#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1u s TYR 4 N 0.00 -0.41 -0.12 -0.67 -0.85 -1.26 -4.18 117.35 109.86 3g1u s TYR 4 Ca 0.00 0.12 -0.04 0.00 -0.52 0.00 0.00 57.07 56.64 3g1u s TYR 4 Cb 0.00 0.56 0.05 0.00 0.38 0.00 0.00 41.96 42.95 3g1u s TYR 4 CO 0.00 -0.93 0.07 0.21 -1.52 0.00 0.00 175.55 173.38 3g1u s LYS 5 N -3.80 0.05 0.25 -3.49 2.20 -0.36 -4.98 119.74 109.61 3g1u s LYS 5 Ca 0.04 0.08 0.01 0.00 -0.36 0.00 0.00 55.97 55.74 3g1u s LYS 5 Cb -0.02 -1.34 -0.05 0.00 -1.51 0.00 0.00 37.83 34.91 3g1u s LYS 5 CO -0.08 -0.54 0.11 0.14 -0.36 0.00 0.00 175.35 174.63 3g1u s VAL 6 N 2.13 0.39 0.06 4.02 -7.23 -1.26 -1.56 120.40 116.95 3g1u s VAL 6 Ca 0.03 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.00 3g1u s VAL 6 Cb -0.15 -2.59 -0.12 0.00 0.56 0.00 0.00 36.38 34.09 3g1u s VAL 6 CO -0.07 0.00 1.43 0.50 -0.31 0.00 0.00 175.10 176.66 3g1u h LYS 7 N 2.42 0.36 -0.99 4.82 1.63 -1.89 -3.45 116.57 119.47 3g1u h LYS 7 Ca -0.37 -0.15 0.06 0.00 -0.85 0.00 0.00 60.65 59.34 3g1u h LYS 7 Cb 1.25 -0.02 -0.21 0.00 -0.60 0.00 0.00 32.23 32.65 3g1u h LYS 7 CO 0.58 0.64 -0.33 0.34 -3.45 0.00 0.00 179.45 177.23 3g1u s ASP 8 N -5.98 -1.53 0.64 4.20 -1.08 -1.26 -5.03 116.67 106.63 3g1u s ASP 8 Ca -0.14 0.45 0.42 0.00 -0.52 0.00 0.00 52.55 52.75 3g1u s ASP 8 Cb 0.06 2.08 2.16 0.00 -1.46 0.00 0.00 42.92 45.76 3g1u s ASP 8 CO 0.74 -0.28 2.28 -0.29 0.52 0.00 0.00 175.17 178.14 3g1u h ILE 9 N 5.98 0.01 0.00 4.11 6.09 -1.93 -1.81 117.51 129.96 3g1u h ILE 9 Ca -0.09 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 3g1u h ILE 9 Cb 1.18 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.60 3g1u h ILE 9 CO 0.19 0.00 0.00 -1.54 -3.07 0.00 0.00 178.15 173.73 3g1u n SER 10 N -3.10 0.62 0.00 2.19 3.41 -1.26 -2.32 113.62 113.16 3g1u n SER 10 Ca -0.02 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 3g1u n SER 10 Cb 0.13 -0.75 0.70 0.00 -0.26 0.00 0.00 64.21 64.04 3g1u n SER 10 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3g1u n LEU 11 N -2.12 0.00 -0.29 1.04 4.77 -0.68 -4.16 117.00 115.57 3g1u n LEU 11 Ca 0.04 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.97 3g1u n LEU 11 Cb 0.33 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.48 3g1u n LEU 11 CO 0.25 0.00 1.13 0.00 -1.33 0.00 0.00 177.39 177.44 3g1u h ALA 12 N 3.63 1.00 -0.22 -1.18 0.00 -1.66 -1.30 119.26 119.54 3g1u h ALA 12 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3g1u h ALA 12 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3g1u h ALA 12 CO 0.00 0.52 0.12 0.93 0.00 0.00 0.00 179.25 180.82 3g1u h GLU 13 N 1.09 0.30 -0.22 0.00 3.07 -1.84 0.32 114.58 117.29 3g1u h GLU 13 Ca 0.28 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3g1u h GLU 13 Cb 0.04 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 3g1u h GLU 13 CO -0.04 0.27 0.11 2.35 -1.40 0.00 0.00 179.01 180.29 3g1u h TRP 14 N 0.25 0.20 -0.60 4.33 7.01 -1.80 -2.58 115.95 122.76 3g1u h TRP 14 Ca 0.08 0.01 0.09 0.00 2.11 0.00 0.00 58.89 61.18 3g1u h TRP 14 Cb 0.05 -0.06 -0.07 0.00 -2.10 0.00 0.00 29.16 26.98 3g1u h TRP 14 CO -0.04 0.11 0.23 0.78 -2.79 0.00 0.00 178.44 176.73 3g1u h GLY 15 N 0.23 0.84 0.78 2.65 0.00 -0.93 -1.93 103.07 104.71 3g1u h GLY 15 Ca 0.09 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.34 3g1u h GLY 15 CO -0.06 -0.01 0.35 -0.09 0.00 0.00 0.00 176.54 176.73 3g1u h ARG 16 N 0.41 0.66 -0.51 4.80 9.65 -0.74 0.25 114.38 128.91 3g1u h ARG 16 Ca 0.30 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 3g1u h ARG 16 Cb 0.36 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.77 3g1u h ARG 16 CO -0.30 0.44 0.33 0.87 2.80 0.00 0.00 179.97 184.10 3g1u h LYS 17 N 0.68 0.68 -0.66 0.20 1.57 -1.16 -0.71 116.57 117.17 3g1u h LYS 17 Ca 0.26 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.94 3g1u h LYS 17 Cb 0.10 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 3g1u h LYS 17 CO -0.14 0.46 0.19 0.00 -0.57 0.00 0.00 179.45 179.40 3g1u h ALA 18 N 1.17 0.87 -0.43 3.86 0.00 -0.77 -2.22 119.26 121.74 3g1u h ALA 18 Ca 0.18 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3g1u h ALA 18 Cb -0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3g1u h ALA 18 CO -0.04 0.56 0.19 0.82 0.00 0.00 0.00 179.25 180.78 3g1u h ILE 19 N 0.97 1.19 -0.95 0.00 2.04 -0.33 -1.73 117.51 118.70 3g1u h ILE 19 Ca 0.21 -0.55 0.10 0.00 1.00 0.00 0.00 64.86 65.63 3g1u h ILE 19 Cb 0.32 0.76 -0.08 0.00 -0.74 0.00 0.00 36.82 37.07 3g1u h ILE 19 CO -0.00 0.21 0.59 -0.08 0.00 0.00 0.00 178.15 178.86 3g1u h GLU 20 N 0.55 0.93 -0.61 2.37 4.81 -0.89 -0.90 114.58 120.85 3g1u h GLU 20 Ca 0.15 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 3g1u h GLU 20 Cb 0.15 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3g1u h GLU 20 CO -0.02 0.62 0.19 -0.07 -0.73 0.00 0.00 179.01 179.00 