 0.00 175.10 174.40 3a9t s GLN 198 N 2.62 3.12 0.44 2.72 -0.21 -1.26 -4.93 119.66 122.16 3a9t s GLN 198 Ca 0.22 -2.10 0.19 0.00 0.02 0.00 0.00 55.36 53.69 3a9t s GLN 198 Cb -0.15 -4.25 1.13 0.00 1.00 0.00 0.00 33.01 30.75 3a9t s GLN 198 CO 0.15 -1.28 1.90 0.93 -2.12 0.00 0.00 175.29 174.87 3a9t h GLU 199 N 8.21 0.33 -0.90 2.91 5.08 -2.00 -1.73 114.58 126.47 3a9t h GLU 199 Ca -0.10 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 199 Cb 1.06 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.15 3a9t h GLU 199 CO 0.87 0.22 0.52 -0.44 -1.00 0.00 0.00 179.01 179.18 3a9t h ASP 200 N 0.34 0.73 0.86 1.42 5.19 -1.98 0.55 116.42 123.53 3a9t h ASP 200 Ca 0.41 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.84 3a9t h ASP 200 Cb 1.07 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 40.51 3a9t h ASP 200 CO -0.12 0.37 -0.41 0.15 -3.12 0.00 0.00 179.24 176.11 3a9t h PHE 201 N 0.81 -1.07 -0.67 4.55 3.57 -1.73 0.20 116.94 122.60 3a9t h PHE 201 Ca 0.46 -0.03 0.10 0.00 3.53 0.00 0.00 57.97 62.04 3a9t h PHE 201 Cb 0.51 0.35 -0.08 0.00 2.79 0.00 0.00 35.95 39.53 3a9t h PHE 201 CO -0.05 -0.67 0.28 0.74 -2.23 0.00 0.00 178.31 176.39 3a9t h PHE 202 N -1.30 0.49 0.02 0.41 0.04 -1.55 0.89 116.94 115.94 3a9t h PHE 202 Ca -0.12 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.68 3a9t h PHE 202 Cb 0.89 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 38.92 3a9t h PHE 202 CO 0.00 0.13 -0.01 0.37 -0.60 0.00 0.00 178.31 178.20 3a9t h GLN 203 N 0.47 -0.03 0.08 1.51 4.15 -0.88 0.25 115.11 120.67 3a9t h GLN 203 Ca 0.34 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 59.48 3a9t h GLN 203 Cb 0.43 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 3a9t h GLN 203 CO -0.32 0.48 -1.47 -0.91 -1.93 0.00 0.00 178.83 174.69 3a9t h ASN 204 N -0.55 0.28 0.31 -0.69 2.35 -0.50 -2.73 115.58 114.06 3a9t h ASN 204 Ca -0.00 -0.39 -0.32 0.00 -0.55 0.00 0.00 56.30 55.03 3a9t h ASN 204 Cb 0.52 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.76 3a9t h ASN 204 CO 0.00 1.32 -1.91 -1.22 -1.65 0.00 0.00 177.43 173.98 3a9t n TYR 205 N -3.39 0.88 0.27 1.19 4.02 0.29 -4.58 117.16 115.85 3a9t n TYR 205 Ca -0.14 0.27 0.04 0.00 -0.01 0.00 0.00 57.90 58.06 3a9t n TYR 205 Cb 1.03 -1.15 -0.05 0.00 -0.02 0.00 0.00 39.34 39.15 3a9t n TYR 205 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3a9t n LEU 206 N -3.12 0.28 -2.03 7.72 4.77 -1.09 -4.91 117.00 118.61 3a9t n LEU 206 Ca -0.24 -0.38 -0.15 0.00 -0.03 0.00 0.00 56.01 55.21 3a9t n LEU 206 Cb 1.06 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.17 3a9t n LEU 206 CO 0.43 0.07 -0.04 0.61 -1.33 0.00 0.00 177.39 177.13 3a9t n GLY 207 N 1.39 -0.16 3.85 -0.72 0.00 -0.05 -3.63 105.19 105.87 3a9t n GLY 207 Ca 0.01 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 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 -5.20 2.73 0.26 1.61 1.00 0.68 -0.32 119.30 120.07 3a9t s MET 208 Ca 0.16 -1.28 0.07 0.00 0.00 0.00 0.00 55.69 54.64 3a9t s MET 208 Cb -0.07 -2.48 -0.03 0.00 0.00 0.00 0.00 34.83 32.24 3a9t s MET 208 CO 0.20 0.11 0.21 1.03 0.00 0.00 0.00 175.02 176.57 3a9t s ARG 209 N -3.99 2.89 -0.16 2.03 0.52 0.13 -3.62 118.95 116.75 3a9t s ARG 209 Ca 0.40 -1.09 0.01 0.00 -0.52 0.00 0.00 55.73 54.53 3a9t s ARG 209 Cb -0.06 -2.55 0.02 0.00 0.52 0.00 0.00 34.95 32.88 3a9t s ARG 209 CO 0.26 0.36 -0.17 -0.80 0.02 0.00 0.00 175.30 174.98 3a9t s ASN 210 N -3.86 2.90 -0.06 0.23 0.01 -1.26 -1.13 114.94 111.77 3a9t s ASN 210 Ca 0.34 -0.57 0.03 0.00 -0.71 0.00 0.00 52.86 51.95 3a9t s ASN 210 Cb -0.08 -1.32 -0.03 0.00 0.41 0.00 0.00 41.25 40.24 3a9t s ASN 210 CO 0.25 -0.03 -0.12 -1.61 -1.51 0.00 0.00 177.10 174.08 3a9t s GLU 211 N 1.40 2.60 -0.02 -0.60 0.41 -0.54 -4.97 118.70 116.98 3a9t s GLU 211 Ca 0.05 -0.66 0.05 0.00 -0.41 0.00 0.00 54.97 54.00 3a9t s GLU 211 Cb -0.13 -2.44 -0.01 0.00 -1.78 0.00 0.00 34.13 29.77 3a9t s GLU 211 CO -0.12 0.62 -0.18 0.71 -0.49 0.00 0.00 175.26 175.80 3a9t s TYR 212 N -0.71 1.62 -0.16 1.61 1.51 -1.26 -0.47 117.35 119.50 3a9t s TYR 212 Ca 0.11 -0.35 -0.07 0.00 -1.01 0.00 0.00 57.07 55.75 3a9t s TYR 212 Cb -0.11 -1.06 0.07 0.00 -0.11 0.00 0.00 41.96 40.75 3a9t s TYR 212 CO 0.01 -0.06 0.35 0.54 -1.11 0.00 0.00 175.55 175.27 3a9t s VAL 213 N -0.30 -0.32 0.56 0.71 0.11 -0.44 -4.98 120.40 115.75 3a9t s VAL 213 Ca 0.04 0.17 -0.19 0.00 -2.93 0.00 0.00 61.98 59.07 3a9t s VAL 213 Cb -0.08 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.17 3a9t s VAL 213 CO 0.00 0.07 1.15 -0.62 -3.33 0.00 0.00 175.10 172.37 3a9t s ASP 214 N 2.01 5.57 0.55 3.54 -1.08 -1.26 -1.03 116.67 124.97 3a9t s ASP 214 Ca -0.04 2.22 0.37 0.00 -0.52 0.00 0.00 52.55 54.58 3a9t s ASP 214 Cb -0.11 -2.58 1.85 0.00 -1.46 0.00 0.00 42.92 40.62 3a9t s ASP 214 CO -0.11 -1.33 2.11 0.24 0.52 0.00 0.00 175.17 176.61 3a9t h MET 215 N 1.08 0.00 0.00 4.34 2.86 -1.90 -2.07 114.93 119.24 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 0.56 0.00 0.01 0.66 1.06 0.00 0.00 176.91 179.21 3a9t h SER 216 N 0.00 0.00 -0.76 1.22 4.64 -2.01 0.13 113.55 116.77 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 0.17 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.23 3a9t h SER 216 CO 0.00 0.00 0.37 -0.08 -0.87 0.00 0.00 176.83 176.25 3a9t h GLU 217 N 0.00 1.11 -0.30 4.77 4.57 -1.74 -1.32 114.58 121.66 3a9t h GLU 217 Ca 0.00 -0.16 -0.05 0.00 -1.18 0.00 0.00 59.36 57.98 3a9t h GLU 217 Cb 0.03 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 3a9t h GLU 217 CO 0.00 0.85 -0.02 0.74 -1.18 0.00 0.00 179.01 179.40 3a9t h PHE 218 N 1.10 0.48 -0.39 0.92 -1.00 -0.95 -1.66 116.94 115.44 3a9t h PHE 218 Ca 0.27 -0.05 -0.11 0.00 2.81 0.00 0.00 57.97 60.90 3a9t h PHE 218 Cb 0.11 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.51 3a9t h PHE 218 CO 0.01 0.50 -0.19 0.28 -1.61 0.00 0.00 178.31 177.30 3a9t h VAL 219 N 0.45 1.27 -0.26 -0.55 2.07 -1.30 -2.44 116.25 115.49 3a9t h VAL 219 Ca 0.10 -1.27 -0.14 0.00 0.82 0.00 0.00 66.70 66.21 3a9t h VAL 219 Cb 0.33 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3a9t h VAL 219 CO 0.01 0.42 -0.38 -0.09 0.02 0.00 0.00 177.57 177.56 3a9t h ARG 220 N 0.66 0.72 0.00 1.57 2.43 -0.64 -2.25 114.38 116.86 3a9t h ARG 220 Ca 0.10 -0.42 -0.13 0.00 -0.81 0.00 0.00 59.98 58.71 3a9t h ARG 220 Cb 0.68 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.24 3a9t h ARG 220 CO 0.05 1.05 -0.64 0.00 -1.51 0.00 0.00 179.97 178.91 3a9t h ARG 221 N 0.45 0.00 0.22 0.20 3.08 -1.32 -1.53 114.38 115.48 3a9t h ARG 221 Ca 0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3a9t h ARG 221 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 3a9t h ARG 221 CO 0.09 0.64 -0.10 0.82 -1.07 0.00 0.00 179.97 180.35 3a9t h ILE 222 N 0.00 0.75 -0.92 2.04 2.04 -1.46 0.72 117.51 120.68 3a9t h ILE 222 Ca -0.01 -0.95 0.05 0.00 1.00 0.00 0.00 64.86 64.95 3a9t h ILE 222 Cb 1.19 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 38.43 3a9t h ILE 222 CO 0.08 0.18 0.59 -0.33 0.00 0.00 0.00 178.15 178.67 3a9t h GLU 223 N -0.85 1.08 -0.01 2.37 4.39 -1.43 -2.38 114.58 117.74 3a9t h GLU 223 Ca -0.03 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.61 3a9t h GLU 223 Cb 0.51 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 3a9t h GLU 223 CO 0.05 0.71 -0.19 1.28 -1.16 0.00 0.00 179.01 179.70 3a9t n LEU 224 N -4.54 1.19 -1.96 1.33 4.77 -0.58 -4.96 117.00 112.26 3a9t n LEU 224 Ca 0.13 -0.34 -0.12 0.00 -0.03 0.00 0.00 56.01 55.64 3a9t n LEU 224 Cb 0.14 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 3a9t n LEU 224 CO 0.33 0.21 0.08 0.61 -1.33 0.00 0.00 177.39 177.29 3a9t n GLY 225 N 1.30 0.12 3.35 -0.72 0.00 0.01 -4.94 105.19 104.30 3a9t n GLY 225 Ca 0.14 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.86 4.09 -3.62 -0.61 5.41 0.23 -4.83 119.36 116.17 3a9t n ILE 226 Ca -0.02 -4.31 0.00 0.00 1.00 0.00 0.00 62.75 59.42 3a9t n ILE 226 Cb 0.55 -2.43 -0.01 0.00 -0.71 0.00 0.00 39.64 37.04 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 2.44 -0.06 -0.50 1.39 -0.85 -1.26 -4.83 117.35 113.68 3a9t s TYR 227 Ca 0.47 -0.03 -0.28 0.00 -0.52 0.00 0.00 57.07 56.70 3a9t s TYR 227 Cb 0.03 0.54 -0.00 0.00 0.38 0.00 0.00 41.96 42.90 3a9t s TYR 227 CO 0.02 -0.26 1.63 0.34 -1.52 0.00 0.00 175.55 175.76 3a9t s ASP 228 N -2.82 5.86 0.41 -0.18 -1.08 -1.26 -4.87 116.67 112.73 3a9t s ASP 228 Ca 0.13 0.63 0.17 0.00 -0.52 0.00 0.00 52.55 52.96 3a9t s ASP 228 Cb 0.04 -2.54 0.91 0.00 -1.46 0.00 0.00 42.92 39.87 3a9t s ASP 228 CO -0.04 -1.86 1.88 0.11 0.52 0.00 0.00 175.17 175.78 3a9t h LYS 229 N 12.54 0.00 -0.19 4.34 1.57 -1.99 -0.89 116.57 131.94 3a9t h LYS 229 Ca -0.28 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.35 3a9t h LYS 229 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 3a9t h LYS 229 CO 1.14 0.30 -0.47 0.93 -0.57 0.00 0.00 179.45 180.78 3a9t h GLU 230 N 0.00 0.65 -0.58 3.15 3.07 -2.01 -2.66 114.58 116.21 3a9t h GLU 230 Ca -0.00 -0.45 -0.04 0.00 -0.50 0.00 0.00 59.36 58.37 3a9t h GLU 230 Cb 0.60 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.55 3a9t h GLU 230 CO 0.04 1.07 0.20 1.49 -1.40 0.00 0.00 179.01 180.40 3a9t h GLU 231 N 0.34 0.89 -0.11 2.33 4.81 -1.90 -2.72 114.58 118.22 3a9t h GLU 231 Ca -0.01 -0.18 0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3a9t h GLU 231 Cb 1.08 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.27 3a9t h GLU 231 CO 0.10 0.79 -0.24 -0.92 -0.73 0.00 0.00 179.01 178.01 3a9t h TYR 232 N 0.81 -0.64 -0.93 0.92 5.03 -1.09 0.93 116.97 122.00 3a9t h TYR 232 Ca 0.19 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.56 3a9t h TYR 232 Cb 0.26 0.30 -0.05 0.00 1.55 0.00 0.00 36.73 38.78 3a9t h TYR 232 CO 0.02 -0.32 0.61 0.93 -1.32 0.00 0.00 178.16 178.08 3a9t h GLU 233 N -0.31 1.15 -0.48 1.82 4.39 -1.38 0.23 114.58 120.00 3a9t h GLU 233 Ca 0.09 -0.07 -0.12 0.00 0.34 0.00 0.00 59.36 59.60 3a9t h GLU 233 Cb 0.45 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 3a9t h GLU 233 CO -0.29 0.76 -0.18 0.00 -1.16 0.00 0.00 179.01 178.15 3a9t h ARG 234 N 1.19 0.95 -0.25 2.33 3.08 -1.13 -2.55 114.38 118.01 3a9t h ARG 234 Ca 0.36 -0.38 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3a9t h ARG 234 Cb -0.02 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3a9t h ARG 234 CO -0.10 1.05 0.04 0.00 -1.07 0.00 0.00 179.97 179.88 3a9t h ALA 235 N 0.95 0.34 -0.25 0.04 0.00 0.17 -1.60 119.26 118.92 3a9t h ALA 235 Ca 0.12 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.89 3a9t h ALA 235 Cb 0.73 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 3a9t h ALA 235 CO 0.06 0.02 -0.07 1.25 0.00 0.00 0.00 179.25 180.51 3a9t h LEU 236 N 0.23 -0.25 -0.44 0.00 6.46 -0.52 0.02 115.31 120.82 3a9t h LEU 236 Ca 0.08 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 3a9t h LEU 236 Cb 0.33 0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.40 3a9t h LEU 236 CO 0.01 -0.09 0.28 0.11 -0.62 0.00 0.00 178.44 178.13 3a9t h LYS 237 N -0.01 0.58 -0.74 1.25 1.57 -1.38 -1.38 116.57 116.46 3a9t h LYS 237 Ca 0.12 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.91 3a9t h LYS 237 Cb 0.19 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3a9t h LYS 237 CO -0.26 0.41 0.45 2.35 -0.57 0.00 0.00 179.45 181.82 3a9t h TRP 238 N 0.59 0.83 -0.38 -1.35 7.01 -0.59 0.93 115.95 122.98 3a9t h TRP 238 Ca 0.16 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.15 3a9t h TRP 238 Cb -0.04 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 26.74 3a9t h TRP 238 CO -0.04 0.43 0.09 0.28 -2.79 0.00 0.00 178.44 176.41 3a9t h VAL 239 N 0.84 1.23 -0.23 2.65 2.07 -0.70 0.11 116.25 122.21 3a9t h VAL 239 Ca 0.32 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 3a9t h VAL 239 Cb 0.13 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3a9t h VAL 239 CO -0.16 0.26 -0.03 0.11 0.02 0.00 0.00 177.57 177.77 3a9t h LYS 240 N 0.47 0.34 0.00 1.57 1.79 -0.57 0.13 116.57 120.30 3a9t h LYS 240 Ca 0.12 -0.06 -0.17 0.00 -2.18 0.00 0.00 60.65 58.36 3a9t h LYS 240 Cb 0.30 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.87 3a9t h LYS 240 CO 0.00 0.40 -1.11 1.49 -1.08 0.00 0.00 179.45 179.15 3a9t h GLU 241 N 0.33 0.00 0.00 3.15 4.57 -0.46 -3.41 114.58 118.76 3a9t h GLU 241 Ca 0.07 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 3a9t h GLU 241 Cb 0.28 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3a9t h GLU 241 CO 0.01 0.48 -1.18 0.09 -1.18 0.00 0.00 179.01 177.23 3a9t n ASN 242 N -3.08 4.17 -4.36 1.04 3.02 0.34 -4.90 115.26 111.49 3a9t n ASN 242 Ca -0.06 0.00 -0.45 0.00 -0.03 0.00 0.00 54.58 54.04 3a9t n ASN 242 Cb 0.85 1.08 -0.04 0.00 -0.61 0.00 0.00 39.78 41.06 3a9t n ASN 242 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a9t s LYS 244 N 1.86 4.37 0.03 0.00 -0.14 -1.26 -4.73 119.74 119.87 3a9t s LYS 244 Ca 0.14 1.68 -0.30 0.00 -1.36 0.00 0.00 55.97 56.12 3a9t s LYS 244 Cb -0.20 -3.52 -0.05 0.00 -1.68 0.00 0.00 37.83 32.38 3a9t s LYS 244 CO 0.00 -0.41 1.13 0.08 -0.76 0.00 0.00 175.35 175.40 3a9t s VAL 245 N 2.01 4.31 0.73 3.17 1.01 -1.26 -1.03 120.40 129.34 3a9t s VAL 245 Ca 0.56 1.65 0.00 0.00 0.00 0.00 0.00 61.98 64.20 3a9t s VAL 245 Cb -0.25 -4.06 0.14 0.00 0.00 0.00 0.00 36.38 32.20 3a9t s VAL 245 CO 0.23 0.11 1.00 -0.83 0.00 0.00 0.00 175.10 175.62 3a9t s GLY 246 N 1.09 1.75 0.52 4.51 0.00 -0.46 -4.83 107.32 109.89 3a9t s GLY 246 Ca 0.56 -1.84 -0.22 0.00 0.00 0.00 0.00 44.72 43.21 3a9t s GLY 246 CO 0.28 -1.24 1.30 -1.05 0.00 0.00 0.00 173.10 172.39 3a9t n PRO 247 N -2.84 1.70 -3.00 2.90 -0.02 -1.26 -4.66 135.00 127.82 3a9t n PRO 247 Ca 0.16 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.85 3a9t n PRO 247 Cb 0.61 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 3a9t n PRO 247 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3a9t s ASP 248 N -0.83 6.62 0.00 2.55 -1.08 -1.26 -4.55 116.67 118.12 3a9t s ASP 248 Ca 0.69 0.63 0.24 0.00 -0.52 0.00 0.00 52.55 53.59 3a9t s ASP 248 Cb -0.44 -2.38 0.82 0.00 -1.46 0.00 0.00 42.92 39.46 3a9t s ASP 248 CO 0.52 -0.54 1.61 0.59 0.52 0.00 0.00 175.17 177.86 3a9t n ASN 249 N 6.05 1.79 -4.73 -0.34 4.13 -1.26 -4.89 115.26 116.01 3a9t n ASN 249 Ca 0.02 -1.65 -0.41 0.00 1.68 0.00 0.00 54.58 54.21 3a9t n ASN 249 Cb 0.48 -0.06 -0.03 0.00 -1.54 0.00 0.00 39.78 38.63 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 -1.78 7.10 0.02 6.41 0.01 -1.26 -4.99 114.94 120.45 3a9t s ASN 250 Ca 0.35 2.18 -0.25 0.00 -0.71 0.00 0.00 52.86 54.43 3a9t s ASN 250 Cb 0.19 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.20 3a9t s ASN 250 CO 0.30 -0.37 0.75 -0.13 -1.51 0.00 0.00 177.10 176.14 3a9t s ARG 251 N -0.02 4.47 0.00 -0.60 1.81 -1.26 -4.50 118.95 118.84 3a9t s ARG 251 Ca 0.53 1.02 0.00 0.00 -1.72 0.00 0.00 55.73 55.56 3a9t s ARG 251 Cb -0.32 -3.38 0.00 0.00 -0.45 0.00 0.00 34.95 30.80 3a9t s ARG 251 CO 0.35 0.23 0.00 -0.40 -0.68 0.00 0.00 175.30 174.80 3a9t n ASP 252 N 3.03 0.00 -0.87 0.23 3.85 -1.26 0.04 116.55 121.58 3a9t n ASP 252 Ca -0.02 0.00 -0.00 0.00 -0.71 0.00 0.00 54.79 54.06 3a9t n ASP 252 Cb 0.50 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 3a9t n ASP 252 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3a9t n GLY 253 N 0.00 1.88 0.00 6.12 0.00 -1.26 -3.22 105.19 108.70 3a9t n GLY 253 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.34 0.00 -2.95 1.61 3.72 0.11 -5.07 117.46 115.21 3a9t n PHE 254 Ca 0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.06 3a9t n PHE 254 Cb 0.44 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.91 3a9t n PHE 254 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3a9t s LYS 255 N -0.15 4.26 0.15 -1.08 1.02 -1.20 -4.54 119.74 118.20 3a9t s LYS 255 Ca 0.00 1.00 -0.03 0.00 0.02 0.00 0.00 55.97 56.96 3a9t s LYS 255 Cb 0.00 -2.54 -0.05 0.00 -0.52 0.00 0.00 37.83 34.72 3a9t s LYS 255 CO 0.00 0.18 0.36 1.03 -0.92 0.00 0.00 175.35 176.00 3a9t s ARG 256 N -2.61 3.56 1.02 1.68 0.52 -1.26 -5.08 118.95 116.78 3a9t s ARG 256 Ca 0.53 -0.23 -0.12 0.00 -0.52 0.00 0.00 55.73 55.40 3a9t s ARG 256 Cb -0.13 -2.87 0.20 0.00 0.52 0.00 0.00 34.95 32.67 3a9t s ARG 256 CO 0.18 0.47 1.08 0.95 0.02 0.00 0.00 175.30 178.00 3a9t s THR 257 N -1.71 2.20 0.21 0.02 -4.23 -1.26 -4.77 115.64 106.10 3a9t s THR 257 Ca 0.39 0.06 -0.09 0.00 -1.18 0.00 0.00 61.69 60.87 3a9t s THR 257 Cb -0.12 -2.22 0.17 0.00 1.34 0.00 0.00 72.50 71.66 3a9t s THR 257 CO 0.27 -0.08 1.85 -0.08 -0.54 0.00 0.00 174.62 176.03 3a9t h GLU 258 N -2.13 1.08 -0.66 3.99 4.81 -1.99 -1.78 114.58 117.90 3a9t h GLU 258 Ca -0.53 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 58.57 3a9t h GLU 258 Cb 1.30 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 3a9t h GLU 258 CO 0.49 0.78 0.31 1.49 -0.73 0.00 0.00 179.01 181.34 3a9t h GLU 259 N 1.09 0.95 -0.57 1.92 4.81 -2.00 -2.61 114.58 118.17 3a9t h GLU 259 Ca 0.28 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3a9t h GLU 259 Cb -0.02 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 3a9t h GLU 259 CO -0.05 0.76 0.27 1.96 -0.73 0.00 0.00 179.01 181.22 3a9t h GLN 260 N 0.91 0.82 0.00 1.92 4.20 -1.78 -2.49 115.11 118.70 3a9t h GLN 260 Ca 0.23 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 3a9t h GLN 260 Cb 0.13 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 3a9t h GLN 260 CO -0.03 0.68 -0.15 0.87 -0.67 0.00 0.00 178.83 179.53 3a9t h LYS 261 N 0.77 0.00 -0.20 1.46 1.57 -1.14 0.17 116.57 119.20 3a9t h LYS 261 Ca 0.19 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.78 3a9t h LYS 261 Cb 0.13 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.44 3a9t h LYS 261 CO -0.02 0.15 -0.62 1.49 -0.57 0.00 0.00 179.45 179.88 3a9t h GLU 262 N 0.00 0.77 -0.45 3.15 4.57 -1.09 -2.65 114.58 118.89 3a9t h GLU 262 Ca -0.00 -0.56 -0.14 0.00 -1.18 0.00 0.00 59.36 57.48 3a9t h GLU 262 Cb 0.30 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 3a9t h GLU 262 CO 0.02 1.18 -0.26 -0.22 -1.18 0.00 0.00 179.01 178.55 3a9t h LYS 263 N 0.50 0.95 -0.86 1.92 3.64 -0.94 -2.07 116.57 119.70 3a9t h LYS 263 Ca -0.02 -0.43 0.10 0.00 -1.27 0.00 0.00 60.65 59.03 3a9t h LYS 263 Cb 1.24 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.96 3a9t h LYS 263 CO 0.13 1.09 0.50 -0.44 -2.27 0.00 0.00 179.45 178.47 3a9t h ASP 264 N 0.81 0.72 -0.50 4.20 3.32 -0.65 0.22 116.42 124.54 3a9t h ASP 264 Ca 0.10 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 3a9t h ASP 264 Cb 0.84 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 3a9t h ASP 264 CO 0.07 0.40 -0.13 -0.50 -1.72 0.00 0.00 179.24 177.36 3a9t h TRP 265 N 0.82 1.11 -0.09 4.55 -0.00 -1.21 -0.49 115.95 120.65 3a9t h TRP 265 Ca 0.42 -0.23 -0.01 0.00 -0.00 0.00 0.00 58.89 59.07 3a9t h TRP 265 Cb 0.40 -0.27 -0.00 0.00 -0.00 0.00 0.00 29.16 29.29 3a9t h TRP 265 CO -0.05 1.04 0.03 0.93 -0.00 0.00 0.00 178.44 180.39 3a9t h GLU 266 N 0.87 0.13 -0.58 0.49 5.08 -0.41 -1.99 114.58 118.18 3a9t h GLU 266 Ca 0.13 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 266 Cb 0.69 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 3a9t h GLU 266 CO 0.05 0.29 -0.01 0.82 -1.00 0.00 0.00 179.01 179.17 3a9t h ILE 267 N -0.05 1.26 -0.72 3.13 1.08 -0.63 -2.14 117.51 119.45 3a9t h ILE 267 Ca 0.03 -1.14 0.04 0.00 -0.39 0.00 0.00 64.86 63.40 3a9t h ILE 267 Cb 0.21 0.82 -0.05 0.00 -3.07 0.00 0.00 36.82 34.74 3a9t h ILE 267 CO -0.00 0.41 0.45 0.28 -0.69 0.00 0.00 178.15 178.60 3a9t h SER 268 N 0.93 0.72 -0.42 1.72 0.02 -0.97 0.46 113.55 116.01 3a9t h SER 268 Ca 0.17 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.05 3a9t h SER 268 Cb 0.55 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 3a9t h SER 268 CO 0.03 0.49 -0.01 0.58 -1.14 0.00 0.00 176.83 176.78 3a9t h VAL 269 N 0.86 1.26 -0.80 2.27 2.07 -1.15 -2.82 116.25 117.94 3a9t h VAL 269 Ca 0.30 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 3a9t h VAL 269 Cb 0.06 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3a9t h VAL 269 CO -0.13 0.36 0.45 0.11 0.02 0.00 0.00 177.57 178.38 3a9t h LYS 270 N 0.59 1.10 -0.97 1.57 1.57 -0.75 -2.10 116.57 117.58 3a9t h LYS 270 Ca 0.12 -0.12 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3a9t h LYS 270 Cb 0.51 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 3a9t h LYS 270 CO 0.02 0.80 0.64 0.52 -0.57 0.00 0.00 179.45 180.86 3a9t h MET 271 N 1.10 1.16 -0.44 3.15 2.86 -0.84 -0.39 114.93 121.53 3a9t h MET 271 Ca 0.28 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 3a9t h MET 271 Cb 0.01 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.39 3a9t h MET 271 CO -0.05 0.77 0.12 0.00 1.06 0.00 0.00 176.91 178.81 3a9t h ALA 272 N 1.45 0.58 -0.07 6.32 0.00 -1.14 0.15 119.26 126.54 3a9t h ALA 272 Ca 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3a9t h ALA 272 Cb 0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3a9t h ALA 272 CO -0.14 0.25 0.02 -0.07 0.00 0.00 0.00 179.25 179.31 3a9t h LEU 273 N 0.57 0.11 -0.44 0.00 3.38 -0.94 -2.37 115.31 115.63 3a9t h LEU 273 Ca 0.14 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3a9t h LEU 273 Cb 0.29 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3a9t h LEU 273 CO -0.00 0.32 0.25 0.40 0.09 0.00 0.00 178.44 179.50 3a9t h ILE 274 N -0.10 1.01 -0.01 1.22 2.04 -1.00 0.18 117.51 120.85 3a9t h ILE 274 Ca 0.02 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.73 3a9t h ILE 274 Cb 0.25 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3a9t h ILE 274 CO 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 178.15 178.16 3a9t h ALA 275 N 1.21 -0.07 -0.70 1.87 0.00 -0.93 -0.23 119.26 120.41 3a9t h ALA 275 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3a9t h ALA 275 Cb 0.05 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3a9t h ALA 275 CO -0.10 -0.57 0.35 -0.09 0.00 0.00 0.00 179.25 178.84 3a9t h ARG 276 N -0.13 1.00 -0.51 0.00 2.43 -1.17 -1.53 114.38 114.47 3a9t h ARG 276 Ca 0.04 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3a9t h ARG 276 Cb 0.17 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 3a9t h ARG 276 CO -0.09 0.78 0.32 -0.44 -1.51 0.00 0.00 179.97 179.02 3a9t h ASP 277 N 0.97 0.60 -0.39 -3.80 3.32 -0.19 -1.28 116.42 115.64 3a9t h ASP 277 Ca 0.24 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 57.12 3a9t h ASP 277 Cb 0.10 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3a9t h ASP 277 CO -0.03 0.45 -0.34 -0.07 -1.72 0.00 0.00 179.24 177.53 3a9t h LEU 278 N 0.70 0.98 0.03 1.55 3.38 -0.46 0.80 115.31 122.28 3a9t h LEU 278 Ca 0.18 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3a9t h LEU 278 Cb -0.04 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.43 3a9t h LEU 278 CO -0.04 1.23 -0.02 0.24 0.09 0.00 0.00 178.44 179.95 3a9t h MET 279 N 0.75 -0.04 0.00 1.13 2.86 -0.37 0.13 114.93 119.38 3a9t h MET 279 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3a9t h MET 279 Cb 0.93 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.60 3a9t h MET 279 CO 0.09 0.32 -0.02 1.33 1.06 0.00 0.00 176.91 179.69 3a9t n VAL 280 N -4.93 0.98 -0.56 -2.22 0.24 -0.57 -0.74 118.33 110.52 3a9t n VAL 280 Ca -0.08 -1.05 0.07 0.00 -2.04 0.00 0.00 64.34 61.24 3a9t n VAL 280 Cb 0.20 0.43 -0.02 0.00 -1.47 0.00 0.00 33.84 32.98 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 -0.58 -1.97 3.22 7.63 0.00 0.27 -4.75 105.19 109.01 3a9t n GLY 281 Ca 0.03 -1.36 0.03 0.00 0.00 0.00 0.00 46.02 44.72 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 -5.21 -1.29 0.62 1.61 3.84 -0.54 -4.67 114.94 109.30 3a9t s ASN 282 Ca 0.00 0.97 0.34 0.00 0.21 0.00 0.00 52.86 54.39 3a9t s ASN 282 Cb 0.00 2.15 2.00 0.00 -0.55 0.00 0.00 41.25 44.86 3a9t s ASN 282 CO 0.00 -0.25 2.27 0.07 -2.79 0.00 0.00 177.10 176.40 3a9t h LYS 283 N 8.01 0.00 -0.91 0.43 -0.00 -1.94 -1.39 116.57 120.76 3a9t h LYS 283 Ca -0.22 0.00 0.01 0.00 -0.00 0.00 0.00 60.65 60.44 3a9t h LYS 283 Cb 1.15 0.00 -0.04 0.00 -0.00 0.00 0.00 32.23 33.33 3a9t h LYS 283 CO 0.23 0.00 0.60 -0.22 -0.00 0.00 0.00 179.45 180.06 3a9t h LYS 284 N 0.00 1.21 -0.70 0.07 1.63 -1.95 -1.45 116.57 115.38 3a9t h LYS 284 Ca 0.01 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3a9t h LYS 284 Cb 0.07 -0.27 -0.03 0.00 -0.60 0.00 0.00 32.23 31.40 3a9t h LYS 284 CO -0.00 0.81 0.45 -0.07 -3.45 0.00 0.00 179.45 177.19 3a9t h LEU 285 N 1.24 0.81 -0.54 5.20 3.38 -1.56 -2.44 115.31 121.40 3a9t h LEU 285 Ca 0.33 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 3a9t h LEU 285 Cb -0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.40 3a9t h LEU 285 CO -0.07 0.60 0.21 -0.08 0.09 0.00 0.00 178.44 179.19 3a9t h GLU 286 N 0.95 0.80 0.00 1.13 4.81 -1.36 -0.88 114.58 120.03 3a9t h GLU 286 Ca 0.25 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3a9t h GLU 286 Cb -0.09 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 3a9t h GLU 286 CO -0.05 0.71 -0.14 0.93 -0.73 0.00 0.00 179.01 179.73 3a9t h GLU 287 N 0.73 0.00 0.00 1.92 5.08 -1.22 -1.96 114.58 119.13 3a9t h GLU 287 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3a9t h GLU 287 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3a9t h GLU 287 CO -0.01 0.14 -0.03 -1.33 -1.00 0.00 0.00 179.01 176.77 3a9t n MET 288 N -4.08 0.21 0.00 2.33 2.81 -0.80 -4.92 117.12 112.67 3a9t n MET 288 Ca -0.02 0.17 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 3a9t n MET 288 Cb 0.22 -1.74 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 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 1.35 1.33 2.45 3.03 0.00 -0.73 -5.05 105.19 107.57 3a9t n GLY 289 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.11 3.43 -0.33 1.61 4.02 -0.40 -4.94 117.16 119.44 3a9t n TYR 290 Ca 0.00 -4.14 -0.04 0.00 -0.01 0.00 0.00 57.90 53.70 3a9t n TYR 290 Cb 0.00 -0.55 0.08 0.00 -0.02 0.00 0.00 39.34 38.85 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 4.28 1.34 0.71 2.72 0.00 -1.81 -1.65 103.07 108.66 3a9t h GLY 291 Ca 0.19 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 3a9t h GLY 291 CO 0.81 0.59 -0.00 -2.09 0.00 0.00 0.00 176.54 175.85 3a9t h GLU 292 N 1.25 0.07 -0.05 4.80 4.81 -1.96 -3.05 114.58 120.45 3a9t h GLU 292 Ca 0.31 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 3a9t h GLU 292 Cb 0.05 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 3a9t h GLU 292 CO -0.05 0.36 -0.01 0.93 -0.73 0.00 0.00 179.01 179.51 3a9t h GLU 293 N -0.23 0.06 0.00 1.92 3.07 -1.94 -2.33 114.58 115.12 3a9t h GLU 293 Ca 0.01 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.86 3a9t h GLU 293 Cb 0.33 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3a9t h GLU 293 CO 0.00 0.09 -0.03 0.00 -1.40 0.00 0.00 179.01 177.66 3a9t h ALA 294 N 1.93 