3g1u h LEU 21 N 0.96 0.88 -0.72 1.64 3.38 -1.05 -3.18 115.31 117.23 3g1u h LEU 21 Ca 0.46 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 3g1u h LEU 21 Cb 0.41 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3g1u h LEU 21 CO -0.25 0.85 0.24 0.00 0.09 0.00 0.00 178.44 179.38 3g1u h ALA 22 N 1.06 0.93 -0.68 1.53 0.00 -0.41 -3.01 119.26 118.69 3g1u h ALA 22 Ca 0.20 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 55.03 3g1u h ALA 22 Cb 0.28 -0.28 -0.10 0.00 0.00 0.00 0.00 17.79 17.70 3g1u h ALA 22 CO -0.01 0.60 0.14 0.93 0.00 0.00 0.00 179.25 180.91 3g1u h GLU 23 N 1.05 0.25 0.00 0.00 5.08 -1.19 0.27 114.58 120.04 3g1u h GLU 23 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3g1u h GLU 23 Cb 0.28 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3g1u h GLU 23 CO -0.01 0.16 0.00 -0.91 -1.00 0.00 0.00 179.01 177.25 3g1u h ASN 24 N 0.25 0.00 -0.18 1.42 2.35 -1.53 -1.28 115.58 116.61 3g1u h ASN 24 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3g1u h ASN 24 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 3g1u h ASN 24 CO -0.47 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 174.69 3g1u n GLU 25 N -2.79 2.33 -3.16 0.81 -0.58 0.79 -4.69 120.64 113.35 3g1u n GLU 25 Ca -0.01 -2.05 -0.24 0.00 -0.42 0.00 0.00 57.16 54.44 3g1u n GLU 25 Cb 0.17 -1.47 -0.05 0.00 -0.57 0.00 0.00 31.44 29.51 3g1u n GLU 25 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3g1u n MET 26 N 1.37 2.06 0.17 3.49 2.81 -0.25 -3.46 117.12 123.31 3g1u n MET 26 Ca 0.16 -4.16 0.01 0.00 -1.81 0.00 0.00 57.70 51.90 3g1u n MET 26 Cb 0.59 -1.93 0.29 0.00 -0.71 0.00 0.00 33.22 31.46 3g1u n MET 26 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3g1u h PRO 27 N 3.46 0.00 -0.22 0.03 0.13 -1.84 -1.64 132.00 131.92 3g1u h PRO 27 Ca 0.13 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.30 3g1u h PRO 27 Cb 0.72 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.82 3g1u h PRO 27 CO 0.68 0.46 -0.02 0.78 -0.23 0.00 0.00 178.00 179.67 3g1u h GLY 28 N 1.41 0.19 1.02 1.56 0.00 -1.88 0.31 103.07 105.68 3g1u h GLY 28 Ca -0.00 0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.28 3g1u h GLY 28 CO 0.06 -0.06 -0.03 1.41 0.00 0.00 0.00 176.54 177.92 3g1u h LEU 29 N 0.04 0.87 -0.97 3.11 3.38 -1.70 -2.38 115.31 117.66 3g1u h LEU 29 Ca 0.11 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 3g1u h LEU 29 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3g1u h LEU 29 CO -0.20 0.98 -0.28 0.24 0.09 0.00 0.00 178.44 179.27 3g1u h MET 30 N 0.74 0.41 -0.29 1.13 2.86 -1.01 -2.89 114.93 115.88 3g1u h MET 30 Ca 0.14 -0.16 -0.15 0.00 -2.06 0.00 0.00 59.70 57.47 3g1u h MET 30 Cb 0.55 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 3g1u h MET 30 CO 0.03 0.66 -0.41 1.49 1.06 0.00 0.00 176.91 179.73 3g1u h GLU 31 N 0.36 0.70 -0.09 1.72 4.57 -0.28 -2.80 114.58 118.75 3g1u h GLU 31 Ca 0.05 -0.37 -0.04 0.00 -1.18 0.00 0.00 59.36 57.82 3g1u h GLU 31 Cb 0.69 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 3g1u h GLU 31 CO 0.05 0.99 -0.11 -0.07 -1.18 0.00 0.00 179.01 178.69 3g1u h LEU 32 N 0.57 0.13 -0.39 1.64 3.38 -1.24 0.11 115.31 119.51 3g1u h LEU 32 Ca 0.04 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3g1u h LEU 32 Cb 0.96 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 3g1u h LEU 32 CO 0.09 0.26 -0.04 0.03 0.09 0.00 0.00 178.44 178.87 3g1u h ARG 33 N 0.14 0.71 0.04 1.13 3.08 -1.32 0.81 114.38 118.97 3g1u h ARG 33 Ca 0.03 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 3g1u h ARG 33 Cb 0.29 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3g1u h ARG 33 CO 0.02 0.83 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.64 3g1u h ARG 34 N 0.53 -0.06 -0.25 0.04 2.43 -1.15 -0.62 114.38 115.31 3g1u h ARG 34 Ca 0.11 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3g1u h ARG 34 Cb 0.53 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3g1u h ARG 34 CO 0.03 0.31 0.06 1.49 -1.51 0.00 0.00 179.97 180.34 3g1u h GLU 35 N -0.42 0.40 0.00 0.20 4.81 -0.84 -3.34 114.58 115.39 3g1u h GLU 35 Ca -0.01 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3g1u h GLU 35 Cb 0.39 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.72 3g1u h GLU 35 CO 0.01 0.50 -1.09 0.66 -0.73 0.00 0.00 179.01 178.36 3g1u n TYR 36 N -4.72 0.00 -0.01 0.92 4.01 0.28 -4.58 117.16 113.05 3g1u n TYR 36 Ca -0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.60 3g1u n TYR 36 Cb 0.18 -0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.12 3g1u n TYR 36 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3g1u h GLY 37 N 4.90 -0.50 -0.10 2.72 0.00 -1.22 -2.47 103.07 106.40 3g1u h GLY 37 Ca 0.00 0.44 0.19 0.00 0.00 0.00 0.00 47.33 47.95 3g1u h GLY 37 CO 0.00 -0.22 0.30 -2.55 0.00 0.00 0.00 176.54 174.07 3g1u h PRO 38 N -0.41 0.36 0.00 4.80 0.11 -1.81 -2.69 132.00 132.36 3g1u h PRO 38 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3g1u h PRO 38 Cb 0.57 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.60 3g1u h PRO 38 CO -0.39 0.24 -0.21 -1.13 -0.21 0.00 0.00 178.00 176.29 3g1u n SER 39 N -5.07 0.29 -4.00 -2.05 3.41 -0.98 -4.99 113.62 100.23 3g1u n SER 39 Ca 0.18 0.23 -0.33 0.00 -0.26 0.00 0.00 58.87 58.69 3g1u n SER 39 Cb 0.54 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.25 3g1u n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g1u n GLN 40 N -1.62 -1.56 0.00 4.33 1.13 -0.97 -4.83 117.38 113.86 3g1u n GLN 40 Ca 0.06 0.26 0.09 0.00 -1.94 0.00 0.00 57.00 55.47 3g1u n GLN 40 Cb 0.35 -3.73 0.50 0.00 0.11 0.00 0.00 30.24 27.48 3g1u n GLN 40 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 3g1u n PRO 41 N -4.56 0.50 -0.13 -1.09 -0.04 -1.20 -1.70 135.00 126.78 3g1u n PRO 41 Ca -0.22 0.02 0.04 0.00 -0.04 0.00 0.00 63.50 63.30 3g1u n PRO 41 Cb 0.64 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.70 3g1u n PRO 41 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3g1u n LEU 42 N -1.04 2.63 -4.68 1.53 4.77 -0.09 -4.76 117.00 115.36 3g1u n LEU 42 Ca 0.12 -2.17 -0.45 0.00 -0.03 0.00 0.00 56.01 53.48 3g1u n LEU 42 Cb 0.07 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 3g1u n LEU 42 CO 0.10 0.64 1.45 1.17 -1.33 0.00 0.00 177.39 179.42 3g1u n LYS 43 N -0.09 2.52 0.00 3.23 4.81 -0.69 -1.00 118.16 126.94 3g1u n LYS 43 Ca 0.09 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.44 3g1u n LYS 43 Cb 0.42 -2.79 0.00 0.00 0.02 0.00 0.00 35.03 32.68 3g1u n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3g1u n GLY 44 N 4.19 2.73 3.73 3.14 0.00 -1.26 -5.00 105.19 112.71 3g1u n GLY 44 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3g1u n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u s ALA 45 N -2.66 3.58 -0.49 4.61 0.00 -0.17 -4.95 121.76 121.68 3g1u s ALA 45 Ca 0.00 1.14 0.02 0.00 0.00 0.00 0.00 51.96 53.13 3g1u s ALA 45 Cb 0.00 -3.52 0.13 0.00 0.00 0.00 0.00 23.12 19.72 3g1u s ALA 45 CO 0.00 -0.60 0.24 0.15 0.00 0.00 0.00 175.76 175.54 3g1u s LYS 46 N 0.59 1.96 -0.30 0.00 1.02 -1.26 -1.26 119.74 120.49 3g1u s LYS 46 Ca 0.62 -2.37 -0.18 0.00 0.02 0.00 0.00 55.97 54.06 3g1u s LYS 46 Cb -0.37 -3.38 -0.02 0.00 -0.52 0.00 0.00 37.83 33.53 3g1u s LYS 46 CO 0.34 -1.08 0.52 0.42 -0.92 0.00 0.00 175.35 174.63 3g1u s ILE 47 N 0.15 5.04 -0.20 2.17 1.01 0.02 -1.27 121.20 128.13 3g1u s ILE 47 Ca 0.15 0.67 -0.23 0.00 0.00 0.00 0.00 60.65 61.24 3g1u s ILE 47 Cb -0.23 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 3g1u s ILE 47 CO -0.03 -0.04 0.72 0.00 0.00 0.00 0.00 174.94 175.59 3g1u s ALA 48 N 2.36 3.55 -0.08 9.38 0.00 -0.54 -1.64 121.76 134.79 3g1u s ALA 48 Ca 0.20 -0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.04 3g1u s ALA 48 Cb -0.15 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 3g1u s ALA 48 CO 0.11 -0.65 -0.24 0.20 0.00 0.00 0.00 175.76 175.19 3g1u s GLY 49 N 1.22 1.34 -0.37 0.00 0.00 -0.32 -1.08 107.32 108.10 3g1u s GLY 49 Ca 0.32 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 44.06 3g1u s GLY 49 CO 0.11 -0.46 0.15 0.00 0.00 0.00 0.00 173.10 172.90 3g1u s LEU 51 N 0.93 -0.82 -0.29 0.00 0.20 -0.71 -2.39 118.68 115.61 3g1u s LEU 51 Ca 0.13 1.39 -0.26 0.00 0.69 0.00 0.00 54.13 56.08 3g1u s LEU 51 Cb -0.21 2.31 -0.11 0.00 -0.43 0.00 0.00 46.19 47.75 3g1u s LEU 51 CO -0.11 -0.23 1.12 1.41 -0.29 0.00 0.00 176.35 178.25 3g1u n HIS 52 N 3.70 0.81 -1.65 5.38 8.25 -1.26 -4.36 115.22 126.10 3g1u n HIS 52 Ca -0.18 0.53 -0.40 0.00 -0.26 0.00 0.00 57.72 57.42 3g1u n HIS 52 Cb 0.58 -1.31 -0.04 0.00 1.12 0.00 0.00 29.99 30.33 3g1u n HIS 52 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 3g1u n MET 53 N 3.55 2.00 -3.42 -0.41 1.56 -1.26 -4.61 117.12 114.52 3g1u n MET 53 Ca 0.26 -2.31 -0.21 0.00 -0.27 0.00 0.00 57.70 55.18 3g1u n MET 53 Cb -0.03 -3.25 -0.01 0.00 2.15 0.00 0.00 33.22 32.09 3g1u n MET 53 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3g1u s THR 54 N 5.93 2.54 0.26 1.12 -4.23 -1.26 -0.74 115.64 119.26 3g1u s THR 54 Ca 0.57 -1.24 -0.02 0.00 -1.18 0.00 0.00 61.69 59.82 3g1u s THR 54 Cb 0.10 -2.78 0.24 0.00 1.34 0.00 0.00 72.50 71.39 3g1u s THR 54 CO 0.08 0.00 1.81 0.58 -0.54 0.00 0.00 174.62 176.55 3g1u h VAL 55 N 0.80 0.88 -0.13 2.29 2.07 -1.90 0.36 116.25 120.63 3g1u h VAL 55 Ca -0.39 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 3g1u h VAL 55 Cb 1.28 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3g1u h VAL 55 CO 0.53 0.15 0.07 1.56 0.02 0.00 0.00 177.57 179.89 3g1u h GLN 56 N 0.82 0.18 -0.49 1.57 7.50 -1.94 -2.61 115.11 120.13 3g1u h GLN 56 Ca 0.44 -0.02 0.03 0.00 0.50 0.00 0.00 58.65 59.60 3g1u h GLN 56 Cb 0.44 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.91 3g1u