1.03 -0.33 3.43 0.00 -1.19 -3.22 119.26 120.90 3a9t h ALA 294 Ca 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3a9t h ALA 294 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3a9t h ALA 294 CO 0.00 0.04 -0.16 -0.07 0.00 0.00 0.00 179.25 179.07 3a9t h LEU 295 N 0.00 0.71 0.00 0.00 3.38 -1.43 -1.45 115.31 116.52 3a9t h LEU 295 Ca -0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 3a9t h LEU 295 Cb 0.43 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3a9t h LEU 295 CO 0.00 0.96 0.00 0.61 0.09 0.00 0.00 178.44 180.10 3a9t n GLY 296 N -0.05 -0.16 0.77 0.83 0.00 -1.22 -4.06 105.19 101.30 3a9t n GLY 296 Ca -0.03 -1.84 0.07 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.17 2.92 -4.08 1.61 5.12 0.03 -4.84 116.66 117.26 3a9t n ARG 297 Ca 0.00 -2.46 -0.28 0.00 -1.93 0.00 0.00 57.85 53.17 3a9t n ARG 297 Cb 0.00 -1.57 -0.04 0.00 -1.16 0.00 0.00 32.46 29.69 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 -0.02 -0.58 -4.62 0.55 5.15 -1.08 -4.60 115.26 110.06 3a9t n ASN 298 Ca 0.17 -1.06 -0.37 0.00 -0.60 0.00 0.00 54.58 52.72 3a9t n ASN 298 Cb 0.67 -2.70 -0.10 0.00 -0.53 0.00 0.00 39.78 37.11 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 -3.92 3.53 -2.35 5.20 0.00 0.08 -1.93 121.76 122.37 3a9t s ALA 299 Ca 0.14 -0.94 0.26 0.00 0.00 0.00 0.00 51.96 51.42 3a9t s ALA 299 Cb -0.08 -2.30 0.74 0.00 0.00 0.00 0.00 23.12 21.49 3a9t s ALA 299 CO 0.92 -0.27 1.56 1.51 0.00 0.00 0.00 175.76 179.48 3a9t n ILE 300 N 4.45 0.00 -3.59 0.00 3.06 -1.05 -4.62 119.36 117.61 3a9t n ILE 300 Ca -0.15 -0.26 -0.15 0.00 -2.50 0.00 0.00 62.75 59.69 3a9t n ILE 300 Cb 0.52 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 -2.17 0.00 0.32 9.51 0.11 -1.24 -4.36 120.40 122.57 3a9t s VAL 301 Ca 0.31 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.32 3a9t s VAL 301 Cb 0.20 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 34.05 3a9t s VAL 301 CO 0.40 0.00 0.45 0.00 -3.33 0.00 0.00 175.10 172.62 3a9t s ALA 302 N -0.24 0.65 0.05 1.54 0.00 -0.52 -1.53 121.76 121.70 3a9t s ALA 302 Ca -0.04 -1.43 -0.09 0.00 0.00 0.00 0.00 51.96 50.40 3a9t s ALA 302 Cb -0.03 1.16 0.00 0.00 0.00 0.00 0.00 23.12 24.25 3a9t s ALA 302 CO 0.04 -0.79 0.18 0.20 0.00 0.00 0.00 175.76 175.39 3a9t s GLY 303 N -3.20 0.06 -0.18 0.00 0.00 -0.57 0.11 107.32 103.55 3a9t s GLY 303 Ca 0.30 -0.36 -0.01 0.00 0.00 0.00 0.00 44.72 44.65 3a9t s GLY 303 CO 0.18 -0.53 -0.02 -0.12 0.00 0.00 0.00 173.10 172.61 3a9t s PHE 304 N -2.73 1.51 0.17 1.90 5.36 -0.58 -1.62 117.98 122.00 3a9t s PHE 304 Ca -0.04 -1.03 -0.20 0.00 -0.96 0.00 0.00 56.93 54.69 3a9t s PHE 304 Cb -0.00 -1.22 0.10 0.00 -0.34 0.00 0.00 43.02 41.55 3a9t s PHE 304 CO -0.05 -0.61 1.61 0.37 -1.46 0.00 0.00 175.22 175.08 3a9t h GLN 305 N 8.15 -0.17 0.00 10.12 4.15 -1.29 -1.48 115.11 134.59 3a9t h GLN 305 Ca -0.21 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.23 3a9t h GLN 305 Cb 1.11 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.84 3a9t h GLN 305 CO 0.37 -0.12 0.00 0.41 -1.93 0.00 0.00 178.83 177.57 3a9t n GLY 306 N -1.41 1.45 3.77 2.39 0.00 -1.26 -3.96 105.19 106.17 3a9t n GLY 306 Ca 0.02 0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3a9t n GLY 306 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a9t s GLN 307 N 0.00 3.43 -0.24 1.61 -0.21 -1.26 -2.41 119.66 120.58 3a9t s GLN 307 Ca 0.00 1.73 0.05 0.00 0.02 0.00 0.00 55.36 57.16 3a9t s GLN 307 Cb 0.00 -2.14 -0.19 0.00 1.00 0.00 0.00 33.01 31.68 3a9t s GLN 307 CO 0.00 -0.82 -0.13 0.54 -2.12 0.00 0.00 175.29 172.77 3a9t n ARG 308 N -1.05 0.66 -0.29 2.91 5.12 -1.26 -4.31 116.66 118.44 3a9t n ARG 308 Ca 0.10 0.12 -0.07 0.00 -1.93 0.00 0.00 57.85 56.07 3a9t n ARG 308 Cb 0.49 -1.53 -0.07 0.00 -1.16 0.00 0.00 32.46 30.20 3a9t n ARG 308 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3a9t n GLN 309 N -3.15 -0.30 0.33 5.56 3.00 -1.25 -1.04 117.38 120.52 3a9t n GLN 309 Ca -0.42 1.24 -0.15 0.00 -0.01 0.00 0.00 57.00 57.66 3a9t n GLN 309 Cb 1.03 -1.83 -0.07 0.00 0.00 0.00 0.00 30.24 29.37 3a9t n GLN 309 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.06 179.41 3a9t h TRP 310 N 0.00 -0.79 -0.11 1.08 2.91 -1.81 -3.21 115.95 114.02 3a9t h TRP 310 Ca 0.11 -0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.14 3a9t h TRP 310 Cb 0.28 0.26 -0.00 0.00 -0.51 0.00 0.00 29.16 29.19 3a9t h TRP 310 CO -0.90 -0.45 0.16 1.79 -1.03 0.00 0.00 178.44 178.01 3a9t h THR 311 N -1.12 0.34 0.00 2.65 1.35 -1.50 0.15 112.91 114.77 3a9t h THR 311 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 3a9t h THR 311 Cb 0.69 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 3a9t h THR 311 CO 0.14 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.88 3a9t n ASP 312 N -3.57 0.00 0.00 5.36 8.00 -0.21 -0.73 116.55 125.40 3a9t n ASP 312 Ca -0.00 -0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.22 3a9t n ASP 312 Cb 0.26 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 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 -1.12 0.00 -4.44 1.24 4.19 -0.39 -4.49 117.16 112.15 3a9t n TYR 313 Ca 0.10 0.00 -0.25 0.00 3.31 0.00 0.00 57.90 61.06 3a9t n TYR 313 Cb 0.08 0.00 -0.10 0.00 0.49 0.00 0.00 39.34 39.82 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 -0.59 2.46 0.49 2.98 0.08 0.39 -4.57 117.98 119.22 3a9t s PHE 314 Ca 0.00 -0.44 -0.24 0.00 0.12 0.00 0.00 56.93 56.37 3a9t s PHE 314 Cb 0.00 -1.37 -0.07 0.00 -0.57 0.00 0.00 43.02 41.01 3a9t s PHE 314 CO 0.00 0.56 1.40 -2.30 -0.10 0.00 0.00 175.22 174.78 3a9t n PRO 315 N -0.84 2.03 -0.85 0.24 -0.02 -1.07 -3.75 135.00 130.74 3a9t n PRO 315 Ca -0.05 0.73 -0.29 0.00 -2.02 0.00 0.00 63.50 61.87 3a9t n PRO 315 Cb 0.62 -2.61 0.23 0.00 -0.02 0.00 0.00 33.50 31.73 3a9t n PRO 315 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3a9t s ASN 316 N -0.64 1.07 -0.18 2.55 2.20 -0.14 -4.80 114.94 115.00 3a9t s ASN 316 Ca 0.65 1.06 0.10 0.00 -0.94 0.00 0.00 52.86 53.73 3a9t s ASN 316 Cb -0.44 -1.61 0.60 0.00 -2.00 0.00 0.00 41.25 37.81 3a9t s ASN 316 CO 0.54 -4.08 1.43 0.61 -2.94 0.00 0.00 177.10 172.66 3a9t n GLY 317 N -0.14 2.64 0.20 0.45 0.00 -1.26 -4.53 105.19 102.56 3a9t n GLY 317 Ca 0.08 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 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 2.88 -0.49 -0.45 1.61 5.19 -1.90 0.22 116.42 123.48 3a9t h ASP 318 Ca 0.02 0.09 -0.04 0.00 -0.62 0.00 0.00 57.03 56.48 3a9t h ASP 318 Cb 1.63 0.23 -0.02 0.00 0.18 0.00 0.00 39.33 41.35 3a9t h ASP 318 CO 0.38 -0.20 0.14 0.15 -3.12 0.00 0.00 179.24 176.58 3a9t h PHE 319 N -0.20 0.73 -0.05 4.55 3.04 -1.79 -0.87 116.94 122.35 3a9t h PHE 319 Ca 0.10 -0.08 0.02 0.00 3.98 0.00 0.00 57.97 61.99 3a9t h PHE 319 Cb 0.34 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.62 3a9t h PHE 319 CO -0.27 0.66 -0.06 1.98 -2.02 0.00 0.00 178.31 178.59 3a9t h MET 320 N 0.59 -0.08 0.00 1.11 4.05 -1.69 -0.66 114.93 118.25 3a9t h MET 320 Ca 0.14 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 3a9t h MET 320 Cb 0.27 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 3a9t h MET 320 CO -0.00 -0.05 -0.17 0.93 0.23 0.00 0.00 176.91 177.84 3a9t h GLU 321 N -0.08 0.00 0.01 0.39 5.08 -0.47 -2.54 114.58 116.96 3a9t h GLU 321 Ca 0.04 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3a9t h GLU 321 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3a9t h GLU 321 CO -0.10 0.17 -0.12 1.15 -1.00 0.00 0.00 179.01 179.11 3a9t h THR 322 N 0.00 1.63 -0.20 1.13 2.02 -0.45 -3.27 112.91 113.77 3a9t h THR 322 Ca -0.00 -2.03 -0.21 0.00 0.77 0.00 0.00 66.41 64.94 3a9t h THR 322 Cb 0.43 2.98 0.01 0.00 -1.74 0.00 0.00 68.15 69.83 3a9t h THR 322 CO 0.02 0.54 -0.69 -0.29 0.37 0.00 0.00 175.52 175.47 3a9t h ILE 323 N -0.72 1.28 -0.34 3.11 6.09 -1.11 -2.76 117.51 123.05 3a9t h ILE 323 Ca -0.02 -1.88 -0.01 0.00 -1.37 0.00 0.00 64.86 61.58 3a9t h ILE 323 Cb 0.95 1.85 -0.02 0.00 0.47 0.00 0.00 36.82 40.07 3a9t h ILE 323 CO 0.02 0.60 0.19 -0.07 -3.07 0.00 0.00 178.15 175.82 3a9t h LEU 324 N 0.59 0.42 -1.31 2.19 3.38 -1.63 -2.06 115.31 116.89 3a9t h LEU 324 Ca -0.03 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3a9t h LEU 324 Cb 1.31 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3a9t h LEU 324 CO 0.15 0.39 0.00 0.78 0.09 0.00 0.00 178.44 179.84 3a9t h ASN 325 N 0.42 0.00 -4.28 -0.43 2.35 -1.62 0.19 115.58 112.22 3a9t h ASN 325 Ca 0.12 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.36 3a9t h ASN 325 Cb 0.06 0.00 0.12 0.00 0.05 0.00 0.00 38.32 38.55 3a9t h ASN 325 CO -0.02 0.00 0.32 -0.44 -1.65 0.00 0.00 177.43 175.64 3a9t s SER 326 N -5.00 4.55 -0.15 5.81 0.01 -0.78 -4.53 113.70 113.62 3a9t s SER 326 Ca 0.02 1.64 0.11 0.00 1.31 0.00 0.00 55.95 59.03 3a9t s SER 326 Cb 0.09 -2.39 0.57 0.00 0.21 0.00 0.00 66.02 64.51 3a9t s SER 326 CO 0.45 -1.98 1.39 -1.54 0.41 0.00 0.00 173.24 171.98 3a9t n SER 327 N -3.47 4.23 -3.61 2.44 3.41 -1.26 -4.15 113.62 111.20 3a9t n SER 327 Ca 0.08 -2.60 -0.03 0.00 -0.26 0.00 0.00 58.87 56.06 3a9t n SER 327 Cb 0.54 -0.61 -0.01 0.00 -0.26 0.00 0.00 64.21 63.87 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 -2.16 -0.14 0.00 7.33 -0.12 -1.26 -1.62 117.98 120.01 3a9t s PHE 328 Ca 0.39 0.03 0.00 0.00 -0.05 0.00 0.00 56.93 57.29 3a9t s PHE 328 Cb 0.29 0.55 0.00 0.00 -0.63 0.00 0.00 43.02 43.22 3a9t s PHE 328 CO 0.13 -0.37 0.00 -0.40 -0.05 0.00 0.00 175.22 174.52 3a9t n ASP 329 N -0.28 0.00 0.03 1.98 5.68 -0.99 -4.93 116.55 118.04 3a9t n ASP 329 Ca -0.05 0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.27 3a9t n ASP 329 Cb 0.61 0.00 0.12 0.00 -1.14 0.00 0.00 41.12 40.70 3a9t n ASP 329 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 3a9t n TRP 330 N 0.00 0.15 -0.22 2.11 2.14 -1.26 -0.96 117.44 119.40 3a9t n TRP 330 Ca 0.00 0.08 0.09 0.00 2.07 0.00 0.00 57.50 59.74 3a9t n TRP 330 Cb 0.00 -0.62 0.24 0.00 -0.81 0.00 0.00 31.31 30.12 3a9t n TRP 330 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 3a9t n ASN 331 N -1.65 3.47 0.00 -0.67 3.02 -1.26 -4.97 115.26 113.20 3a9t n ASN 331 Ca -0.00 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 3a9t n ASN 331 Cb 0.01 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 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 1.17 -1.98 3.75 7.41 0.00 -0.13 -4.95 105.19 110.45 3a9t n GLY 332 Ca 0.19 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.10 2.81 -0.03 1.61 -2.85 -1.26 -2.35 119.74 117.57 3a9t s LYS 333 Ca 0.00 1.74 -0.30 0.00 -1.00 0.00 0.00 55.97 56.41 3a9t s LYS 333 Cb 0.00 -1.92 0.11 0.00 -2.06 0.00 0.00 37.83 33.96 3a9t s LYS 333 CO 0.00 -1.31 1.07 -0.98 0.10 0.00 0.00 175.35 174.23 3a9t s ARG 334 N -3.54 0.67 0.37 1.78 1.70 -0.64 -4.91 118.95 114.38 3a9t s ARG 334 Ca 0.75 -0.30 -0.27 0.00 -0.47 0.00 0.00 55.73 55.44 3a9t s ARG 334 Cb -0.28 0.27 -0.10 0.00 -0.57 0.00 0.00 34.95 34.27 3a9t s ARG 334 CO 0.36 -0.30 1.32 0.00 -1.08 0.00 0.00 175.30 175.61 3a9t s ALA 335 N -2.82 3.39 0.98 7.88 0.00 -1.26 -4.26 121.76 125.66 3a9t s ALA 335 Ca 0.09 1.28 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 3a9t s ALA 335 Cb -0.00 -3.50 0.18 0.00 0.00 0.00 0.00 23.12 19.80 3a9t s ALA 335 CO -0.05 -0.77 1.09 -2.14 0.00 0.00 0.00 175.76 173.89 3a9t s PRO 336 N -2.04 0.58 -0.39 0.00 0.02 -1.26 -4.94 135.00 126.98 3a9t s PRO 336 Ca 0.53 1.06 0.02 0.00 0.02 0.00 0.00 61.00 62.63 3a9t s PRO 336 Cb -0.40 -1.71 0.11 0.00 0.02 0.00 0.00 34.50 32.52 3a9t s PRO 336 CO 0.52 -2.77 0.12 0.71 -0.33 0.00 0.00 177.00 175.25 3a9t s TYR 337 N -2.71 3.65 -0.41 6.54 2.02 0.67 -4.99 117.35 122.12 3a9t s TYR 337 Ca 0.66 -2.90 -0.31 0.00 -0.37 0.00 0.00 57.07 54.15 3a9t s TYR 337 Cb -0.21 -2.99 -0.10 0.00 -0.40 0.00 0.00 41.96 38.26 3a9t s TYR 337 CO 0.59 -0.92 2.30 -0.89 -1.57 0.00 0.00 175.55 175.06 3a9t n ILE 338 N 4.15 0.14 -3.94 2.71 2.08 -1.26 -3.67 119.36 119.57 3a9t n ILE 338 Ca 0.03 -0.40 -0.28 0.00 0.56 0.00 0.00 62.75 62.66 3a9t n ILE 338 Cb 0.40 -2.00 -0.17 0.00 -0.75 0.00 0.00 39.64 37.13 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 8.80 1.70 0.05 1.39 2.19 -1.26 -1.44 117.98 129.41 3a9t s PHE 339 Ca 1.08 -0.91 -0.22 0.00 0.33 0.00 0.00 56.93 57.21 3a9t s PHE 339 Cb -0.63 -1.35 -0.06 0.00 -1.31 0.00 0.00 43.02 39.67 3a9t s PHE 339 CO 0.41 -0.57 0.67 0.00 1.83 0.00 0.00 175.22 177.56 3a9t s ALA 340 N 1.64 3.46 0.54 11.12 0.00 0.31 -4.91 121.76 133.93 3a9t s ALA 340 Ca 0.05 0.16 -0.18 0.00 0.00 0.00 0.00 51.96 51.99 3a9t s ALA 340 Cb -0.13 -2.83 -0.06 0.00 0.00 0.00 0.00 23.12 20.10 3a9t s ALA 340 CO -0.09 0.20 1.04 0.99 0.00 0.00 0.00 175.76 177.90 3a9t s THR 341 N -0.47 3.91 -1.07 0.00 2.01 -1.26 -1.53 115.64 117.22 3a9t s THR 341 Ca 0.34 1.01 0.00 0.00 0.31 0.00 0.00 61.69 63.35 3a9t s THR 341 Cb -0.20 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 68.86 3a9t s THR 341 CO 0.21 -0.43 0.00 -0.62 -0.69 0.00 0.00 174.62 173.09 3a9t n GLU 342 N -1.56 -1.31 -2.14 4.92 1.02 -0.81 -1.36 120.64 119.40 3a9t n GLU 342 Ca 0.09 0.60 -0.19 0.00 -0.02 0.00 0.00 57.16 57.63 3a9t n GLU 342 Cb 0.53 -4.82 -0.03 0.00 -0.02 0.00 0.00 31.44 27.10 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 -0.29 -5.44 -4.57 1.62 5.15 -0.62 -4.26 115.26 106.85 3a9t n ASN 343 Ca -0.10 0.16 -0.36 0.00 -0.60 0.00 0.00 54.58 53.68 3a9t n ASN 343 Cb 0.36 -4.63 -0.03 0.00 -0.53 0.00 0.00 39.78 34.95 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 -2.23 6.03 0.51 1.20 -1.08 -0.47 -4.17 116.67 116.46 3a9t s ASP 344 Ca 0.00 -1.70 0.16 0.00 -0.52 0.00 0.00 52.55 50.49 3a9t s ASP 344 Cb 0.00 -2.58 1.24 0.00 -1.46 0.00 0.00 42.92 40.13 3a9t s ASP 344 CO 0.00 -1.98 2.13 -0.55 0.52 0.00 0.00 175.17 175.29 3a9t h ASN 345 N 9.29 0.04 0.10 -0.34 7.08 -1.69 -0.94 115.58 129.12 3a9t h ASN 345 Ca 0.27 -0.00 -0.11 0.00 -3.08 0.00 0.00 56.30 53.38 3a9t h ASN 345 Cb 0.95 -0.01 -0.01 0.00 -2.08 0.00 0.00 38.32 37.16 3a9t h ASN 345 CO 1.35 0.03 -0.38 -0.07 -2.08 0.00 0.00 177.43 176.29 3a9t h LEU 346 N 0.05 0.39 -0.22 6.14 3.38 -1.86 -0.76 115.31 122.43 3a9t h LEU 346 Ca 0.03 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 3a9t h LEU 346 Cb 0.