h GLN 56 CO -0.27 0.22 0.33 1.15 -1.50 0.00 0.00 178.83 178.75 3g1u h THR 57 N 0.09 1.05 -0.38 -0.54 2.02 -1.69 -2.27 112.91 111.19 3g1u h THR 57 Ca 0.04 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 3g1u h THR 57 Cb 0.09 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3g1u h THR 57 CO -0.01 0.10 0.21 0.00 0.37 0.00 0.00 175.52 176.19 3g1u h ALA 58 N 1.71 1.65 0.00 6.16 0.00 -0.55 0.63 119.26 128.87 3g1u h ALA 58 Ca 0.20 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 3g1u h ALA 58 Cb 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 58 CO -0.05 0.30 -0.86 0.28 0.00 0.00 0.00 179.25 178.92 3g1u h VAL 59 N 0.52 1.58 -0.21 0.00 2.07 -1.29 -2.41 116.25 116.51 3g1u h VAL 59 Ca 0.14 -2.82 -0.03 0.00 0.82 0.00 0.00 66.70 64.81 3g1u h VAL 59 Cb 0.02 2.54 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 3g1u h VAL 59 CO -0.02 0.81 0.03 0.25 0.02 0.00 0.00 177.57 178.66 3g1u h LEU 60 N 0.03 0.34 -0.63 2.57 5.85 -0.90 -1.95 115.31 120.62 3g1u h LEU 60 Ca -0.02 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.47 3g1u h LEU 60 Cb 1.50 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 3g1u h LEU 60 CO 0.12 0.52 0.38 0.40 -0.34 0.00 0.00 178.44 179.51 3g1u h ILE 61 N 0.15 1.05 0.00 4.05 2.04 -0.85 -1.91 117.51 122.03 3g1u h ILE 61 Ca 0.06 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3g1u h ILE 61 Cb 0.32 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 3g1u h ILE 61 CO 0.00 0.13 0.00 -0.33 0.00 0.00 0.00 178.15 177.96 3g1u h GLU 62 N 0.73 0.00 -0.18 2.37 5.08 -1.42 -0.89 114.58 120.28 3g1u h GLU 62 Ca 0.26 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.52 3g1u h GLU 62 Cb 0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 3g1u h GLU 62 CO -0.12 0.00 -0.30 1.15 -1.00 0.00 0.00 179.01 178.73 3g1u h THR 63 N 0.00 1.34 -0.44 1.13 2.02 -0.96 -1.78 112.91 114.22 3g1u h THR 63 Ca 0.00 -1.53 -0.06 0.00 0.77 0.00 0.00 66.41 65.59 3g1u h THR 63 Cb 0.82 1.90 -0.02 0.00 -1.74 0.00 0.00 68.15 69.11 3g1u h THR 63 CO 0.00 0.47 0.04 -0.07 0.37 0.00 0.00 175.52 176.32 3g1u h LEU 64 N 0.17 0.72 -0.44 2.58 3.38 -1.09 -2.69 115.31 117.95 3g1u h LEU 64 Ca 0.01 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3g1u h LEU 64 Cb 0.89 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 3g1u h LEU 64 CO 0.07 0.83 0.26 0.50 0.09 0.00 0.00 178.44 180.19 3g1u h LYS 65 N 0.60 0.59 0.00 1.13 3.64 -1.26 -1.93 116.57 119.34 3g1u h LYS 65 Ca 0.13 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3g1u h LYS 65 Cb 0.43 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3g1u h LYS 65 CO 0.02 0.44 0.00 0.00 -2.27 0.00 0.00 179.45 177.64 3g1u h ALA 66 N 1.12 1.00 -0.58 5.00 0.00 -1.22 -1.21 119.26 123.36 3g1u h ALA 66 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3g1u h ALA 66 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3g1u h ALA 66 CO -0.03 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.50 3g1u n LEU 67 N -3.07 3.39 0.00 0.00 4.32 -0.89 -4.69 117.00 116.07 3g1u n LEU 67 Ca -0.02 -1.65 0.00 0.00 -0.02 0.00 0.00 56.01 54.32 3g1u n LEU 67 Cb 0.11 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 41.52 3g1u n LEU 67 CO 0.21 0.82 0.00 0.61 -1.22 0.00 0.00 177.39 177.81 3g1u n GLY 68 N 1.51 0.64 3.74 -0.72 0.00 -0.46 -0.92 105.19 108.99 3g1u n GLY 68 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 3g1u n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u s ALA 69 N -2.12 2.31 -0.11 4.61 0.00 -0.78 -4.18 121.76 121.49 3g1u s ALA 69 Ca 0.00 0.79 -0.03 0.00 0.00 0.00 0.00 51.96 52.72 3g1u s ALA 69 Cb 0.00 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 3g1u s ALA 69 CO 0.00 -1.54 0.01 -2.00 0.00 0.00 0.00 175.76 172.23 3g1u s GLU 70 N -3.86 3.27 0.07 0.00 2.12 -0.39 -4.33 118.70 115.58 3g1u s GLU 70 Ca 0.72 -0.40 0.04 0.00 0.36 0.00 0.00 54.97 55.69 3g1u s GLU 70 Cb -0.26 -2.90 -0.03 0.00 0.26 0.00 0.00 34.13 31.20 3g1u s GLU 70 CO 0.42 0.57 -0.12 -0.51 -0.54 0.00 0.00 175.26 175.07 3g1u s LEU 71 N -0.50 2.31 -0.03 2.70 1.02 -1.26 -0.80 118.68 122.13 3g1u s LEU 71 Ca 0.09 -0.66 0.01 0.00 0.02 0.00 0.00 54.13 53.59 3g1u s LEU 71 Cb -0.12 -0.39 0.02 0.00 0.02 0.00 0.00 46.19 45.72 3g1u s LEU 71 CO 0.02 -0.15 -0.03 -0.13 0.02 0.00 0.00 176.35 176.08 3g1u s ARG 72 N -2.00 0.48 0.01 1.70 0.52 -0.65 -4.16 118.95 114.86 3g1u s ARG 72 Ca -0.02 -0.05 0.03 0.00 -0.52 0.00 0.00 55.73 55.18 3g1u s ARG 72 Cb -0.08 -0.55 -0.01 0.00 0.52 0.00 0.00 34.95 34.82 3g1u s ARG 72 CO 0.01 -0.05 -0.09 -0.46 0.02 0.00 0.00 175.30 174.74 3g1u s TRP 73 N 0.67 0.76 0.20 -0.53 -0.11 -0.13 -1.18 118.94 118.62 3g1u s TRP 73 Ca -0.07 -0.23 -0.01 0.00 1.22 0.00 0.00 56.10 57.01 3g1u s TRP 73 Cb -0.11 -0.48 -0.04 0.00 -1.50 0.00 0.00 33.47 31.35 3g1u s TRP 73 CO -0.01 -0.02 0.13 -1.54 -4.62 0.00 0.00 