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3a9t h LEU 346 CO -0.00 0.73 -0.53 -1.13 0.09 0.00 0.00 178.44 177.61 3a9t h ASN 347 N 0.32 0.00 -0.45 -0.43 -1.24 -1.51 -1.69 115.58 110.57 3a9t h ASN 347 Ca 0.03 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.96 3a9t h ASN 347 Cb 0.81 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.84 3a9t h ASN 347 CO 0.06 0.53 -0.04 1.23 -1.29 0.00 0.00 177.43 177.92 3a9t h GLY 348 N 3.11 0.89 1.89 1.57 0.00 -0.56 -0.10 103.07 109.88 3a9t h GLY 348 Ca -0.01 -0.69 -0.14 0.00 0.00 0.00 0.00 47.33 46.50 3a9t h GLY 348 CO 0.07 0.63 -0.60 -2.22 0.00 0.00 0.00 176.54 174.42 3a9t h ILE 349 N 0.67 1.41 -0.52 2.60 1.08 -1.08 0.81 117.51 122.48 3a9t h ILE 349 Ca 0.12 -2.03 -0.03 0.00 -0.39 0.00 0.00 64.86 62.54 3a9t h ILE 349 Cb 0.55 2.06 -0.02 0.00 -3.07 0.00 0.00 36.82 36.35 3a9t h ILE 349 CO 0.03 0.59 0.22 0.28 -0.69 0.00 0.00 178.15 178.58 3a9t h SER 350 N 0.08 0.70 -0.44 1.72 0.02 -0.95 -0.64 113.55 114.05 3a9t h SER 350 Ca -0.01 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 3a9t h SER 350 Cb 1.09 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.43 3a9t h SER 350 CO 0.09 0.66 0.14 0.24 -1.14 0.00 0.00 176.83 176.82 3a9t h MET 351 N 0.70 0.68 -0.51 3.45 2.86 -0.68 -3.03 114.93 118.40 3a9t h MET 351 Ca 0.17 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3a9t h MET 351 Cb 0.17 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 3a9t h MET 351 CO -0.02 0.66 0.31 1.25 1.06 0.00 0.00 176.91 180.17 3a9t h LEU 352 N 0.57 0.52 -0.21 1.22 5.85 -0.43 0.66 115.31 123.48 3a9t h LEU 352 Ca 0.14 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.91 3a9t h LEU 352 Cb 0.26 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 3a9t h LEU 352 CO -0.01 0.37 -0.13 -0.26 -0.34 0.00 0.00 178.44 178.07 3a9t h PHE 353 N 0.63 -0.33 -0.42 1.25 0.05 -1.06 0.14 116.94 117.20 3a9t h PHE 353 Ca 0.20 0.03 -0.05 0.00 3.82 0.00 0.00 57.97 61.96 3a9t h PHE 353 Cb -0.01 0.18 -0.02 0.00 2.00 0.00 0.00 35.95 38.10 3a9t h PHE 353 CO -0.06 -0.20 0.03 0.78 -0.18 0.00 0.00 178.31 178.68 3a9t h GLY 354 N -0.13 0.71 0.60 -1.45 0.00 -1.35 -2.49 103.07 98.97 3a9t h GLY 354 Ca 0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 3a9t h GLY 354 CO -0.29 0.40 -0.12 -1.82 0.00 0.00 0.00 176.54 174.72 3a9t h TYR 355 N 0.63 -0.30 0.00 5.60 5.03 0.10 -2.81 116.97 125.22 3a9t h TYR 355 Ca 0.13 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.44 3a9t h TYR 355 Cb 0.35 0.10 -0.00 0.00 1.55 0.00 0.00 36.73 38.73 3a9t h TYR 355 CO 0.02 0.06 -0.00 -0.07 -1.32 0.00 0.00 178.16 176.84 3a9t h LEU 356 N -0.72 0.00 0.00 2.82 3.38 -0.72 0.87 115.31 120.94 3a9t h LEU 356 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3a9t h LEU 356 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3a9t h LEU 356 CO 0.05 0.00 -0.41 0.18 0.09 0.00 0.00 178.44 178.36 3a9t n LEU 357 N -3.47 0.59 0.00 1.67 4.77 -0.94 -4.48 117.00 115.13 3a9t n LEU 357 Ca -0.03 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 3a9t n LEU 357 Cb 0.08 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 3a9t n LEU 357 CO 0.24 -0.03 -0.04 0.35 -1.33 0.00 0.00 177.39 176.58 3a9t n THR 358 N -1.93 0.00 -1.41 -5.08 -2.24 -0.54 -5.02 114.28 98.06 3a9t n THR 358 Ca 0.05 -0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.65 3a9t n THR 358 Cb 0.40 0.52 -0.06 0.00 -2.10 0.00 0.00 70.33 69.10 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 -0.19 -4.64 -4.58 3.42 3.02 0.29 -4.71 115.26 107.87 3a9t n ASN 359 Ca 0.00 0.33 -0.27 0.00 -0.03 0.00 0.00 54.58 54.61 3a9t n ASN 359 Cb 0.00 -3.35 -0.09 0.00 -0.61 0.00 0.00 39.78 35.73 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 -2.51 3.28 0.51 3.41 -4.23 -1.25 -4.25 115.64 110.60 3a9t s THR 360 Ca 0.00 -1.53 -0.23 0.00 -1.18 0.00 0.00 61.69 58.75 3a9t s THR 360 Cb 0.00 -2.61 -0.06 0.00 1.34 0.00 0.00 72.50 71.17 3a9t s THR 360 CO 0.00 -0.05 1.38 0.00 -0.54 0.00 0.00 174.62 175.41 3a9t s ALA 361 N -1.57 2.99 -0.02 3.99 0.00 -1.26 -4.50 121.76 121.39 3a9t s ALA 361 Ca 0.24 1.37 0.05 0.00 0.00 0.00 0.00 51.96 53.62 3a9t s ALA 361 Cb -0.09 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 3a9t s ALA 361 CO 0.15 -1.28 -0.15 -0.65 0.00 0.00 0.00 175.76 173.83 3a9t s GLN 362 N -2.72 2.36 -0.17 0.00 -1.52 -1.26 -4.71 119.66 111.64 3a9t s GLN 362 Ca 0.67 -0.79 -0.15 0.00 -1.95 0.00 0.00 55.36 53.13 3a9t s GLN 362 Cb -0.41 -2.31 -0.04 0.00 -0.22 0.00 0.00 33.01 30.02 3a9t s GLN 362 CO 0.51 0.59 0.37 0.42 -0.25 0.00 0.00 175.29 176.93 3a9t s ILE 363 N -0.81 5.24 0.04 1.08 -1.09 0.52 -4.61 121.20 121.57 3a9t s ILE 363 Ca 0.13 0.69 -0.22 0.00 -2.23 0.00 0.00 60.65 59.02 3a9t s ILE 363 Cb -0.11 -3.71 -0.06 0.00 -1.58 0.00 0.00 42.46 37.01 3a9t s ILE 363 CO 0.03 0.31 0.64 0.12 -1.23 0.00 0.00 174.94 174.81 3a9t s PHE 364 N 0.89 3.75 0.22 3.97 2.19 -1.26 -0.35 117.98 127.39 3a9t s PHE 364 Ca 0.19 1.32 -0.18 0.00 0.33 0.00 0.00 56.93 58.59 3a9t s PHE 364 Cb -0.14 -2.64 0.02 0.00 -1.31 0.00 0.00 43.02 38.95 3a9t s PHE 364 CO 0.07 0.41 0.56 0.00 1.83 0.00 0.00 175.22 178.09 3a9t s ALA 365 N -0.47 -0.92 -0.11 11.12 0.00 -1.08 -4.27 121.76 126.03 3a9t s ALA 365 Ca 0.33 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 51.96 3a9t s ALA 365 Cb -0.19 0.89 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 3a9t s ALA 365 CO 0.20 -0.86 -0.01 -0.51 0.00 0.00 0.00 175.76 174.58 3a9t s ASP 366 N -2.90 5.07 -1.20 0.00 -0.00 -1.19 -2.52 116.67 113.94 3a9t s ASP 366 Ca 0.11 0.05 -0.16 0.00 -0.00 0.00 0.00 52.55 52.55 3a9t s ASP 366 Cb -0.02 -1.54 0.13 0.00 -0.00 0.00 0.00 42.92 41.49 3a9t s ASP 366 CO 0.00 0.31 1.50 -0.69 -0.00 0.00 0.00 175.17 176.29 3a9t s VAL 367 N -0.48 4.65 -0.01 -1.27 1.01 -0.16 -1.26 120.40 122.88 3a9t s VAL 367 Ca 0.08 -2.19 -0.23 0.00 0.00 0.00 0.00 61.98 59.64 3a9t s VAL 367 Cb -0.12 -5.00 -0.16 0.00 0.00 0.00 0.00 36.38 31.10 3a9t s VAL 367 CO 0.02 -1.76 1.08 -0.09 0.00 0.00 0.00 175.10 174.36 3a9t h ARG 368 N 7.62 -0.34 -3.35 2.72 9.65 -1.48 -3.48 114.38 125.72 3a9t h ARG 368 Ca 0.33 0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 59.08 3a9t h ARG 368 Cb 0.90 0.08 -0.23 0.00 -1.39 0.00 0.00 29.97 29.32 3a9t h ARG 368 CO 1.31 0.01 -0.47 0.99 2.80 0.00 0.00 179.97 184.61 3a9t s THR 369 N -4.17 0.04 -0.31 0.20 2.01 -1.16 -4.98 115.64 107.27 3a9t s THR 369 Ca -0.13 -0.31 -0.08 0.00 0.31 0.00 0.00 61.69 61.47 3a9t s THR 369 Cb 0.01 -0.36 0.01 0.00 0.01 0.00 0.00 72.50 72.17 3a9t s THR 369 CO 0.51 -0.17 0.12 -0.47 -0.69 0.00 0.00 174.62 173.91 3a9t s TYR 370 N -0.60 3.18 -0.43 4.92 5.04 -1.26 0.82 117.35 129.01 3a9t s TYR 370 Ca -0.07 -0.89 -0.13 0.00 -2.44 0.00 0.00 57.07 53.54 3a9t s TYR 370 Cb -0.04 -2.31 0.05 0.00 0.35 0.00 0.00 41.96 40.02 3a9t s TYR 370 CO 0.01 -0.56 0.32 -1.58 -1.34 0.00 0.00 175.55 172.40 3a9t s TRP 371 N 1.53 3.26 0.72 4.97 0.52 0.08 -5.01 118.94 125.02 3a9t s TRP 371 Ca 0.03 -0.97 -0.11 0.00 0.02 0.00 0.00 56.10 55.07 3a9t s TRP 371 Cb -0.18 -2.88 0.02 0.00 -1.15 0.00 0.00 33.47 29.29 3a9t s TRP 371 CO 0.04 -0.74 1.08 -1.54 0.02 0.00 0.00 176.95 175.81 3a9t s SER 372 N 2.13 5.21 0.25 2.95 1.04 -1.26 -1.70 113.70 122.31 3a9t s SER 372 Ca 0.04 1.36 -0.04 0.00 0.48 0.00 0.00 55.95 57.79 3a9t s SER 372 Cb -0.22 -2.20 0.39 0.00 0.10 0.00 0.00 66.02 64.09 3a9t s SER 372 CO 0.07 -1.52 1.84 -0.65 0.98 0.00 0.00 173.24 173.96 3a9t h PRO 373 N -0.77 0.90 -0.62 4.02 0.11 -1.85 -2.18 132.00 131.60 3a9t h PRO 373 Ca -0.45 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 3a9t h PRO 373 Cb 1.24 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3a9t h PRO 373 CO 0.60 0.60 0.29 0.93 -0.21 0.00 0.00 178.00 180.21 3a9t h GLU 374 N 0.93 0.90 -0.46 1.05 3.07 -1.96 -1.30 114.58 116.80 3a9t h GLU 374 Ca 0.40 -0.14 -0.04 0.00 -0.50 0.00 0.00 59.36 59.09 3a9t h GLU 374 Cb 0.27 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 3a9t h GLU 374 CO -0.21 0.73 0.13 0.00 -1.40 0.00 0.00 179.01 178.26 3a9t h ALA 375 N 1.13 0.60 -0.36 3.43 0.00 -1.80 -0.04 119.26 122.21 3a9t h ALA 375 Ca 0.21 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3a9t h ALA 375 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3a9t h ALA 375 CO -0.03 0.26 -0.01 0.28 0.00 0.00 0.00 179.25 179.76 3a9t h VAL 376 N 0.60 1.26 -0.85 0.00 2.07 -1.29 -1.77 116.25 116.28 3a9t h VAL 376 Ca 0.15 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.68 3a9t h VAL 376 Cb 0.29 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 3a9t h VAL 376 CO -0.00 0.33 0.56 0.50 0.02 0.00 0.00 177.57 178.98 3a9t h LYS 377 N 0.46 1.09 -0.31 1.57 1.63 -1.07 0.31 116.57 120.25 3a9t h LYS 377 Ca 0.10 -0.07 -0.13 0.00 -0.85 0.00 0.00 60.65 59.70 3a9t h LYS 377 Cb 0.47 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 31.85 3a9t h LYS 377 CO 0.02 0.72 -0.32 -0.09 -3.45 0.00 0.00 179.45 176.33 3a9t h ARG 378 N 1.12 0.77 0.00 1.90 2.43 -0.76 0.32 114.38 120.17 3a9t h ARG 378 Ca 0.32 -0.41 -0.16 0.00 -0.81 0.00 0.00 59.98 58.91 3a9t h ARG 378 Cb -0.09 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 3a9t h ARG 378 CO -0.08 1.04 -1.04 0.28 -1.51 0.00 0.00 179.97 178.66 3a9t h VAL 379 N 0.54 0.87 0.00 0.20 2.07 -1.04 -3.39 116.25 115.50 3a9t h VAL 379 Ca 0.05 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.18 3a9t h VAL 379 Cb 0.90 2.35 0.00 0.00 -1.52 0.00 0.00 31.29 33.02 3a9t h VAL 379 CO 0.08 0.50 0.00 0.35 0.02 0.00 0.00 177.57 178.52 3a9t n THR 380 N -3.10 0.00 -0.89 2.57 -2.24 0.11 -4.99 114.28 105.74 3a9t n THR 380 Ca -0.05 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 3a9t n THR 380 Cb 0.84 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 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 0.71 0.29 3.85 3.38 0.00 0.11 -4.97 105.19 108.57 3a9t n GLY 381 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.75 3.54 -0.21 1.61 6.14 -1.26 -4.96 117.35 120.46 3a9t s TYR 382 Ca 0.00 0.48 -0.14 0.00 0.64 0.00 0.00 57.07 58.05 3a9t s TYR 382 Cb 0.00 -1.93 -0.04 0.00 0.42 0.00 0.00 41.96 40.41 3a9t s TYR 382 CO 0.00 0.70 0.31 0.99 0.64 0.00 0.00 175.55 178.19 3a9t s THR 383 N -0.98 5.26 0.27 4.34 2.01 -1.26 -3.26 115.64 122.02 3a9t s THR 383 Ca 0.15 0.52 -0.30 0.00 0.31 0.00 0.00 61.69 62.37 3a9t s THR 383 Cb -0.12 -3.65 -0.10 0.00 0.01 0.00 0.00 72.50 68.64 3a9t s THR 383 CO 0.04 0.29 1.48 -0.76 -0.69 0.00 0.00 174.62 174.98 3a9t s LEU 384 N 1.15 4.37 0.46 4.42 1.43 -1.26 -5.02 118.68 124.25 3a9t s LEU 384 Ca 0.15 2.75 0.03 0.00 -1.03 0.00 0.00 54.13 56.03 3a9t s LEU 384 Cb -0.14 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.42 3a9t s LEU 384 CO 0.06 -0.75 0.02 -1.61 0.23 0.00 0.00 176.35 174.30 3a9t s GLU 385 N -0.49 2.08 2.37 1.70 2.02 -1.26 -4.17 118.70 120.95 3a9t s GLU 385 Ca 0.60 -2.28 0.00 0.00 0.02 0.00 0.00 54.97 53.31 3a9t s GLU 385 Cb -0.43 -1.46 0.00 0.00 0.10 0.00 0.00 34.13 32.34 3a9t s GLU 385 CO 0.45 -0.27 0.00 0.41 0.02 0.00 0.00 175.26 175.87 3a9t n GLY 386 N -1.12 1.47 0.36 -1.39 0.00 -1.26 -1.43 105.19 101.81 3a9t n GLY 386 Ca -0.13 -0.47 0.18 0.00 0.00 0.00 0.00 46.02 45.60 3a9t n GLY 386 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3a9t h ARG 387 N 0.00 0.00 0.00 1.61 3.08 -1.99 0.15 114.38 117.23 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 -0.09 0.00 -1.07 0.00 0.00 179.97 178.81 3a9t n ALA 388 N -2.25 2.49 -0.36 0.04 0.00 -0.52 -4.23 120.51 115.68 3a9t n ALA 388 Ca 0.03 -0.12 0.26 0.00 0.00 0.00 0.00 53.44 53.61 3a9t n ALA 388 Cb 0.43 -1.41 0.52 0.00 0.00 0.00 0.00 19.45 18.99 3a9t n ALA 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a9t h ALA 389 N 2.86 2.24 -0.46 0.00 0.00 0.18 -0.03 119.26 124.04 3a9t h ALA 389 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3a9t h ALA 389 Cb 0.57 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3a9t h ALA 389 CO 0.00 -0.75 0.00 0.09 0.00 0.00 0.00 179.25 178.59 3a9t n ASN 390 N -4.78 3.76 0.00 0.00 3.02 -1.26 -4.75 115.26 111.25 3a9t n ASN 390 Ca 0.30 -2.39 0.00 0.00 -0.03 0.00 0.00 54.58 52.46 3a9t n ASN 390 Cb 1.02 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 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 0.83 2.54 3.10 7.41 0.00 -0.03 -4.48 105.19 114.56 3a9t n GLY 391 Ca 0.19 -1.