176.95 170.90 3g1u s SER 74 N -0.58 0.15 0.30 5.86 1.04 -0.47 -0.32 113.70 119.69 3g1u s SER 74 Ca 0.00 -1.38 -0.09 0.00 0.48 0.00 0.00 55.95 54.96 3g1u s SER 74 Cb -0.05 0.38 -0.07 0.00 0.10 0.00 0.00 66.02 66.38 3g1u s SER 74 CO 0.00 -0.84 0.63 -0.55 0.98 0.00 0.00 173.24 173.46 3g1u s SER 75 N -3.15 6.57 -0.17 7.02 0.15 -1.25 -1.74 113.70 121.13 3g1u s SER 75 Ca 0.38 0.96 0.16 0.00 0.70 0.00 0.00 55.95 58.15 3g1u s SER 75 Cb 0.07 -2.25 0.76 0.00 -1.71 0.00 0.00 66.02 62.89 3g1u s SER 75 CO 0.12 -0.20 1.67 0.00 1.20 0.00 0.00 173.24 176.03 3g1u s ASN 77 N -0.82 -0.68 0.53 0.00 3.84 -1.26 -4.94 114.94 111.61 3g1u s ASN 77 Ca 0.52 1.26 0.31 0.00 0.21 0.00 0.00 52.86 55.16 3g1u s ASN 77 Cb 0.37 1.27 1.44 0.00 -0.55 0.00 0.00 41.25 43.77 3g1u s ASN 77 CO 0.20 -0.26 2.03 0.16 -2.79 0.00 0.00 177.10 176.44 3g1u h ILE 78 N 4.00 0.30 -0.13 -5.21 3.07 -1.90 -3.22 117.51 114.43 3g1u h ILE 78 Ca -0.28 -0.58 0.00 0.00 1.55 0.00 0.00 64.86 65.54 3g1u h ILE 78 Cb 1.16 1.45 0.00 0.00 -0.27 0.00 0.00 36.82 39.16 3g1u h ILE 78 CO 0.12 0.09 0.00 0.49 -1.05 0.00 0.00 178.15 177.79 3g1u n PHE 79 N -3.32 0.16 0.00 0.16 3.72 -1.26 -0.64 117.46 116.28 3g1u n PHE 79 Ca -0.01 -0.25 0.02 0.00 -0.05 0.00 0.00 57.45 57.16 3g1u n PHE 79 Cb 0.28 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.69 3g1u n PHE 79 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3g1u n SER 80 N 0.33 0.47 -4.68 4.37 3.41 -1.21 -4.22 113.62 112.09 3g1u n SER 80 Ca 0.06 0.20 -0.43 0.00 -0.26 0.00 0.00 58.87 58.44 3g1u n SER 80 Cb 0.28 0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 65.02 3g1u n SER 80 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3g1u n THR 81 N -2.69 1.64 -3.57 6.66 -1.04 -1.26 -4.61 114.28 109.42 3g1u n THR 81 Ca -0.12 -0.41 -0.40 0.00 -2.04 0.00 0.00 64.05 61.07 3g1u n THR 81 Cb 0.82 -1.50 -0.11 0.00 -1.82 0.00 0.00 70.33 67.72 3g1u n THR 81 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3g1u s GLN 82 N -1.35 3.26 0.30 -2.82 -0.21 0.08 -4.21 119.66 114.70 3g1u s GLN 82 Ca 0.60 -0.80 -0.01 0.00 0.02 0.00 0.00 55.36 55.17 3g1u s GLN 82 Cb -0.60 -3.75 0.44 0.00 1.00 0.00 0.00 33.01 30.10 3g1u s GLN 82 CO 0.58 -0.53 1.91 -0.44 -2.12 0.00 0.00 175.29 174.69 3g1u h ASP 83 N 8.46 0.86 -0.91 5.90 3.32 -1.93 -1.17 116.42 130.94 3g1u h ASP 83 Ca -0.30 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 56.68 3g1u h ASP 83 Cb 1.14 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.43 3g1u h ASP 83 CO 0.65 0.71 0.59 -0.55 -1.72 0.00 0.00 179.24 178.92 3g1u h ASN 84 N 0.96 1.05 -0.31 6.45 -1.07 -1.91 -0.96 115.58 119.80 3g1u h ASN 84 Ca 0.24 -0.03 -0.02 0.00 0.07 0.00 0.00 56.30 56.55 3g1u h ASN 84 Cb 0.05 -0.26 -0.01 0.00 -2.07 0.00 0.00 38.32 36.03 3g1u h ASN 84 CO -0.04 0.77 0.09 0.00 0.07 0.00 0.00 177.43 178.33 3g1u h ALA 85 N 1.33 0.40 -0.55 4.14 0.00 -1.55 0.31 119.26 123.34 3g1u h ALA 85 Ca 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3g1u h ALA 85 Cb -0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3g1u h ALA 85 CO -0.07 0.04 0.29 0.00 0.00 0.00 0.00 179.25 179.51 3g1u h ALA 86 N 0.93 0.71 -0.59 0.00 0.00 -1.15 -1.58 119.26 117.58 3g1u h ALA 86 Ca 0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3g1u h ALA 86 Cb 0.25 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3g1u h ALA 86 CO -0.00 0.25 0.21 0.00 0.00 0.00 0.00 179.25 179.71 3g1u h ALA 87 N 1.13 0.77 -0.86 0.00 0.00 -1.11 0.25 119.26 119.43 3g1u h ALA 87 Ca 0.19 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3g1u h ALA 87 Cb 0.07 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3g1u h ALA 87 CO -0.03 0.40 0.55 0.00 0.00 0.00 0.00 179.25 180.18 3g1u h ALA 88 N 1.07 1.13 -0.22 0.00 0.00 -0.56 0.41 119.26 121.09 3g1u h ALA 88 Ca 0.19 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 88 Cb 0.24 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 88 CO -0.01 0.39 -0.43 0.82 0.00 0.00 0.00 179.25 180.02 3g1u h ILE 89 N 1.07 1.31 -0.73 0.00 1.08 -1.20 -3.23 117.51 115.82 3g1u h ILE 89 Ca 0.34 -1.65 -0.04 0.00 -0.39 0.00 0.00 64.86 63.12 3g1u h ILE 89 Cb 0.01 1.81 -0.03 0.00 -3.07 0.00 0.00 36.82 35.54 3g1u h ILE 89 CO -0.12 0.52 0.29 0.00 -0.69 0.00 0.00 178.15 178.15 3g1u h ALA 90 N 0.62 1.14 -0.43 1.87 0.00 -0.47 -2.42 119.26 119.57 3g1u h ALA 90 Ca 0.01 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.79 3g1u h ALA 90 Cb 1.04 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3g1u h ALA 90 CO 0.10 0.62 0.29 -0.22 0.00 0.00 0.00 179.25 180.03 3g1u h LYS 91 N 1.05 0.34 -0.00 0.00 1.63 -0.97 -2.33 116.57 116.30 3g1u h LYS 91 Ca 0.24 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 3g1u h LYS 91 Cb 0.20 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 3g1u h LYS 91 CO -0.02 0.23 -0.06 0.25 -3.45 0.00 0.00 179.45 176.39 3g1u n THR 92 N -4.48 0.00 -0.15 1.00 -2.24 -0.92 -4.91 114.28 102.59 3g1u n THR 92 Ca 0.05 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3g1u n THR 92 Cb 0.24 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 3g1u n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g1u n GLY 93 N 1.38 0.64 3.69 3.38 0.00 -0.88 -5.06 105.19 108.34 3g1u n GLY 93 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3g1u n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1u s VAL 94 N -2.25 3.98 -0.28 1.61 1.01 -1.19 -4.97 120.40 118.30 3g1u s VAL 94 Ca 0.00 1.32 -0.29 0.00 0.00 0.00 0.00 61.98 63.01 3g1u s VAL 94 Cb 0.00 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 3g1u s VAL 94 CO 0.00 -0.01 1.79 -2.84 0.00 0.00 0.00 175.10 174.03 3g1u s PRO 95 N 2.44 3.47 -0.00 2.72 0.02 -1.26 -4.23 135.00 138.16 3g1u s PRO 95 Ca 0.60 1.57 0.04 0.00 0.02 0.00 0.00 61.00 63.23 3g1u s PRO 95 Cb -0.28 -4.17 -0.01 0.00 0.02 0.00 0.00 34.50 30.06 3g1u s PRO 95 CO 0.24 -1.70 -0.13 0.54 -0.33 0.00 0.00 177.00 175.62 3g1u s VAL 96 N 6.47 1.01 -0.41 3.83 0.11 -1.26 -0.96 120.40 129.20 3g1u s VAL 96 Ca 0.80 -0.61 0.01 0.00 -2.93 0.00 0.00 61.98 59.24 3g1u s VAL 96 Cb -0.25 -0.86 0.13 0.00 -1.53 0.00 0.00 36.38 33.88 3g1u s VAL 96 CO 0.33 0.24 0.22 -0.36 -3.33 0.00 0.00 175.10 172.19 3g1u s PHE 97 N -0.39 1.63 -0.28 1.54 0.08 0.57 -1.22 117.98 119.90 3g1u s PHE 97 Ca 0.04 -2.16 -0.17 0.00 0.12 0.00 0.00 56.93 54.77 3g1u s PHE 97 Cb -0.05 -1.62 0.11 0.00 -0.57 0.00 0.00 43.02 40.88 3g1u s PHE 97 CO -0.00 -0.80 0.83 0.00 -0.10 0.00 0.00 175.22 175.14 3g1u s ALA 98 N 0.65 -2.04 0.03 5.36 0.00 -0.60 -3.92 121.76 121.24 3g1u s ALA 98 Ca 0.17 2.29 -0.10 0.00 0.00 0.00 0.00 51.96 54.32 3g1u s ALA 98 Cb -0.24 -1.53 0.01 0.00 0.00 0.00 0.00 23.12 21.36 3g1u s ALA 98 CO -0.02 -0.36 0.22 1.67 0.00 0.00 0.00 175.76 177.28 3g1u s TRP 99 N 1.39 0.01 0.07 0.00 -2.14 -1.26 -4.24 118.94 112.77 3g1u s TRP 99 Ca -0.08 -0.17 -0.31 0.00 2.66 0.00 0.00 56.10 58.19 3g1u s TRP 99 Cb -0.04 0.00 -0.07 0.00 -3.10 0.00 0.00 33.47 30.26 3g1u s TRP 99 CO -0.16 -0.43 1.43 0.21 -2.66 0.00 0.00 176.95 175.34 3g1u s LYS 100 N -2.35 4.29 0.00 3.25 2.20 -1.26 -3.77 119.74 122.10 3g1u s LYS 100 Ca -0.07 2.07 0.00 0.00 -0.36 0.00 0.00 55.97 57.62 3g1u s LYS 100 Cb -0.02 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 3g1u s LYS 100 CO -0.03 -0.53 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 3g1u n GLY 101 N 3.62 0.98 3.78 5.54 0.00 0.19 -5.02 105.19 114.28 3g1u n GLY 101 Ca 0.13 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 3g1u n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g1u s GLU 102 N -2.81 3.79 0.78 1.61 2.02 -0.93 -5.04 118.70 118.12 3g1u s GLU 102 Ca 0.00 1.53 -0.12 0.00 0.02 0.00 0.00 54.97 56.41 3g1u s GLU 102 Cb 0.00 -2.25 0.06 0.00 0.10 0.00 0.00 34.13 32.04 3g1u s GLU 102 CO 0.00 -0.47 1.13 0.95 0.02 0.00 0.00 175.26 176.90 3g1u s THR 103 N -1.77 2.72 0.22 3.63 -4.23 -1.26 -4.84 115.64 110.12 3g1u s THR 103 Ca 0.65 0.24 -0.07 0.00 -1.18 0.00 0.00 61.69 61.32 3g1u s THR 103 Cb -0.22 -3.17 0.17 0.00 1.34 0.00 0.00 72.50 70.63 3g1u s THR 103 CO 0.26 -0.31 1.80 0.44 -0.54 0.00 0.00 174.62 176.27 3g1u h ASP 104 N -0.96 0.53 0.23 3.99 3.32 -1.99 0.14 116.42 121.69 3g1u h ASP 104 Ca -0.46 0.05 -0.16 0.00 0.02 0.00 0.00 57.03 56.48 3g1u h ASP 104 Cb 1.29 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 3g1u h ASP 104 CO 0.64 0.32 -0.60 1.05 -1.72 0.00 0.00 179.24 178.93 3g1u h GLU 105 N 0.67 0.38 -0.48 3.56 9.09 -1.99 -1.94 114.58 123.86 3g1u h GLU 105 Ca 0.34 -0.26 -0.13 0.00 0.05 0.00 0.00 59.36 59.36 3g1u h GLU 105 Cb 0.30 0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.42 3g1u h GLU 105 CO -0.23 0.86 -0.22 0.93 0.05 0.00 0.00 179.01 180.41 3g1u h GLU 106 N 0.28 1.00 -0.17 1.06 5.08 -1.84 -0.97 114.58 119.02 3g1u h GLU 106 Ca -0.01 -0.43 0.05 0.00 -1.00 0.00 0.00 59.36 57.97 3g1u h GLU 106 Cb 1.13 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.30 3g1u h GLU 106 CO 0.10 1.10 -0.13 -0.92 -1.00 0.00 0.00 179.01 178.16 3g1u h TYR 107 N 0.86 -0.33 -0.37 4.33 3.20 -0.50 0.02 116.97 124.18 3g1u h TYR 107 Ca 0.11 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.89 3g1u h TYR 107 Cb 0.80 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 3g1u h TYR 107 CO 0.05 -0.20 -0.24 0.93 -1.64 0.00 0.00 178.16 177.06 3g1u h GLU 108 N -0.14 0.74 -0.72 1.82 5.08 -1.35 -2.66 114.58 117.36 3g1u h GLU 108 Ca 0.11 -0.31 0.04 0.00 -1.00 0.00 0.00 59.36 58.20 3g1u h GLU 108 Cb 0.30 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 3g1u h GLU 108 CO -0.26 0.91 0.45 2.35 -1.00 0.00 0.00 179.01 181.46 3g1u h TRP 109 N 0.65 0.83 -0.29 4.33 7.01 -0.87 -2.94 115.95 124.66 3g1u h TRP 109 Ca 0.09 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.09 