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 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 -2.81 0.30 -0.08 -0.61 -4.36 -0.69 -4.72 121.20 108.22 3a9t s ILE 392 Ca 0.00 -1.79 0.03 0.00 -0.26 0.00 0.00 60.65 58.64 3a9t s ILE 392 Cb 0.00 -1.49 -0.01 0.00 1.25 0.00 0.00 42.46 42.21 3a9t s ILE 392 CO 0.00 -0.95 -0.19 -0.63 0.24 0.00 0.00 174.94 173.40 3a9t s ILE 393 N -3.75 2.55 -0.52 8.37 1.01 0.20 -0.74 121.20 128.32 3a9t s ILE 393 Ca 0.07 -0.87 -0.23 0.00 0.00 0.00 0.00 60.65 59.62 3a9t s ILE 393 Cb 0.07 -2.00 0.04 0.00 0.01 0.00 0.00 42.46 40.58 3a9t s ILE 393 CO -0.09 0.56 0.84 -2.28 0.00 0.00 0.00 174.94 173.97 3a9t s HIS 394 N -0.06 2.89 -0.29 3.97 5.65 0.24 -1.25 115.29 126.44 3a9t s HIS 394 Ca -0.05 -0.08 -0.13 0.00 0.25 0.00 0.00 55.06 55.06 3a9t s HIS 394 Cb -0.14 -3.87 -0.04 0.00 -1.18 0.00 0.00 32.58 27.35 3a9t s HIS 394 CO 0.04 -1.20 0.27 -0.51 -0.65 0.00 0.00 174.74 172.69 3a9t s LEU 395 N 3.53 4.11 -0.30 8.88 1.43 -0.77 -1.25 118.68 134.31 3a9t s LEU 395 Ca 0.27 0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.40 3a9t s LEU 395 Cb -0.14 -2.25 0.19 0.00 0.03 0.00 0.00 46.19 44.03 3a9t s LEU 395 CO 0.19 -0.14 0.63 -0.51 0.23 0.00 0.00 176.35 176.75 3a9t s ILE 396 N 1.89 -0.95 0.66 -0.59 2.07 -0.39 -1.73 121.20 122.15 3a9t s ILE 396 Ca 0.10 0.00 -0.15 0.00 -1.41 0.00 0.00 60.65 59.19 3a9t s ILE 396 Cb -0.16 -0.99 -0.00 0.00 0.13 0.00 0.00 42.46 41.43 3a9t s ILE 396 CO 0.11 0.00 1.10 0.21 -1.91 0.00 0.00 174.94 174.44 3a9t s ASN 397 N 2.86 5.20 0.00 4.50 2.47 -1.26 -3.15 114.94 125.56 3a9t s ASN 397 Ca 0.18 1.94 -0.01 0.00 0.42 0.00 0.00 52.86 55.39 3a9t s ASN 397 Cb -0.14 -2.54 -0.06 0.00 -1.45 0.00 0.00 41.25 37.06 3a9t s ASN 397 CO -0.21 -1.57 1.44 -1.54 -3.72 0.00 0.00 177.10 171.50 3a9t n SER 398 N -2.45 2.50 0.00 -4.21 3.41 -1.26 -4.32 113.62 107.29 3a9t n SER 398 Ca 0.10 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.90 3a9t n SER 398 Cb 0.52 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 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 2.25 1.20 3.34 5.00 0.00 -1.26 -5.03 105.19 110.69 3a9t n GLY 399 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.93 2.11 -0.29 4.61 0.00 -1.26 0.19 121.76 126.19 3a9t s ALA 400 Ca 0.00 -1.35 -0.25 0.00 0.00 0.00 0.00 51.96 50.36 3a9t s ALA 400 Cb 0.00 -0.33 0.17 0.00 0.00 0.00 0.00 23.12 22.96 3a9t s ALA 400 CO 0.00 0.46 1.32 0.00 0.00 0.00 0.00 175.76 177.54 3a9t s ALA 401 N -1.07 -2.15 0.37 0.00 0.00 -1.26 -4.60 121.76 113.05 3a9t s ALA 401 Ca 0.10 1.74 -0.26 0.00 0.00 0.00 0.00 51.96 53.54 3a9t s ALA 401 Cb -0.10 -1.67 -0.11 0.00 0.00 0.00 0.00 23.12 21.24 3a9t s ALA 401 CO 0.05 -0.14 1.17 0.00 0.00 0.00 0.00 175.76 176.84 3a9t n ALA 402 N 1.71 0.79 0.30 0.00 0.00 -1.26 -4.67 120.51 117.38 3a9t n ALA 402 Ca -0.11 0.31 0.16 0.00 0.00 0.00 0.00 53.44 53.80 3a9t n ALA 402 Cb 0.57 -2.18 0.77 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 2.09 0.00 -2.13 0.00 3.38 -1.90 0.38 115.31 117.13 3a9t h LEU 403 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3a9t h LEU 403 Cb 1.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 3a9t h LEU 403 CO 0.60 0.00 -0.06 0.44 0.09 0.00 0.00 178.44 179.51 3a9t h ASP 404 N 0.00 0.00 0.08 -0.43 5.19 -1.92 -2.33 116.42 117.00 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 0.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.75 3a9t h ASP 404 CO 0.00 0.06 0.00 0.61 -3.12 0.00 0.00 179.24 176.79 3a9t n GLY 405 N -0.70 -0.67 0.22 2.75 0.00 0.12 -1.89 105.19 105.02 3a9t n GLY 405 Ca -0.02 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.13 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 0.83 -0.09 2.61 1.35 -1.62 -3.38 112.91 112.61 3a9t h THR 406 Ca 0.00 -0.96 -0.04 0.00 -0.55 0.00 0.00 66.41 64.86 3a9t h THR 406 Cb 0.04 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.02 3a9t h THR 406 CO 0.00 0.24 -0.03 0.61 -0.25 0.00 0.00 175.52 176.08 3a9t n GLY 407 N -0.41 0.54 0.16 5.82 0.00 -0.79 -1.94 105.19 108.56 3a9t n GLY 407 Ca -0.01 -0.44 0.02 0.00 0.00 0.00 0.00 46.02 45.59 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 0.42 0.00 -6.97 1.61 4.39 -1.81 -3.37 114.58 108.84 3a9t h GLU 408 Ca -0.04 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.12 3a9t h GLU 408 Cb 0.22 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 28.98 3a9t h GLU 408 CO 0.06 0.52 0.75 -0.65 -1.16 0.00 0.00 179.01 178.52 3a9t s GLN 409 N -3.48 3.91 0.04 2.33 -0.21 -1.26 -4.88 119.66 116.11 3a9t s GLN 409 Ca 0.00 2.52 0.05 0.00 0.02 0.00 0.00 55.36 57.95 3a9t s GLN 409 Cb 0.11 -2.82 -0.02 0.00 1.00 0.00 0.00 33.01 31.28 3a9t s GLN 409 CO 0.73 -0.68 -0.13 0.99 -2.12 0.00 0.00 175.29 174.08 3a9t s THR 410 N -1.16 1.06 -0.07 -0.19 2.01 -1.26 -1.50 115.64 114.54 3a9t s THR 410 Ca 0.57 -1.04 -0.03 0.00 0.31 0.00 0.00 61.69 61.49 3a9t s THR 410 Cb -0.46 -0.98 0.04 0.00 0.01 0.00 0.00 72.50 71.12 3a9t s THR 410 CO 0.61 -0.06 0.12 -0.75 -0.69 0.00 0.00 174.62 173.85 3a9t s LYS 411 N -1.26 0.00 -1.49 4.92 2.20 -0.27 -4.85 119.74 119.00 3a9t s LYS 411 Ca 0.00 0.47 -0.10 0.00 -0.36 0.00 0.00 55.97 55.98 3a9t s LYS 411 Cb -0.08 -0.33 0.07 0.00 -1.51 0.00 0.00 37.83 35.97 3a9t s LYS 411 CO 0.01 -0.29 0.89 -0.25 -0.36 0.00 0.00 175.35 175.36 3a9t n ASP 412 N 5.14 -3.78 -0.63 1.43 8.00 -1.26 -1.08 116.55 124.37 3a9t n ASP 412 Ca -0.08 -0.80 -0.08 0.00 0.71 0.00 0.00 54.79 54.54 3a9t n ASP 412 Cb 0.50 -3.85 -0.04 0.00 -0.02 0.00 0.00 41.12 37.71 3a9t n ASP 412 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a9t n GLY 413 N -1.67 0.94 3.31 0.44 0.00 -1.26 -5.00 105.19 101.95 3a9t n GLY 413 Ca -0.05 -0.26 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.42 1.60 0.20 1.61 1.02 -0.24 -5.11 119.74 116.40 3a9t s LYS 414 Ca 0.00 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 54.61 3a9t s LYS 414 Cb 0.00 -1.79 -0.09 0.00 -0.52 0.00 0.00 37.83 35.43 3a9t s LYS 414 CO 0.00 0.46 1.26 -1.25 -0.92 0.00 0.00 175.35 174.90 3a9t s PRO 415 N -1.31 4.43 0.18 -1.68 0.04 -1.26 -1.11 135.00 134.29 3a9t s PRO 415 Ca 0.10 1.98 -0.04 0.00 0.04 0.00 0.00 61.00 63.08 3a9t s PRO 415 Cb -0.10 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 31.25 3a9t s PRO 415 CO 0.02 -0.18 0.32 1.33 0.04 0.00 0.00 177.00 178.53 3a9t n VAL 416 N 2.49 0.00 -3.65 -0.36 0.24 -0.56 -4.75 118.33 111.73 3a9t n VAL 416 Ca 0.05 -0.67 -0.27 0.00 -2.04 0.00 0.00 64.34 61.41 3a9t n VAL 416 Cb 0.44 0.51 -0.17 0.00 -1.47 0.00 0.00 33.84 33.15 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 -2.59 0.15 0.31 1.34 1.01 -1.26 -4.07 121.20 116.08 3a9t s ILE 417 Ca 0.11 -0.36 0.07 0.00 0.00 0.00 0.00 60.65 60.47 3a9t s ILE 417 Cb -0.01 -0.78 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 3a9t s ILE 417 CO 0.08 -0.29 0.32 -1.59 0.00 0.00 0.00 174.94 173.46 3a9t s LYS 418 N 2.03 2.94 0.53 2.79 -2.85 -1.26 -4.87 119.74 119.04 3a9t s LYS 418 Ca 0.01 -1.12 -0.22 0.00 -1.00 0.00 0.00 55.97 53.64 3a9t s LYS 418 Cb -0.16 -2.62 -0.05 0.00 -2.06 0.00 0.00 37.83 32.93 3a9t s LYS 418 CO -0.10 0.18 1.33 -2.14 0.10 0.00 0.00 175.35 174.72 3a9t s PRO 419 N -4.01 3.24 0.55 1.78 0.02 -1.26 -4.70 135.00 130.62 3a9t s PRO 419 Ca 0.40 2.18 0.31 0.00 0.02 0.00 0.00 61.00 63.90 3a9t s PRO 419 Cb -0.07 -2.29 1.47 0.00 0.02 0.00 0.00 34.50 33.63 3a9t s PRO 419 CO 0.28 -1.09 1.89 0.10 -0.33 0.00 0.00 177.00 177.84 3a9t h TYR 420 N 1.57 0.00 0.00 6.54 -0.00 -1.84 0.12 116.97 123.35 3a9t h TYR 420 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.22 3a9t h TYR 420 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.02 3a9t h TYR 420 CO 0.47 0.00 0.00 2.48 -0.00 0.00 0.00 178.16 181.11 3a9t n TYR 421 N -4.16 0.00 -0.09 0.10 4.11 -1.26 -2.61 117.16 113.24 3a9t n TYR 421 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.06 3a9t n TYR 421 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.24 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 -0.60 -0.54 -2.16 -3.48 1.02 0.03 -5.06 120.64 109.85 3a9t n GLU 422 Ca 0.04 -0.43 -0.37 0.00 -0.02 0.00 0.00 57.16 56.38 3a9t n GLU 422 Cb 0.02 -0.92 -0.00 0.00 -0.02 0.00 0.00 31.44 30.51 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 -0.09 4.01 0.17 -4.62 1.43 -1.07 -5.00 118.68 113.50 3a9t s LEU 423 Ca 0.00 2.41 0.08 0.00 -1.03 0.00 0.00 54.13 55.58 3a9t s LEU 423 Cb 0.00 -4.22 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 3a9t s LEU 423 CO 0.00 -1.02 -0.02 0.42 0.23 0.00 0.00 176.35 175.96 3a9t s THR 424 N -1.48 3.62 0.57 5.49 -4.23 -1.26 -4.99 115.64 113.37 3a9t s THR 424 Ca 0.64 -1.46 0.28 0.00 -1.18 0.00 0.00 61.69 59.98 3a9t s THR 424 Cb -0.31 -2.81 0.40 0.00 1.34 0.00 0.00 72.50 71.11 3a9t s THR 424 CO 0.38 -0.10 1.94 0.44 -0.54 0.00 0.00 174.62 176.74 3a9t h ASP 425 N 2.76 0.00 -0.14 3.99 3.32 -2.00 0.12 116.42 124.47 3a9t h ASP 425 Ca -0.47 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 3a9t h ASP 425 Cb 1.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 3a9t h ASP 425 CO 0.57 0.00 -0.12 -0.08 -1.72 0.00 0.00 179.24 177.89 3a9t h GLU 426 N 0.00 0.33 0.13 3.56 4.57 -1.98 -1.49 114.58 119.70 3a9t h GLU 426 Ca 0.23 -0.17 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 3a9t h GLU 426 Cb 1.13 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.69 3a9t h GLU 426 CO -0.00 0.71 -0.26 -0.44 -1.18 0.00 0.00 179.01 177.83 3a9t h ASP 427 N -0.04 -0.74 0.01 1.04 3.32 -1.14 0.56 116.42 119.43 3a9t h ASP 427 Ca 0.02 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.18 3a9t h ASP 427 Cb 0.64 0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 3a9t h ASP 427 CO 0.03 -0.36 -0.17 0.40 -1.72 0.00 0.00 179.24 177.43 3a9t h ILE 428 N -0.48 0.59 -0.28 0.35 2.04 -1.49 -1.35 117.51 116.89 3a9t h ILE 428 Ca 0.03 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.95 3a9t h ILE 428 Cb 0.50 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 37.10 3a9t h ILE 428 CO -0.14 0.00 -0.17 0.50 0.00 0.00 0.00 178.15 178.33 3a9t h LYS 429 N -0.28 -0.14 -0.30 2.37 3.11 -0.95 -1.72 116.57 118.65 3a9t h LYS 429 Ca 0.05 0.01 -0.06 0.00 -2.81 0.00 0.00 60.65 57.84 3a9t h LYS 429 Cb 0.35 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.59 3a9t h LYS 429 CO -0.15 -0.09 -0.06 0.87 -2.81 0.00 0.00 179.45 177.20 3a9t h LYS 430 N -0.15 0.47 -0.82 1.90 1.57 -0.71 -1.47 116.57 117.37 3a9t h LYS 430 Ca 0.15 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 3a9t h LYS 430 Cb 0.37 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 3a9t h LYS 430 CO -0.37 0.55 0.40 0.00 -0.57 0.00 0.00 179.45 179.47 3a9t h LEU 432 N 1.17 0.94 -0.95 0.00 3.38 -0.80 -3.15 115.31 115.90 3a9t h LEU 432 Ca 0.28 -0.47 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 3a9t h LEU 432 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3a9t h LEU 432 CO -0.04 1.26 -0.10 -0.33 0.09 0.00 0.00 178.44 179.32 3a9t h GLU 433 N 0.68 0.66 0.00 1.13 5.08 -0.87 -2.70 114.58 118.57 3a9t h GLU 433 Ca 0.03 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 3a9t h GLU 433 Cb 1.07 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3a9t h GLU 433 CO 0.11 0.75 0.00 0.00 -1.00 0.00 0.00 179.01 178.86 3a9t n ALA 434 N -2.48 2.12 -2.42 3.43 0.00 -0.28 -4.79 120.51 116.09 3a9t n ALA 434 Ca 0.01 -0.11 -0.29 0.00 0.00 0.00 0.00 53.44 53.06 3a9t n ALA 434 Cb 0.34 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.35 3a9t n ALA 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3a9t s THR 435 N -2.29 2.40 -0.03 0.00 2.01 -1.02 -4.50 115.64 112.21 3a9t s THR 435 Ca 0.24 -1.74 0.02 0.00 0.31 0.00 0.00 61.69 60.52 3a9t s THR 435 Cb 0.13 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.56 3a9t s THR 435 CO 0.26 0.07 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.06 3a9t s GLN 436 N -2.15 1.06 -0.46 4.92 -0.21 -0.36 -4.60 119.66 117.85 3a9t s GLN 436 Ca 0.16 -0.32 -0.17 0.00 0.02 0.00 0.00 55.36 55.05 3a9t s GLN 436 Cb -0.10 -0.97 0.05 0.00 1.00 0.00 0.00 33.01 32.99 3a9t s GLN 436 CO 0.07 0.10 0.49 -0.06 -2.12 0.00 0.00 175.29 173.77 3a9t s PHE 437 N 0.27 3.15 0.02 0.91 0.40 -0.20 -0.77 117.98 121.76 3a9t s PHE 437 Ca -0.05 -0.59 -0.14 0.00 -0.60 0.00 0.00 56.93 55.55 3a9t s PHE 437 Cb -0.10 -3.19 -0.06 0.00 0.51 0.00 0.00 43.02 40.19 3a9t s PHE 437 CO 0.01 -0.84 0.41 1.03 0.70 0.00 0.00 175.22 176.53 3a9t s ARG 438 N 2.16 3.89 0.15 0.44 1.81 -0.59 -1.36 118.95 125.45 3a9t s ARG 438 Ca 0.11 0.38 -0.32 0.00 -1.72 0.00 0.00 55.73 54.18 3a9t s ARG 438 Cb -0.20 -3.18 -0.12 0.00 -0.45 0.00 0.00 34.95 31.01 3a9t s ARG 438 CO 0.11 0.67 1.77 -2.30 -0.68 0.00 0.00 175.30 174.87 3a9t n PRO 439 N 1.65 2.68 -1.48 3.54 -0.02 -1.26 0.14 135.00 140.25 3a9t n PRO 439 Ca -0.13 0.97 -0.40 0.00 -2.02 0.00 0.00 63.50 61.92 3a9t n PRO 439 Cb 0.52 -2.83 0.02 0.00 -0.02 0.00 0.00 33.50 31.19 3a9t n PRO 439 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a9t n ALA 440 N 4.88 -1.15 -2.45 3.55 0.00 -0.43 -4.71 120.51 120.19 3a9t n ALA 440 Ca 0.17 0.09 -0.41 0.00 0.00 0.00 0.00 53.44 53.29 3a9t n ALA 440 Cb 0.35 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 17.94 3a9t n ALA 440 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3a9t s SER 441 N -1.02 6.10 0.64 0.00 0.01 -1.26 -4.86 113.70 113.31 3a9t s SER 441 Ca 0.65 -0.06 0.32 0.00 1.31 0.00 0.00 55.95 58.17 3a9t s SER 441 Cb -0.53 -2.55 1.73 0.00 0.21 0.00 0.00 66.02 64.88 3a9t s SER 441 CO 0.56 -1.80 2.02 0.71 0.41 0.00 0.00 173.24 175.14 3a9t h THR 442 N 6.24 0.16 0.00 1.44 1.35 -1.80 0.19 112.91 120.49 3a9t h THR 442 Ca -0.27 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.55 3a9t h THR 442 Cb 1.08 0.