3g1u h TRP 109 Cb 0.75 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 3g1u h TRP 109 CO 0.04 0.46 0.11 0.00 -2.79 0.00 0.00 178.44 176.26 3g1u h ILE 111 N 0.32 1.14 0.00 0.00 2.04 -1.51 -2.56 117.51 116.94 3g1u h ILE 111 Ca 0.10 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 3g1u h ILE 111 Cb 0.20 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3g1u h ILE 111 CO -0.01 0.15 -0.29 0.00 0.00 0.00 0.00 178.15 178.01 3g1u h ALA 112 N 1.65 1.10 0.00 1.87 0.00 -1.29 -2.02 119.26 120.57 3g1u h ALA 112 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3g1u h ALA 112 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3g1u h ALA 112 CO -0.03 0.36 0.00 1.04 0.00 0.00 0.00 179.25 180.62 3g1u n GLN 113 N -3.58 0.14 0.01 0.00 1.13 -0.96 -3.26 117.38 110.85 3g1u n GLN 113 Ca -0.01 0.34 0.11 0.00 -1.94 0.00 0.00 57.00 55.50 3g1u n GLN 113 Cb 0.42 -1.75 -0.05 0.00 0.11 0.00 0.00 30.24 28.97 3g1u n GLN 113 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3g1u n THR 114 N -2.01 0.04 -0.97 5.09 -2.24 -0.76 -4.09 114.28 109.33 3g1u n THR 114 Ca 0.03 -0.13 0.05 0.00 -2.27 0.00 0.00 64.05 61.72 3g1u n THR 114 Cb 0.23 0.57 0.35 0.00 -2.10 0.00 0.00 70.33 69.38 3g1u n THR 114 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3g1u n VAL 115 N -1.72 2.69 -3.61 2.28 0.24 -1.20 -4.60 118.33 112.40 3g1u n VAL 115 Ca 0.03 -1.61 -0.11 0.00 -2.04 0.00 0.00 64.34 60.61 3g1u n VAL 115 Cb 0.39 -0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 32.44 3g1u n VAL 115 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 3g1u s LYS 116 N -2.85 1.26 0.00 7.34 -2.85 -1.26 -4.58 119.74 116.80 3g1u s LYS 116 Ca 0.52 -0.69 0.00 0.00 -1.00 0.00 0.00 55.97 54.79 3g1u s LYS 116 Cb 0.40 0.53 0.00 0.00 -2.06 0.00 0.00 37.83 36.70 3g1u s LYS 116 CO 0.13 -0.53 0.00 0.41 0.10 0.00 0.00 175.35 175.46 3g1u n GLY 117 N -0.32 0.66 3.58 0.59 0.00 -0.16 -4.92 105.19 104.62 3g1u n GLY 117 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 3g1u n GLY 117 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g1u s PHE 118 N -2.00 0.54 1.03 1.61 0.40 -1.15 -4.95 117.98 113.46 3g1u s PHE 118 Ca 0.00 0.55 -0.15 0.00 -0.60 0.00 0.00 56.93 56.72 3g1u s PHE 118 Cb 0.00 -3.39 0.21 0.00 0.51 0.00 0.00 43.02 40.34 3g1u s PHE 118 CO 0.00 -3.89 1.16 -1.54 0.70 0.00 0.00 175.22 171.64 3g1u s SER 119 N -3.79 2.46 1.80 1.36 1.04 -1.26 -3.50 113.70 111.82 3g1u s SER 119 Ca 0.70 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.89 3g1u s SER 119 Cb -0.11 -1.14 0.00 0.00 0.10 0.00 0.00 66.02 64.87 3g1u s SER 119 CO 0.56 -3.18 0.00 0.61 0.98 0.00 0.00 173.24 172.21 3g1u n GLY 120 N -1.93 3.11 0.00 7.32 0.00 -1.26 -1.90 105.19 110.53 3g1u n GLY 120 Ca 0.10 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.03 3g1u n GLY 120 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g1u n ASP 121 N 5.92 0.00 -0.34 1.61 5.68 -1.26 -4.88 116.55 123.28 3g1u n ASP 121 Ca 0.00 -0.48 -0.04 0.00 -0.50 0.00 0.00 54.79 53.76 3g1u n ASP 121 Cb 0.00 -0.05 -0.02 0.00 -1.14 0.00 0.00 41.12 39.91 3g1u n ASP 121 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g1u n GLY 122 N 0.22 0.72 3.50 6.12 0.00 -0.80 -4.89 105.19 110.07 3g1u n GLY 122 Ca 0.13 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 3g1u n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g1u s LEU 123 N -1.01 2.82 0.63 0.99 1.43 -1.26 -0.99 118.68 121.30 3g1u s LEU 123 Ca 0.00 -0.23 -0.16 0.00 -1.03 0.00 0.00 54.13 52.71 3g1u s LEU 123 Cb 0.00 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 3g1u s LEU 123 CO 0.00 0.31 1.11 -2.16 0.23 0.00 0.00 176.35 175.84 3g1u s PRO 124 N -1.07 2.96 0.00 1.29 0.04 -1.26 -4.88 135.00 132.08 3g1u s PRO 124 Ca 0.14 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.60 3g1u s PRO 124 Cb -0.11 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.46 3g1u s PRO 124 CO 0.03 -1.13 0.34 0.27 0.04 0.00 0.00 177.00 176.55 3g1u n ASN 125 N -2.14 0.68 -3.89 6.66 0.23 -0.39 -4.60 115.26 111.80 3g1u n ASN 125 Ca 0.11 -0.86 -0.11 0.00 -0.53 0.00 0.00 54.58 53.18 3g1u n ASN 125 Cb 0.52 0.23 -0.12 0.00 -2.08 0.00 0.00 39.78 38.33 3g1u n ASN 125 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 3g1u s MET 126 N -0.23 0.22 -0.09 -3.83 -1.94 -0.94 -0.76 119.30 111.72 3g1u s MET 126 Ca 0.00 -0.20 0.03 0.00 -1.71 0.00 0.00 55.69 53.81 3g1u s MET 126 Cb 0.00 0.09 -0.01 0.00 2.01 0.00 0.00 34.83 36.92 3g1u s MET 126 CO 0.00 -0.04 -0.20 0.42 -0.01 0.00 0.00 175.02 175.19 3g1u s ILE 127 N -0.65 2.41 -0.21 2.53 1.01 -0.63 -1.47 121.20 124.20 3g1u s ILE 127 Ca -0.07 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.68 3g1u s ILE 127 Cb -0.04 -1.94 0.03 0.00 0.01 0.00 0.00 42.46 40.52 3g1u s ILE 127 CO 0.00 0.56 -0.16 -0.22 0.00 0.00 0.00 174.94 175.12 3g1u s LEU 128 N 0.11 