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 3a9t h THR 442 CO 1.23 0.00 -0.18 1.05 -0.25 0.00 0.00 175.52 177.37 3a9t h GLU 443 N 0.00 0.00 0.00 4.72 4.11 -1.90 -2.70 114.58 118.81 3a9t h GLU 443 Ca 0.05 0.00 -0.41 0.00 0.07 0.00 0.00 59.36 59.07 3a9t h GLU 443 Cb 0.62 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 3a9t h GLU 443 CO -0.00 0.18 -2.40 0.66 0.07 0.00 0.00 179.01 177.52 3a9t n TYR 444 N -3.39 0.00 -3.55 2.06 4.01 0.01 -4.78 117.16 111.51 3a9t n TYR 444 Ca -0.00 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.41 3a9t n TYR 444 Cb 0.38 -0.91 -0.07 0.00 -0.31 0.00 0.00 39.34 38.43 3a9t n TYR 444 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3a9t n PHE 445 N -3.90 3.65 -0.17 -0.72 3.72 0.46 -4.86 117.46 115.63 3a9t n PHE 445 Ca -0.48 -3.98 0.25 0.00 -0.05 0.00 0.00 57.45 53.19 3a9t n PHE 445 Cb 0.88 -0.90 0.66 0.00 -0.94 0.00 0.00 39.48 39.18 3a9t n PHE 445 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3a9t h ARG 446 N 5.31 0.10 0.00 -1.08 3.08 -1.42 -0.99 114.38 119.39 3a9t h ARG 446 Ca 0.18 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3a9t h ARG 446 Cb 0.73 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.76 3a9t h ARG 446 CO 0.89 0.07 0.00 0.41 -1.07 0.00 0.00 179.97 180.26 3a9t n GLY 447 N -1.65 -1.26 1.06 0.04 0.00 0.09 -4.84 105.19 98.63 3a9t n GLY 447 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 1.03 -1.70 0.00 -0.02 0.00 -0.37 -2.60 105.19 101.52 3a9t n GLY 448 Ca 0.09 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 0.30 2.93 -0.02 0.00 -1.26 -0.97 105.19 106.17 3a9t n GLY 449 Ca 0.00 -2.28 -0.14 0.00 0.00 0.00 0.00 46.02 43.60 3a9t n GLY 449 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a9t s TYR 450 N -0.17 -0.21 0.32 1.61 2.02 -1.26 -1.32 117.35 118.34 3a9t s TYR 450 Ca 0.00 0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 57.26 3a9t s TYR 450 Cb 0.00 -0.10 -0.04 0.00 -0.40 0.00 0.00 41.96 41.42 3a9t s TYR 450 CO 0.00 -0.21 0.55 -1.54 -1.57 0.00 0.00 175.55 172.78 3a9t s SER 451 N 1.48 6.36 -0.23 2.29 1.04 0.12 -3.47 113.70 121.30 3a9t s SER 451 Ca -0.06 0.58 -0.19 0.00 0.48 0.00 0.00 55.95 56.77 3a9t s SER 451 Cb -0.12 -2.09 -0.03 0.00 0.10 0.00 0.00 66.02 63.89 3a9t s SER 451 CO -0.06 -0.25 0.54 -0.89 0.98 0.00 0.00 173.24 173.56 3a9t s THR 452 N -2.21 5.07 -0.26 2.02 2.01 0.13 -1.54 115.64 120.87 3a9t s THR 452 Ca 0.42 0.97 -0.00 0.00 0.31 0.00 0.00 61.69 63.38 3a9t s THR 452 Cb -0.10 -3.86 0.04 0.00 0.01 0.00 0.00 72.50 68.60 3a9t s THR 452 CO 0.33 0.12 -0.07 -0.62 -0.69 0.00 0.00 174.62 173.70 3a9t s ASP 453 N 1.34 4.42 0.24 3.53 2.15 0.05 -1.13 116.67 127.28 3a9t s ASP 453 Ca 0.24 -1.13 -0.17 0.00 0.43 0.00 0.00 52.55 51.91 3a9t s ASP 453 Cb -0.16 -1.63 0.02 0.00 -0.30 0.00 0.00 42.92 40.85 3a9t s ASP 453 CO 0.09 -0.17 0.58 0.72 -0.17 0.00 0.00 175.17 176.22 3a9t s PHE 454 N 1.23 -0.00 -0.16 -5.34 -0.12 -1.26 -1.22 117.98 111.10 3a9t s PHE 454 Ca -0.04 -0.39 0.00 0.00 -0.05 0.00 0.00 56.93 56.46 3a9t s PHE 454 Cb -0.18 0.45 0.03 0.00 -0.63 0.00 0.00 43.02 42.69 3a9t s PHE 454 CO -0.04 -1.06 -0.10 -1.17 -0.05 0.00 0.00 175.22 172.80 3a9t s LEU 455 N -2.93 1.76 0.21 -1.99 2.96 -1.26 -1.38 118.68 116.05 3a9t s LEU 455 Ca 0.14 -0.62 -0.31 0.00 -0.22 0.00 0.00 54.13 53.12 3a9t s LEU 455 Cb -0.03 -1.07 -0.11 0.00 0.50 0.00 0.00 46.19 45.48 3a9t s LEU 455 CO 0.04 -0.12 1.60 -0.89 -1.32 0.00 0.00 176.35 175.66 3a9t s THR 456 N 1.53 2.36 0.25 3.68 2.01 -0.72 -4.83 115.64 119.93 3a9t s THR 456 Ca 0.02 0.27 -0.30 0.00 0.31 0.00 0.00 61.69 62.00 3a9t s THR 456 Cb -0.14 -3.17 -0.10 0.00 0.01 0.00 0.00 72.50 69.09 3a9t s THR 456 CO -0.09 0.03 1.38 -0.54 -0.69 0.00 0.00 174.62 174.71 3a9t s LYS 457 N 0.71 4.32 0.75 4.92 1.02 -0.82 -4.76 119.74 125.88 3a9t s LYS 457 Ca 0.69 2.22 -0.12 0.00 0.02 0.00 0.00 55.97 58.78 3a9t s LYS 457 Cb -0.46 -3.12 0.04 0.00 -0.52 0.00 0.00 37.83 33.77 3a9t s LYS 457 CO 0.35 -0.33 1.11 0.20 -0.92 0.00 0.00 175.35 175.77 3a9t s GLY 458 N 0.18 1.62 0.00 -3.33 0.00 -1.26 -4.23 107.32 100.31 3a9t s GLY 458 Ca 0.56 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.95 3a9t s GLY 458 CO 0.44 0.07 0.00 0.61 0.00 0.00 0.00 173.10 174.22 3a9t n GLY 459 N -2.74 0.76 3.67 0.20 0.00 0.21 -4.78 105.19 102.50 3a9t n GLY 459 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.58 4.23 0.26 1.61 0.00 -1.24 -4.82 119.30 118.75 3a9t s MET 460 Ca 0.00 0.60 -0.30 0.00 0.00 0.00 0.00 55.69 55.99 3a9t s MET 460 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 34.83 31.17 3a9t s MET 460 CO 0.00 -0.20 1.33 -1.25 0.00 0.00 0.00 175.02 174.90 3a9t s PRO 461 N 1.77 4.37 0.18 4.11 0.04 -1.26 -0.97 135.00 143.23 3a9t s PRO 461 Ca 0.29 2.14 -0.07 0.00 0.04 0.00 0.00 61.00 63.40 3a9t s PRO 461 Cb -0.16 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 3a9t s PRO 461 CO 0.11 -0.24 0.25 0.14 0.04 0.00 0.00 177.00 177.30 3a9t s VAL 462 N -0.37 0.05 -0.08 -0.36 -7.23 0.46 0.38 120.40 113.24 3a9t s VAL 462 Ca 0.54 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 59.12 3a9t s VAL 462 Cb -0.38 -2.05 0.03 0.00 0.56 0.00 0.00 36.38 34.53 3a9t s VAL 462 CO 0.44 -0.22 -0.02 -0.89 -0.31 0.00 0.00 175.10 174.09 3a9t s THR 463 N -4.02 0.56 -0.04 5.32 2.01 0.21 -0.57 115.64 119.10 3a9t s THR 463 Ca 0.23 -0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.20 3a9t s THR 463 Cb 0.04 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 3a9t s THR 463 CO 0.04 0.28 0.10 0.27 -0.69 0.00 0.00 174.62 174.62 3a9t s ILE 464 N 1.76 4.93 0.12 1.82 -4.36 -0.00 -1.29 121.20 124.18 3a9t s ILE 464 Ca 0.03 -0.21 -0.10 0.00 -0.26 0.00 0.00 60.65 60.11 3a9t s ILE 464 Cb -0.13 -3.21 0.00 0.00 1.25 0.00 0.00 42.46 40.37 3a9t s ILE 464 CO -0.05 0.45 0.25 -0.94 0.24 0.00 0.00 174.94 174.88 3a9t s SER 465 N -1.47 0.05 -0.25 4.36 1.04 -0.89 -0.93 113.70 115.61 3a9t s SER 465 Ca 0.20 -0.69 -0.14 0.00 0.48 0.00 0.00 55.95 55.80 3a9t s SER 465 Cb -0.12 0.39 0.07 0.00 0.10 0.00 0.00 66.02 66.46 3a9t s SER 465 CO 0.11 -0.80 0.61 -0.60 0.98 0.00 0.00 173.24 173.53 3a9t s ARG 466 N -3.89 0.62 -0.20 4.02 6.06 -0.73 -1.46 118.95 123.37 3a9t s ARG 466 Ca 0.09 1.09 -0.07 0.00 -2.50 0.00 0.00 55.73 54.33 3a9t s ARG 466 Cb 0.04 0.11 -0.04 0.00 0.06 0.00 0.00 34.95 35.12 3a9t s ARG 466 CO -0.07 -0.15 0.07 -1.17 -2.50 0.00 0.00 175.30 171.47 3a9t s LEU 467 N 1.50 3.75 0.24 -0.88 2.96 -1.26 -1.64 118.68 123.34 3a9t s LEU 467 Ca -0.09 0.02 0.08 0.00 -0.22 0.00 0.00 54.13 53.92 3a9t s LEU 467 Cb -0.06 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 3a9t s LEU 467 CO -0.17 0.13 -0.14 0.20 -1.32 0.00 0.00 176.35 175.05 3a9t s ASN 468 N 0.64 2.85 -0.22 3.68 0.01 -0.63 -4.65 114.94 116.61 3a9t s ASN 468 Ca 0.03 -1.06 0.01 0.00 -0.71 0.00 0.00 52.86 51.13 3a9t s ASN 468 Cb -0.13 -0.18 0.03 0.00 0.41 0.00 0.00 41.25 41.38 3a9t s ASN 468 CO 0.02 -0.16 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.68 3a9t s ILE 469 N -2.87 2.37 -0.17 0.60 1.01 -1.26 -1.41 121.20 119.46 3a9t s ILE 469 Ca 0.26 -1.12 -0.04 0.00 0.00 0.00 0.00 60.65 59.74 3a9t s ILE 469 Cb -0.01 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 3a9t s ILE 469 CO 0.10 0.29 -0.03 -0.69 0.00 0.00 0.00 174.94 174.61 3a9t s VAL 470 N 1.26 3.83 0.16 2.92 1.01 -0.71 -4.94 120.40 123.93 3a9t s VAL 470 Ca 0.00 -0.37 -0.33 0.00 0.00 0.00 0.00 61.98 61.28 3a9t s VAL 470 Cb -0.16 -2.70 -0.13 0.00 0.00 0.00 0.00 36.38 33.40 3a9t s VAL 470 CO -0.08 0.47 1.68 1.17 0.00 0.00 0.00 175.10 178.34 3a9t n LYS 471 N 3.84 2.45 -0.30 2.72 3.00 -1.26 0.15 118.16 128.76 3a9t n LYS 471 Ca -0.17 0.88 0.00 0.00 -0.00 0.00 0.00 58.31 59.02 3a9t n LYS 471 Cb 0.52 -2.70 0.00 0.00 0.00 0.00 0.00 35.03 32.85 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 3.77 0.94 1.49 3.14 0.00 -1.26 -4.79 105.19 108.48 3a9t n GLY 472 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 0.08 0.00 0.99 7.94 -0.02 -5.16 117.00 120.83 3a9t n LEU 473 Ca 0.00 0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 3a9t n LEU 473 Cb 0.00 0.01 0.00 0.00 0.53 0.00 0.00 43.42 43.96 3a9t n LEU 473 CO 0.00 -0.33 0.00 0.61 -1.11 0.00 0.00 177.39 176.56 3a9t n GLY 474 N 2.32 -0.47 3.77 -3.96 0.00 0.12 -4.95 105.19 102.01 3a9t n GLY 474 Ca 0.00 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 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 3.92 -0.10 1.61 0.04 -1.26 -1.73 135.00 137.48 3a9t s PRO 475 Ca 0.00 2.08 -0.13 0.00 0.04 0.00 0.00 61.00 62.99 3a9t s PRO 475 Cb 0.00 -2.69 0.03 0.00 0.04 0.00 0.00 34.50 31.88 3a9t s PRO 475 CO 0.00 -0.51 0.34 0.54 0.04 0.00 0.00 177.00 177.42 3a9t s VAL 476 N -1.31 0.02 -0.02 -0.36 0.11 -0.50 -4.21 120.40 114.13 3a9t s VAL 476 Ca 0.58 -0.13 0.07 0.00 -2.93 0.00 0.00 61.98 59.58 3a9t s VAL 476 Cb -0.36 -0.53 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 3a9t s VAL 476 CO 0.46 -0.07 -0.24 -0.22 -3.33 0.00 0.00 175.10 171.69 3a9t s LEU 477 N -0.23 2.05 -0.01 2.54 2.96 -0.04 -1.61 118.68 124.33 3a9t s LEU 477 Ca -0.04 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 53.50 3a9t s LEU 477 Cb -0.03 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 3a9t s LEU 477 CO 0.02 0.29 -0.26 0.00 -1.32 0.00 0.00 176.35 175.08 3a9t s GLN 478 N -0.52 2.09 0.00 1.98 -2.07 -0.65 -1.97 119.66 118.52 3a9t s GLN 478 Ca 0.08 -0.94 0.03 0.00 -1.82 0.00 0.00 55.36 52.71 3a9t s GLN 478 Cb -0.10 -2.04 -0.01 0.00 -1.09 0.00 0.00 33.01 29.77 3a9t s GLN 478 CO -0.00 0.56 -0.10 0.42 -1.32 0.00 0.00 175.29 174.84 3a9t s ILE 479 N -0.63 0.78 -0.16 3.63 1.01 0.21 -1.78 121.20 124.26 3a9t s ILE 479 Ca 0.10 -0.55 -0.05 0.00 0.00 0.00 0.00 60.65 60.16 3a9t s ILE 479 Cb -0.10 -0.68 0.06 0.00 0.01 0.00 0.00 42.46 41.75 3a9t s ILE 479 CO -0.01 0.13 0.08 0.00 0.00 0.00 0.00 174.94 175.14 3a9t s ALA 480 N -0.41 0.44 0.11 9.38 0.00 -0.11 -3.48 121.76 127.69 3a9t s ALA 480 Ca 0.02 -0.28 -0.15 0.00 0.00 0.00 0.00 51.96 51.56 3a9t s ALA 480 Cb -0.05 -1.00 -0.07 0.00 0.00 0.00 0.00 23.12 22.01 3a9t s ALA 480 CO -0.00 -1.10 0.53 -1.21 0.00 0.00 0.00 175.76 173.98 3a9t s GLU 481 N 2.13 4.00 0.00 0.00 2.02 -1.26 -0.82 118.70 124.76 3a9t s GLU 481 Ca 0.02 0.51 0.00 0.00 0.02 0.00 0.00 54.97 55.52 3a9t s GLU 481 Cb -0.16 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.05 3a9t s GLU 481 CO -0.08 0.54 0.00 0.41 0.02 0.00 0.00 175.26 176.14 3a9t n GLY 482 N 1.09 1.86 3.12 -1.39 0.00 0.26 -0.77 105.19 109.37 3a9t n GLY 482 Ca -0.07 -0.41 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.31 0.37 0.33 1.61 1.51 -0.26 -0.41 117.35 119.19 3a9t s TYR 483 Ca 0.00 -0.86 -0.07 0.00 -1.01 0.00 0.00 57.07 55.13 3a9t s TYR 483 Cb 0.00 -0.26 -0.06 0.00 -0.11 0.00 0.00 41.96 41.53 3a9t s TYR 483 CO 0.00 -0.42 0.63 0.95 -1.11 0.00 0.00 175.55 175.60 3a9t s THR 484 N -3.72 4.94 0.12 -0.71 -4.23 -0.15 -1.36 115.64 110.53 3a9t s THR 484 Ca 0.05 0.27 0.04 0.00 -1.18 0.00 0.00 61.69 60.87 3a9t s THR 484 Cb 0.06 -3.73 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 3a9t s THR 484 CO -0.10 -0.38 -0.10 0.68 -0.54 0.00 0.00 174.62 174.18 3a9t s VAL 485 N -2.17 1.02 -0.05 2.29 -7.23 -0.18 0.64 120.40 114.72 3a9t s VAL 485 Ca 0.47 -1.84 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 3a9t s VAL 485 Cb -0.11 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 3a9t s VAL 485 CO 0.30 -0.66 0.11 -1.81 -0.31 0.00 0.00 175.10 172.72 3a9t s ASP 486 N -2.79 5.93 0.18 4.85 1.01 -1.26 -4.18 116.67 120.41 3a9t s ASP 486 Ca 0.11 0.27 0.11 0.00 0.71 0.00 0.00 52.55 53.74 3a9t s ASP 486 Cb 0.00 -1.79 -0.04 0.00 1.01 0.00 0.00 42.92 42.09 3a9t s ASP 486 CO -0.00 0.32 -0.21 -0.76 0.21 0.00 0.00 175.17 174.73 3a9t s LEU 487 N -1.48 2.55 0.29 1.23 1.43 -1.26 -5.02 118.68 116.42 3a9t s LEU 487 Ca 0.20 -0.79 -0.30 0.00 -1.03 0.00 0.00 54.13 52.22 3a9t s LEU 487 Cb -0.12 -1.29 -0.12 0.00 0.03 0.00 0.00 46.19 44.69 3a9t s LEU 487 CO 0.11 0.12 1.48 -2.65 0.23 0.00 0.00 176.35 175.64 3a9t n PRO 488 N 0.29 2.39 -0.29 1.29 -0.02 -1.26 -4.66 135.00 132.74 3a9t n PRO 488 Ca -0.13 0.85 0.11 0.00 -2.02 0.00 0.00 63.50 62.31 3a9t n PRO 488 Cb 0.55 -2.55 0.25 0.00 -0.02 0.00 0.00 33.50 31.73 3a9t n PRO 488 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9t h GLU 489 N 4.08 0.14 -0.82 -0.52 4.81 -1.99 0.47 114.58 120.76 3a9t h GLU 489 Ca -0.46 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 58.83 3a9t h GLU 489 Cb 1.25 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.53 3a9t h GLU 489 CO 0.74 0.09 0.49 1.49 -0.73 0.00 0.00 179.01 181.09 3a9t h GLU 490 N 0.15 0.83 -0.28 1.92 4.81 -2.01 -1.46 114.58 118.54 3a9t h GLU 490 Ca 0.51 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.54 3a9t h GLU 490 Cb 1.00 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 3a9t h GLU 490 CO -0.69 0.55 -0.44 0.28 -0.73 0.00 0.00 179.01 177.98 3a9t h VAL 491 N 0.86 1.29 -0.52 0.32 2.07 -0.49 -3.12 116.25 116.65 3a9t h VAL 491 Ca 0.38 -1.63 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 3a9t h VAL 491 Cb 0.26 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 3a9t h VAL 491 CO -0.21 0.52 0.31 -0.74 0.02 0.00 0.00 177.57 177.48 3a9t h HIS 492 N 0.55 0.69 -0.50 1.57 -0.00 -0.54 -2.83 115.15 114.08 3a9t h HIS 492 Ca 0.02 -0.00 0.05 0.00 -0.00 0.00 0.00 60.37 60.44 3a9t h HIS 492 Cb 1.04 -0.23 -0.05 0.00 -0.00 0.00 0.00 27.41 28.17 3a9t h HIS 492 CO 0.08 0.48 0.23 -0.44 -0.00 0.00 0.00 177.93 178.27 3a9t h ASP 493 N 0.70 0.30 -0.77 3.26 3.32 -1.29 0.28 116.42 122.22 3a9t h ASP 493 Ca 0.19 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 3a9t h ASP 493 Cb -0.01 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 3a9t h ASP 493 CO -0.04 0.21 0.32 0.58 -1.72 0.00 0.00 179.24 178.59 3a9t h VAL 494 N 0.44 1.26 0.02 -1.35 2.07 -1.47 0.30 116.25 117.52 3a9t h VAL 494 Ca 0.23 -0.79 -0.23 0.00 0.82 0.00 0.00 66.70 66.72 3a9t h VAL 494 Cb 0.17 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3a9t h VAL 494 CO -0.18 0.32 -0.98 -0.07 0.02 0.00 0.00 177.57 176.67 3a9t h LEU 495 N 1.11 0.53 -0.07 2.57 3.38 -1.24 -3.27 115.31 118.33 3a9t h LEU 495 Ca 0.26 -0.44 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 3a9t h LEU 495 Cb 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3a9t h LEU 495 CO -0.02 1.25 -0.32 -0.78 0.09 0.00 0.00 178.44 178.66 3a9t h ASP 496 N 0.21 0.40 0.03 -0.43 3.58 -0.24 -3.25 116.42 116.73 3a9t h ASP 496 Ca -0.09 -0.65 -0.01 0.00 0.42 0.00 0.00 57.03 56.71 3a9t h ASP 496 Cb 1.63 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 42.56 3a9t h ASP 496 CO 0.17 0.98 -0.03 0.11 -2.88 0.00 0.00 179.24 177.59 3a9t h LYS 497 N -0.16 0.00 -0.50 0.28 1.79 -0.52 -2.14 116.57 115.32 3a9t h LYS 497 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 3a9t h LYS 497 Cb 0.97 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.62 3a9t h LYS 497 CO 0.07 0.03 0.00 2.89 -1.08 0.00 0.00 179.45 181.35 3a9t n ARG 498 N -4.40 2.18 0.00 3.15 1.85 -1.23 -4.63 116.66 113.58 3a9t n ARG 498 Ca -0.03 -1.83 0.00 0.00 -1.00 0.00 0.00 57.85 54.99 3a9t n ARG 498 Cb 0.11 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 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 0.99 0.00 -2.74 8.89 -1.04 -0.82 -5.07 114.28 114.49 3a9t n THR 499 Ca 0.17 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.14 3a9t n THR 499 Cb 0.43 -0.37 0.02 0.00 -1.82 0.00 0.00 70.33 68.59 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 -0.58 -3.06 0.00 8.00 8.00 -1.13 -5.04 116.55 122.73 3a9t n ASP 500 Ca 0.00 -2.54 0.01 0.00 0.71 0.00 0.00 54.79 52.97 3a9t n ASP 500 Cb 0.00 1.56 0.05 0.00 -0.02 0.00 0.00 41.12 42.71 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 2.84 0.02 -0.15 -0.24 -0.04 -1.18 -1.93 135.00 134.32 3a9t n PRO 501 Ca 0.17 0.33 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 3a9t n PRO 501 Cb 0.58 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.73 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 0.41 -3.90 0.52 -2.24 -1.26 -4.93 114.28 101.52 3a9t n THR 502 Ca 0.01 -0.70 -0.22 0.00 -2.27 0.00 0.00 64.05 60.87 3a9t n THR 502 Cb 0.02 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 69.30 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 -1.58 2.87 0.07 4.78 0.51 -0.81 -4.14 118.94 120.63 3a9t s TRP 503 Ca 0.37 -0.31 -0.28 0.00 -2.12 0.00 0.00 56.10 53.76 3a9t s TRP 503 Cb 0.22 -1.74 -0.05 0.00 -0.81 0.00 0.00 33.47 31.09 3a9t s TRP 503 CO 0.31 0.24 0.89 -1.25 -0.51 0.00 0.00 176.95 176.63 3a9t s PRO 504 N -3.95 4.60 0.05 4.98 0.04 -0.28 -4.32 135.00 136.12 3a9t s PRO 504 Ca 0.40 1.29 0.04 0.00 0.04 0.00 0.00 61.00 62.78 3a9t s PRO 504 Cb -0.05 -3.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 3a9t s PRO 504 CO 0.26 0.19 -0.05 0.99 0.04 0.00 0.00 177.00 178.43 3a9t s THR 505 N 0.16 3.73 -0.09 1.26 2.01 -0.48 -4.08 115.64 118.14 3a9t s THR 505 Ca 0.44 -0.94 -0.04 0.00 0.31 0.00 0.00 61.69 61.47 3a9t s THR 505 Cb -0.22 -2.70 0.05 0.00 0.01 0.00 0.00 72.50 69.64 3a9t s THR 505 CO 0.27 0.25 0.19 -0.89 -0.69 0.00 0.00 174.62 173.75 3a9t s THR 506 N -1.14 -0.26 -0.33 -0.82 2.01 -0.71 -1.76 115.64 112.64 3a9t s THR 506 Ca 0.21 0.30 -0.19 0.00 0.31 0.00 0.00 61.69 62.31 3a9t s THR 506 Cb -0.11 -0.33 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 3a9t s THR 506 CO 0.12 0.12 0.59 0.26 -0.69 0.00 0.00 174.62 175.02 3a9t s TRP 507 N 2.10 3.19 0.01 4.92 0.52 -1.26 -1.84 118.94 126.58 3a9t s TRP 507 Ca 0.00 0.42 0.03 0.00 0.02 0.00 0.00 56.10 56.57 3a9t s TRP 507 Cb -0.12 -2.98 -0.03 0.00 -1.15 0.00 0.00 33.47 29.19 3a9t s TRP 507 CO -0.07 -0.51 -0.04 0.12 0.02 0.00 0.00 176.95 176.47 3a9t s PHE 508 N 2.55 2.95 -0.07 -1.98 5.36 -0.38 -1.02 117.98 125.38 3a9t s PHE 508 Ca 0.23 -0.00 -0.02 0.00 -0.96 0.00 0.00 56.93 56.17 3a9t s PHE 508 Cb -0.15 -1.62 0.03 0.00 -0.34 0.00 0.00 43.02 40.94 3a9t s PHE 508 CO 0.13 0.41 0.03 0.08 -1.46 0.00 0.00 175.22 174.41 3a9t s VAL 509 N -1.04 0.15 0.25 3.12 1.01 -0.46 -0.63 120.40 122.80 3a9t s VAL 509 Ca 0.18 0.18 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 3a9t s VAL 509 Cb -0.11 -0.41 -0.08 0.00 0.00 0.00 0.00 36.38 35.77 3a9t s VAL 509 CO 0.09 0.16 0.69 -2.16 0.00 0.00 0.00 175.10 173.88 3a9t s PRO 510 N 2.06 4.08 0.36 2.72 0.04 -1.26 -1.11 135.00 141.89 3a9t s PRO 510 Ca 0.04 0.69 -0.28 0.00 0.04 0.00 0.00 61.00 61.50 3a9t s PRO 510 Cb -0.13 -2.69 -0.10 0.00 0.04 0.00 0.00 34.50 31.63 3a9t s PRO 510 CO -0.05 0.30 1.28 -0.80 0.04 0.00 0.00 177.00 177.78 3a9t s ASN 511 N -1.97 6.62 0.28 6.66 0.01 0.05 -4.94 114.94 121.65 3a9t s ASN 511 Ca 0.47 2.63 0.06 0.00 -0.71 0.00 0.00 52.86 55.31 3a9t s ASN 511 Cb -0.13 -2.64 -0.02 0.00 0.41 0.00 0.00 41.25 38.86 3a9t s ASN 511 CO 0.19 -0.63 0.37 -0.76 -1.51 0.00 0.00 177.10 174.76 3a9t s LEU 512 N -2.05 4.08 0.00 0.60 1.43 -1.26 -4.91 118.68 116.57 3a9t s LEU 512 Ca 0.52 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 3a9t s LEU 512 Cb -0.38 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.14 3a9t s LEU 512 CO 0.50 -0.21 0.04 0.35 0.23 0.00 0.00 176.35 177.27 3a9t n THR 513 N -1.45 0.00 -0.81 5.49 -2.24 -0.47 -5.00 114.28 109.79 3a9t n THR 513 Ca -0.05 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 3a9t n THR 513 Cb 0.58 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 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 0.26 0.99 3.51 3.38 0.00 -1.08 -4.96 105.19 107.29 3a9t n GLY 514 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3a9t n GLY 514 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a9t s GLU 515 N -0.16 1.90 1.28 1.61 2.02 -1.26 -4.70 118.70 119.39 3a9t s GLU 515 Ca 0.00 -2.15 0.00 0.00 0.02 0.00 0.00 54.97 52.84 3a9t s GLU 515 Cb 0.00 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.55 3a9t s GLU 515 CO 0.00 -0.44 0.00 0.41 0.02 0.00 0.00 175.26 175.25 3a9t n GLY 516 N -0.89 2.42 0.94 -1.39 0.00 -1.26 -1.39 105.19 103.61 3a9t n GLY 516 Ca -0.06 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 45.93 3a9t n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a9t n ALA 517 N 7.29 2.81 -1.77 4.61 0.00 -1.26 -4.01 120.51 128.17 3a9t n ALA 517 Ca 0.00 -0.80 0.06 0.00 0.00 0.00 0.00 53.44 52.69 3a9t n ALA 517 Cb 0.00 -1.02 0.16 0.00 0.00 0.00 0.00 19.45 18.59 3a9t n ALA 517 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a9t n PHE 518 N 0.46 0.00 0.18 0.00 3.72 -0.49 -2.49 117.46 118.85 3a9t n PHE 518 Ca 0.13 -1.21 0.05 0.00 -0.05 0.00 0.00 57.45 56.37 3a9t n PHE 518 Cb 0.51 -0.22 0.28 0.00 -0.94 0.00 0.00 39.48 39.12 3a9t n PHE 518 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3a9t h LYS 519 N 0.91 0.00 -2.88 -1.08 1.57 -1.65 -1.19 116.57 112.26 3a9t h LYS 519 Ca -0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3a9t h LYS 519 Cb 1.21 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.39 3a9t h LYS 519 CO 0.02 0.39 0.23 0.16 -0.57 0.00 0.00 179.45 179.68 3a9t s ASP 520 N -6.41 -0.56 0.34 0.86 1.47 -1.26 -4.56 116.67 106.55 3a9t s ASP 520 Ca 0.01 0.05 0.06 0.00 1.18 0.00 0.00 52.55 53.85 3a9t s ASP 520 Cb 0.10 0.58 0.74 0.00 -0.34 0.00 0.00 42.92 44.00 3a9t s ASP 520 CO 0.69 -0.92 1.87 0.58 0.68 0.00 0.00 175.17 178.07 3a9t h VAL 521 N 2.07 0.88 -0.47 2.11 2.07 -1.90 -2.10 116.25 118.90 3a9t h VAL 521 Ca -0.33 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 66.97 3a9t h VAL 521 Cb 1.29 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3a9t h VAL 521 CO 0.38 0.14 0.21 0.22 0.02 0.00 0.00 177.57 178.54 3a9t h TYR 522 N 0.79 0.39 -0.23 1.57 3.20 -1.96 -2.63 116.97 118.09 3a9t h TYR 522 Ca 0.45 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.29 3a9t h TYR 522 Cb 0.61 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 3a9t h TYR 522 CO -0.00 0.18 -0.06 0.77 -1.64 0.00 0.00 178.16 177.41 3a9t h SER 523 N 0.42 0.34 -1.00 -2.11 0.02 -1.65 0.46 113.55 110.04 3a9t h SER 523 Ca 0.21 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3a9t h SER 523 Cb 0.15 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 3a9t h SER 523 CO -0.17 0.44 0.66 0.58 -1.14 0.00 0.00 176.83 177.20 3a9t h VAL 524 N 0.35 1.22 0.21 2.27 2.07 -1.15 -0.77 116.25 120.45 3a9t h VAL 524 Ca 0.07 -0.45 -0.32 0.00 0.82 0.00 0.00 66.70 66.83 3a9t h VAL 524 Cb 0.33 -0.21 0.03 0.00 -1.52 0.00 0.00 31.29 29.92 3a9t h VAL 524 CO 0.01 0.24 -1.46 -0.03 0.02 0.00 0.00 177.57 176.35 3a9t h MET 525 N 1.31 0.45 0.00 1.57 1.85 -1.37 -3.02 114.93 115.72 3a9t h MET 525 Ca 0.38 -0.78 0.00 0.00 -0.61 0.00 0.00 59.70 58.70 3a9t h MET 525 Cb -0.08 0.29 0.00 0.00 0.43 0.00 0.00 31.60 32.24 3a9t h MET 525 CO -0.10 1.37 0.00 -0.97 -0.40 0.00 0.00 176.91 176.81 3a9t h ASN 526 N 0.03 0.00 -0.02 1.39 -1.24 -0.71 -0.73 115.58 114.31 3a9t h ASN 526 Ca -0.27 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.74 3a9t h ASN 526 Cb 2.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.10 3a9t h ASN 526 CO 0.22 0.00 -0.40 0.59 -1.29 0.00 0.00 177.43 176.55 3a9t n ASN 527 N -2.94 2.12 -4.72 1.15 3.02 -0.31 -4.93 115.26 108.65 3a9t n ASN 527 Ca -0.02 -1.56 -0.42 0.00 -0.03 0.00 0.00 54.58 52.55 3a9t n ASN 527 Cb 0.09 0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 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 -2.36 3.22 -1.83 3.10 -0.11 -0.28 -4.90 118.94 115.77 3a9t s TRP 528 Ca 0.19 0.96 0.05 0.00 1.22 0.00 0.00 56.10 58.53 3a9t s TRP 528 Cb 0.18 -3.70 0.16 0.00 -1.50 0.00 0.00 33.47 28.61 3a9t s TRP 528 CO 0.52 -2.43 1.08 0.41 -4.62 0.00 0.00 176.95 171.92 3a9t n GLY 529 N 3.29 0.12 3.66 5.86 0.00 -1.26 -4.91 105.19 111.95 3a9t n GLY 529 Ca 0.11 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.71 -1.64 -0.11 4.61 0.00 -1.26 -5.02 121.76 116.63 3a9t s ALA 530 Ca 0.12 0.35 0.30 0.00 0.00 0.00 0.00 51.96 52.73 3a9t s ALA 530 Cb 0.07 0.63 1.08 0.00 0.00 0.00 0.00 23.12 24.90 3a9t s ALA 530 CO 0.07 -0.91 1.87 -2.95 0.00 0.00 0.00 175.76 173.84 3a9t h ASN 531 N 2.00 0.00 -1.76 0.00 -0.00 -1.95 -3.46 115.58 110.42 3a9t h ASN 531 Ca -0.24 0.00 -0.53 0.00 -0.00 0.00 0.00 56.30 55.53 3a9t h ASN 531 Cb 1.25 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 39.50 3a9t h ASN 531 CO 0.28 0.00 -0.49 -1.00 -0.00 0.00 0.00 177.43 176.22 3a9t s HIS 532 N -3.51 2.71 0.27 4.14 3.76 -1.26 -0.98 115.29 120.42 3a9t s HIS 532 Ca 0.03 -0.43 -0.21 0.00 -0.15 0.00 0.00 55.06 54.30 3a9t s HIS 532 Cb 0.08 -1.82 0.02 0.00 1.11 0.00 0.00 32.58 31.98 3a9t s HIS 532 CO 0.56 0.21 0.74 0.00 -0.85 0.00 0.00 174.74 175.40 3a9t s SER 534 N -2.93 2.29 -0.13 0.00 0.15 -0.54 -2.63 113.70 109.91 3a9t s SER 534 Ca 0.11 -0.38 -0.15 0.00 0.70 0.00 0.00 55.95 56.23 3a9t s SER 534 Cb -0.06 -0.99 -0.05 0.00 -1.71 0.00 0.00 66.02 63.22 3a9t s SER 534 CO 0.07 -0.03 0.35 -0.63 1.20 0.00 0.00 173.24 174.20 3a9t s ILE 535 N 1.21 5.25 0.04 6.45 1.01 0.53 -2.10 121.20 133.59 3a9t s ILE 535 Ca -0.03 0.68 0.07 0.00 0.00 0.00 0.00 60.65 61.37 3a9t s ILE 535 Cb -0.14 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 3a9t s ILE 535 CO -0.04 0.39 -0.21 -0.55 0.00 0.00 0.00 174.94 174.53 3a9t s SER 536 N 0.35 2.50 0.35 3.58 0.15 -0.41 -0.35 113.70 119.86 3a9t s SER 536 Ca 0.20 -0.51 -0.26 0.00 0.70 0.00 0.00 55.95 56.08 3a9t s SER 536 Cb -0.14 -0.22 -0.09 0.00 -1.71 0.00 0.00 66.02 63.86 3a9t s SER 536 CO 0.06 0.18 1.06 -0.47 1.20 0.00 0.00 173.24 175.28 3a9t s TYR 537 N -0.76 3.40 0.00 3.44 6.14 -1.26 -0.62 117.35 127.69 3a9t s TYR 537 Ca 0.08 1.67 0.00 0.00 0.64 0.00 0.00 57.07 59.46 3a9t s TYR 537 Cb -0.09 -3.18 0.00 0.00 0.42 0.00 0.00 41.96 39.11 3a9t s TYR 537 CO 0.01 -0.57 0.00 0.41 0.64 0.00 0.00 175.55 176.04 3a9t n GLY 538 N 0.69 -0.38 3.24 8.97 0.00 0.16 -4.78 105.19 113.10 3a9t n GLY 538 Ca 0.03 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 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 -1.71 3.47 -0.19 1.61 3.76 -1.26 -2.36 115.29 118.61 3a9t s HIS 539 Ca 0.00 -1.91 0.16 0.00 -0.15 0.00 0.00 55.06 53.16 3a9t s HIS 539 Cb 0.00 -3.60 0.56 0.00 1.11 0.00 0.00 32.58 30.65 3a9t s HIS 539 CO 0.00 -0.98 1.46 0.44 -0.85 0.00 0.00 174.74 174.81 3a9t n ILE 540 N 4.53 2.34 -0.11 0.60 -5.35 -1.26 -4.68 119.36 115.42 3a9t n ILE 540 Ca -0.01 -1.82 -0.05 0.00 -0.27 0.00 0.00 62.75 60.59 3a9t n ILE 540 Cb 0.42 -0.25 0.03 0.00 -1.74 0.00 0.00 39.64 38.09 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 2.06 0.44 0.80 3.28 0.00 -1.97 0.11 103.07 107.79 3a9t h GLY 541 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 47.33 47.38 3a9t h GLY 541 CO 0.25 -0.04 0.62 0.00 0.00 0.00 0.00 176.54 177.37 3a9t h ALA 542 N 1.30 1.46 -0.15 3.60 0.00 -1.90 0.31 119.26 123.87 3a9t h ALA 542 Ca 0.18 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3a9t h ALA 542 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3a9t h ALA 542 CO -0.25 0.40 -0.50 -0.44 0.00 0.00 0.00 179.25 178.45 3a9t h ASP 543 N 1.10 0.46 0.21 0.00 3.32 -1.57 -2.32 116.42 117.62 3a9t h ASP 543 Ca 0.41 -0.23 -0.17 0.00 0.02 0.00 0.00 57.03 57.06 3a9t h ASP 543 Cb 0.18 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3a9t h ASP 543 CO -0.16 0.88 -0.64 -0.07 -1.72 0.00 0.00 179.24 177.53 3a9t h LEU 544 N 0.33 0.47 -0.14 1.55 3.38 -0.04 -2.39 115.31 118.47 3a9t h LEU 544 Ca 0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3a9t h LEU 544 Cb 1.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 3a9t h LEU 544 CO 0.09 0.99 0.01 0.40 0.09 0.00 0.00 178.44 180.02 3a9t h ILE 545 N 0.30 1.23 -0.85 1.22 2.04 -0.83 0.24 117.51 120.86 3a9t h ILE 545 Ca -0.01 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.12 3a9t h ILE 545 Cb 1.19 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 38.68 3a9t h ILE 545 CO 0.11 0.22 0.55 0.74 0.00 0.00 0.00 178.15 179.77 3a9t h THR 546 N 0.00 1.18 -0.43 -0.27 2.02 -1.43 -1.24 112.91 112.74 3a9t h THR 546 Ca 0.04 -0.38 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 3a9t h THR 546 Cb 0.32 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 3a9t h THR 546 CO 0.00 0.20 0.10 0.25 0.37 0.00 0.00 175.52 176.44 3a9t h LEU 547 N 1.10 0.67 -0.78 2.58 6.46 -1.20 -2.52 115.31 121.63 3a9t h LEU 547 Ca 0.32 -0.24 0.03 0.00 -0.12 0.00 0.00 57.88 57.87 3a9t h LEU 547 Cb -0.06 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 39.64 3a9t h LEU 547 CO -0.09 0.74 0.50 0.00 -0.62 0.00 0.00 178.44 178.97 3a9t h ALA 548 N 0.96 1.01 0.00 1.25 0.00 0.05 -1.98 119.26 120.55 3a9t h ALA 548 Ca 0.13 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3a9t h ALA 548 Cb 0.34 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3a9t h ALA 548 CO 0.00 0.32 -0.38 0.66 0.00 0.00 0.00 179.25 179.86 3a9t h SER 549 N 0.99 0.00 -0.01 0.00 4.64 -1.08 0.17 113.55 118.25 3a9t h SER 549 Ca 0.31 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.50 3a9t h SER 549 Cb -0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3a9t h SER 549 CO -0.10 0.38 -0.38 0.40 -0.87 0.00 0.00 176.83 176.26 3a9t h ILE 550 N 0.00 1.30 -0.01 0.95 2.04 -0.94 -2.49 117.51 118.36 3a9t h ILE 550 Ca -0.00 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.34 3a9t h ILE 550 Cb 0.69 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 3a9t h ILE 550 CO 0.05 0.48 -0.09 0.18 0.00 0.00 0.00 178.15 178.77 3a9t n LEU 551 N -4.04 0.92 -3.40 1.44 4.77 -0.88 -4.92 117.00 110.88 3a9t n LEU 551 Ca -0.01 -0.25 -0.23 0.00 -0.03 0.00 0.00 56.01 55.50 3a9t n LEU 551 Cb 0.49 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.58 3a9t n LEU 551 CO 0.44 0.16 0.23 0.54 -1.33 0.00 0.00 177.39 177.43 3a9t n ARG 552 N -0.47 -7.49 -3.76 3.23 1.74 -0.15 -4.95 116.66 104.82 3a9t n ARG 552 Ca 0.17 0.78 -0.37 0.00 -0.77 0.00 0.00 57.85 57.65 3a9t n ARG 552 Cb 0.30 -5.68 -0.12 0.00 -1.02 0.00 0.00 32.46 25.93 3a9t n ARG 552 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3a9t s ILE 553 N -3.30 3.92 0.62 0.55 1.01 0.42 -4.81 121.20 119.60 3a9t s ILE 553 Ca 0.55 -0.83 -0.18 0.00 0.00 0.00 0.00 60.65 60.19 3a9t s ILE 553 Cb -0.24 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 3a9t s ILE 553 CO 0.68 -0.00 1.22 -2.16 0.00 0.00 0.00 174.94 174.68 3a9t s PRO 554 N 1.47 2.80 -0.43 2.79 0.04 -1.26 -4.33 135.00 136.09 3a9t s PRO 554 Ca 0.01 1.86 -0.06 0.00 0.04 0.00 0.00 61.00 62.85 3a9t s PRO 554 Cb -0.18 -1.90 0.10 0.00 0.04 0.00 0.00 34.50 32.56 3a9t s PRO 554 CO 0.03 -1.34 0.25 0.08 0.04 0.00 0.00 177.00 176.06 3a9t s VAL 555 N -1.61 3.77 -0.14 -0.36 1.01 -1.26 -0.86 120.40 120.96 3a9t s VAL 555 Ca 0.78 -1.81 0.30 0.00 0.00 0.00 0.00 61.98 61.25 3a9t s VAL 555 Cb -0.31 -3.48 0.36 0.00 0.00 0.00 0.00 36.38 32.95 3a9t s VAL 555 CO 0.36 -0.66 1.85 -0.55 0.00 0.00 0.00 175.10 176.10 3a9t h ASN 556 N 8.26 0.00 -2.81 3.32 -1.07 -1.76 -3.45 115.58 118.07 3a9t h ASN 556 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.19 3a9t h ASN 556 Cb 1.06 0.00 -0.22 0.00 -2.07 0.00 0.00 38.32 37.09 3a9t h ASN 556 CO 0.76 0.00 -0.08 -0.32 0.07 0.00 0.00 177.43 177.86 3a9t s MET 557 N -3.49 0.61 0.00 4.14 0.00 -1.25 -5.05 119.30 114.27 3a9t s MET 557 Ca 0.03 1.20 -0.28 0.00 0.00 0.00 0.00 55.69 56.64 3a9t s MET 557 Cb 0.08 0.27 0.10 0.00 0.00 0.00 0.00 34.83 35.28 3a9t s MET 557 CO 0.56 -0.17 0.83 -3.38 0.00 0.00 0.00 175.02 172.87 3a9t s HIS 558 N 1.91 -0.40 -0.26 4.11 -3.43 -1.24 0.67 115.29 116.65 3a9t s HIS 558 Ca -0.09 0.34 0.11 0.00 -0.80 0.00 0.00 55.06 54.63 3a9t s HIS 558 Cb -0.07 0.52 0.46 0.00 -1.43 0.00 0.00 32.58 32.06 3a9t s HIS 558 CO -0.18 -0.58 1.18 0.27 -2.00 0.00 0.00 174.74 173.43 3a9t n ASN 559 N -0.08 3.62 -4.75 7.38 6.94 -1.23 -4.98 115.26 122.16 3a9t n ASN 559 Ca -0.11 -3.40 -0.39 0.00 -0.02 0.00 0.00 54.58 50.65 3a9t n ASN 559 Cb 0.62 -0.39 -0.05 0.00 -2.36 0.00 0.00 39.78 37.59 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 -4.01 4.81 0.29 3.53 1.01 -1.26 -4.84 120.40 119.93 3a9t s VAL 560 Ca 0.44 1.46 -0.29 0.00 0.00 0.00 0.00 61.98 63.59 3a9t s VAL 560 Cb 0.39 -4.03 -0.13 0.00 0.00 0.00 0.00 36.38 32.60 3a9t s VAL 560 CO -0.00 0.38 1.21 -2.65 0.00 0.00 0.00 175.10 174.05 3a9t n PRO 561 N 2.80 1.78 0.16 2.72 -0.02 -1.26 -4.84 135.00 136.34 3a9t n PRO 561 Ca -0.04 0.63 0.14 0.00 -2.02 0.00 0.00 63.50 62.20 3a9t n PRO 561 Cb 0.51 -2.15 0.69 0.00 -0.02 0.00 0.00 33.50 32.52 3a9t n PRO 561 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a9t h GLU 562 N 2.78 0.00 0.00 -0.52 4.81 -1.99 -0.76 114.58 118.91 3a9t h GLU 562 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 3a9t h GLU 562 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3a9t h GLU 562 CO 0.65 0.00 0.00 -0.85 -0.73 0.00 0.00 179.01 178.08 3a9t n GLU 563 N -4.38 0.12 0.02 1.92 0.00 -1.26 -2.66 120.64 114.41 3a9t n GLU 563 Ca 0.02 0.31 0.11 0.00 0.00 0.00 0.00 57.16 57.61 3a9t n GLU 563 Cb 0.31 -1.71 0.05 0.00 0.00 0.00 0.00 31.44 30.09 3a9t n GLU 563 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3a9t n LYS 564 N -1.93 0.22 -1.82 3.44 4.76 -0.29 -4.92 118.16 117.61 3a9t n LYS 564 Ca 0.03 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 3a9t n LYS 564 Cb 0.24 -1.57 -0.03 0.00 -1.84 0.00 0.00 35.03 31.83 3a9t n LYS 564 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3a9t s ILE 565 N -3.15 2.76 -0.24 -0.18 1.01 -1.09 -4.88 121.20 115.43 3a9t s ILE 565 Ca 0.05 0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.94 3a9t s ILE 565 Cb 0.15 -3.17 0.07 0.00 0.01 0.00 0.00 42.46 39.53 3a9t s ILE 565 CO 0.79 0.00 0.05 0.12 0.00 0.00 0.00 174.94 175.90 3a9t s PHE 566 N 2.63 1.40 0.27 3.97 5.36 -1.26 -5.10 117.98 125.25 3a9t s PHE 566 Ca 0.77 -1.26 0.02 0.00 -0.96 0.00 0.00 56.93 55.50 3a9t s PHE 566 Cb -0.43 -1.32 -0.05 0.00 -0.34 0.00 0.00 43.02 40.88 3a9t s PHE 566 CO 0.34 -0.73 0.08 1.03 -1.46 0.00 0.00 175.22 174.48 3a9t s ARG 567 N 1.73 1.45 0.57 10.12 0.52 -1.26 -4.04 118.95 128.04 3a9t s ARG 567 Ca 0.02 -1.78 -0.20 0.00 -0.52 0.00 0.00 55.73 53.25 3a9t s ARG 567 Cb -0.17 -0.44 -0.05 0.00 0.52 0.00 0.00 34.95 34.80 3a9t s ARG 567 CO -0.14 -0.25 1.03 -2.30 0.02 0.00 0.00 175.30 173.66 3a9t n PRO 568 N -0.51 1.06 -0.17 3.54 -0.02 -1.26 -4.72 135.00 132.92 3a9t n PRO 568 Ca -0.01 0.40 0.19 0.00 -2.02 0.00 0.00 63.50 62.06 3a9t n PRO 568 Cb 0.66 -2.21 0.56 0.00 -0.02 0.00 0.00 33.50 32.49 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 0.73 0.30 -0.36 2.55 3.58 -1.68 -1.01 116.42 120.53 3a9t h ASP 569 Ca -0.48 0.02 0.08 0.00 0.42 0.00 0.00 57.03 57.07 3a9t h ASP 569 Cb 1.35 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.35 3a9t h ASP 569 CO 0.52 0.14 0.25 0.00 -2.88 0.00 0.00 179.24 177.28 3a9t h ALA 570 N 1.64 2.19 -0.92 -0.78 0.00 -1.89 -2.42 119.26 117.08 3a9t h ALA 570 Ca 0.39 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.35 3a9t h ALA 570 Cb 1.07 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 3a9t h ALA 570 CO -0.11 -0.28 0.60 -1.49 0.00 0.00 0.00 179.25 177.97 3a9t h TRP 571 N 0.12 1.08 0.00 0.00 6.55 -1.52 -0.79 115.95 121.39 3a9t h TRP 571 Ca 0.17 0.03 -0.05 0.00 0.95 0.00 0.00 58.89 59.99 3a9t h TRP 571 Cb 0.52 -0.36 -0.01 0.00 -0.86 0.00 0.00 29.16 28.46 3a9t h TRP 571 CO -0.00 0.57 -0.22 0.66 -1.05 0.00 0.00 178.44 178.41 3a9t h SER 572 N 1.07 0.00 0.20 -3.49 4.64 -1.61 -1.81 113.55 112.55 3a9t h SER 572 Ca 0.39 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.70 3a9t h SER 572 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3a9t h SER 572 CO -0.14 0.22 -0.03 0.24 -0.87 0.00 0.00 176.83 176.24 3a9t h MET 573 N 0.00 0.00 -0.64 4.77 2.86 -1.23 -1.44 114.93 119.25 3a9t h MET 573 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3a9t h MET 573 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3a9t h MET 573 CO 0.03 0.03 0.00 1.19 1.06 0.00 0.00 176.91 179.22 3a9t n PHE 574 N -3.46 0.86 0.00 -0.22 3.01 -0.68 -4.99 117.46 111.98 3a9t n PHE 574 Ca -0.02 -0.43 0.00 0.00 1.01 0.00 0.00 57.45 58.01 3a9t n PHE 574 Cb 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 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 1.52 4.67 0.00 1.37 0.00 -0.54 -4.41 105.19 107.81 3a9t n GLY 575 Ca 0.22 -0.92 0.02 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.24 0.00 0.09 2.61 -2.24 -1.26 -4.46 114.28 107.78 3a9t n THR 576 Ca 0.00 -0.09 -0.22 0.00 -2.27 0.00 0.00 64.05 61.47 3a9t n THR 576 Cb 0.00 0.44 -0.15 0.00 -2.10 0.00 0.00 70.33 68.52 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 0.40 -3.19 -0.78 1.57 -1.96 -3.41 116.57 109.20 3a9t h LYS 577 Ca 0.00 -0.68 -0.63 0.00 -1.87 0.00 0.00 60.65 57.48 3a9t h LYS 577 Cb 0.16 0.25 -0.41 0.00 0.08 0.00 0.00 32.23 32.31 3a9t h LYS 577 CO 0.00 1.30 -0.61 0.34 -0.57 0.00 0.00 179.45 179.92 3a9t s ASP 578 N -7.29 4.54 0.37 0.86 2.15 -1.26 -4.96 116.67 111.08 3a9t s ASP 578 Ca -0.13 -3.48 0.08 0.00 0.43 0.00 0.00 52.55 49.45 3a9t s ASP 578 Cb 0.05 -1.61 0.79 0.00 -0.30 0.00 0.00 42.92 41.86 3a9t s ASP 578 CO 0.87 -0.15 1.94 -0.07 -0.17 0.00 0.00 175.17 177.59 3a9t h LEU 579 N 5.88 0.63 0.42 -1.34 3.38 -1.83 -0.97 115.31 121.47 3a9t h LEU 579 Ca 0.05 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3a9t h LEU 579 Cb 0.82 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3a9t h LEU 579 CO 0.70 0.38 -0.20 -0.08 0.09 0.00 0.00 178.44 179.33 3a9t h GLU 580 N 0.70 -0.54 -0.82 1.13 4.81 -1.94 0.16 114.58 118.08 3a9t h GLU 580 Ca 0.34 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.69 3a9t h GLU 580 Cb 0.41 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 29.85 3a9t h GLU 580 CO -0.12 -0.32 0.49 0.78 -0.73 0.00 0.00 179.01 179.10 3a9t h GLY 581 N -0.63 1.25 1.02 1.92 0.00 -1.86 -1.11 103.07 103.66 3a9t h GLY 581 Ca -0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 3a9t h GLY 581 CO 0.09 0.19 0.40 0.00 0.00 0.00 0.00 176.54 177.22 3a9t h ALA 582 N 1.42 1.02 -0.43 3.60 0.00 -0.89 -1.51 119.26 122.47 3a9t h ALA 582 Ca 0.38 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.20 3a9t h ALA 582 Cb 0.26 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3a9t h ALA 582 CO -0.21 0.57 0.14 0.22 0.00 0.00 0.00 179.25 179.97 3a9t h ASP 583 N 1.11 0.13 -0.45 0.00 3.58 0.55 0.21 116.42 121.54 3a9t h ASP 583 Ca 0.27 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.77 3a9t h ASP 583 Cb 0.10 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 3a9t h ASP 583 CO -0.04 0.11 0.24 1.88 -2.88 0.00 0.00 179.24 178.55 3a9t h TYR 584 N 0.30 0.63 -0.52 0.28 -1.99 -0.92 -1.54 116.97 113.21 3a9t h TYR 584 Ca 0.20 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.90 3a9t h TYR 584 Cb 0.20 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 38.71 3a9t h TYR 584 CO -0.16 0.49 0.27 0.00 -0.00 0.00 0.00 178.16 178.75 3a9t h ARG 585 N 0.59 0.73 -0.04 4.88 3.08 -0.40 -2.22 114.38 121.00 3a9t h ARG 585 Ca 0.16 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 3a9t h ARG 585 Cb 0.08 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3a9t h ARG 585 CO -0.02 0.59 0.01 0.00 -1.07 0.00 0.00 179.97 179.47 3a9t h ALA 586 N 1.11 0.05 -0.99 0.04 0.00 -0.49 -1.81 119.26 117.16 3a9t h ALA 586 Ca 0.18 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.03 3a9t h ALA 586 Cb 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 3a9t h ALA 586 CO -0.03 -0.31 0.63 0.00 0.00 0.00 0.00 179.25 179.55 3a9t h LYS 588 N 1.10 -0.57 0.00 0.00 3.64 -1.34 -3.33 116.57 116.07 3a9t h LYS 588 Ca 0.45 0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.82 3a9t h LYS 588 Cb 0.27 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3a9t h LYS 588 CO -0.20 -0.27 -0.24 0.87 -2.27 0.00 0.00 179.45 177.34 3a9t h LYS 589 N -0.99 0.00 -0.03 1.90 6.56 -1.19 -3.52 116.57 119.30 3a9t h LYS 589 Ca -0.06 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 3a9t h LYS 589 Cb 0.57 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.23 3a9t h LYS 589 CO 0.10 0.24 0.00 1.28 -2.06 0.00 0.00 179.45 179.01