2.60 0.10 2.97 0.20 -0.24 -1.73 118.68 122.69 3g1u s LEU 128 Ca -0.10 -0.88 0.03 0.00 0.69 0.00 0.00 54.13 53.88 3g1u s LEU 128 Cb -0.16 -1.52 -0.04 0.00 -0.43 0.00 0.00 46.19 44.05 3g1u s LEU 128 CO 0.06 -0.06 -0.09 -0.62 -0.29 0.00 0.00 176.35 175.34 3g1u s ASP 129 N 1.24 1.40 -0.07 3.68 -1.08 -0.41 -0.23 116.67 121.21 3g1u s ASP 129 Ca 0.01 -0.89 -0.03 0.00 -0.52 0.00 0.00 52.55 51.12 3g1u s ASP 129 Cb -0.15 0.03 0.04 0.00 -1.46 0.00 0.00 42.92 41.37 3g1u s ASP 129 CO -0.10 -0.33 0.15 1.51 0.52 0.00 0.00 175.17 176.92 3g1u s ASP 130 N -2.70 -0.12 0.00 -0.34 -4.77 -1.01 -1.52 116.67 106.23 3g1u s ASP 130 Ca 0.08 0.30 0.00 0.00 -3.30 0.00 0.00 52.55 49.64 3g1u s ASP 130 Cb -0.00 0.20 0.00 0.00 -1.09 0.00 0.00 42.92 42.03 3g1u s ASP 130 CO -0.01 -0.14 0.00 0.61 0.70 0.00 0.00 175.17 176.33 3g1u n GLY 131 N 4.11 2.73 0.00 2.12 0.00 -1.26 -4.63 105.19 108.26 3g1u n GLY 131 Ca -0.25 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3g1u n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g1u n GLY 132 N 0.00 1.06 0.19 -0.02 0.00 -1.26 -3.90 105.19 101.26 3g1u n GLY 132 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3g1u n GLY 132 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g1u h ASP 133 N 0.00 0.60 -0.44 1.61 3.32 -1.96 -1.61 116.42 117.93 3g1u h ASP 133 Ca 0.00 -0.41 -0.12 0.00 0.02 0.00 0.00 57.03 56.53 3g1u h ASP 133 Cb 0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 3g1u h ASP 133 CO 0.00 0.87 -0.17 0.25 -1.72 0.00 0.00 179.24 178.47 3g1u h LEU 134 N 0.32 0.95 -0.30 1.55 5.85 -1.93 -0.35 115.31 121.40 3g1u h LEU 134 Ca 0.06 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.46 3g1u h LEU 134 Cb 0.64 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3g1u h LEU 134 CO 0.04 1.10 0.18 0.74 -0.34 0.00 0.00 178.44 180.16 3g1u h THR 135 N 0.82 1.05 -0.33 1.05 2.02 -1.96 -1.50 112.91 114.05 3g1u h THR 135 Ca 0.12 -0.13 -0.13 0.00 0.77 0.00 0.00 66.41 67.04 3g1u h THR 135 Cb 0.72 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 3g1u h THR 135 CO 0.06 0.07 -0.34 0.78 0.37 0.00 0.00 175.52 176.46 3g1u h ASN 136 N 0.38 0.78 -0.31 4.18 2.35 -1.21 -2.31 115.58 119.43 3g1u h ASN 136 Ca 0.12 -0.33 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 3g1u h ASN 136 Cb -0.02 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 3g1u h ASN 136 CO -0.04 1.05 0.13 0.25 -1.65 0.00 0.00 177.43 177.16 3g1u h LEU 137 N 0.62 0.43 -0.22 1.61 5.85 -0.90 -1.41 115.31 121.29 3g1u h LEU 137 Ca 0.06 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 3g1u h LEU 137 Cb 0.87 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 3g1u h LEU 137 CO 0.08 0.48 -0.01 0.58 -0.34 0.00 0.00 178.44 179.23 3g1u h VAL 138 N 0.36 1.26 -0.30 1.05 2.07 -1.25 0.24 116.25 119.68 3g1u h VAL 138 Ca 0.10 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.62 3g1u h VAL 138 Cb 0.18 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3g1u h VAL 138 CO -0.01 0.28 -0.18 0.40 0.02 0.00 0.00 177.57 178.08 3g1u h ILE 139 N 0.16 1.30 0.00 4.57 2.04 -1.44 -1.15 117.51 122.99 3g1u h ILE 139 Ca 0.06 -1.30 -0.21 0.00 1.00 0.00 0.00 64.86 64.42 3g1u h ILE 139 Cb 0.42 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.96 3g1u h ILE 139 CO 0.01 0.41 -1.28 0.44 0.00 0.00 0.00 178.15 177.73 3g1u h ASP 140 N 0.39 0.00 0.00 1.72 3.32 -1.27 -3.37 116.42 117.21 3g1u h ASP 140 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3g1u h ASP 140 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 3g1u h ASP 140 CO 0.05 0.80 0.00 0.54 -1.72 0.00 0.00 179.24 178.91 3g1u n ARG 141 N -3.09 4.68 -3.06 3.56 5.12 0.83 -4.75 116.66 119.95 3g1u n ARG 141 Ca -0.08 -0.12 -0.22 0.00 -1.93 0.00 0.00 57.85 55.50 3g1u n ARG 141 Cb 0.92 -0.61 -0.03 0.00 -1.16 0.00 0.00 32.46 31.58 3g1u n ARG 141 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3g1u n TYR 142 N -0.70 1.89 0.25 -1.55 4.01 -0.44 -4.92 117.16 115.69 3g1u n TYR 142 Ca 0.00 -3.86 0.08 0.00 -0.16 0.00 0.00 57.90 53.96 3g1u n TYR 142 Cb 0.00 -0.44 0.61 0.00 -0.31 0.00 0.00 39.34 39.20 3g1u n TYR 142 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3g1u h PRO 143 N 2.98 0.00 0.00 -0.72 0.11 -1.72 0.71 132.00 133.37 3g1u h PRO 143 Ca 0.11 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 3g1u h PRO 143 Cb 0.78 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 3g1u h PRO 143 CO 0.64 0.09 -0.02 1.05 -0.21 0.00 0.00 178.00 179.54 3g1u h GLU 144 N 0.00 0.00 0.01 1.05 9.09 -1.91 -1.85 114.58 120.97 3g1u h GLU 144 Ca -0.00 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.22 3g1u h GLU 144 Cb 0.16 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.24 3g1u h GLU 144 CO 0.01 0.02 -0.88 -0.07 0.05 0.00 0.00 179.01 178.14 3g1u h LEU 145 N 0.00 0.14 -0.65 3.06 3.38 -1.17 -3.39 115.31 116.68 3g1u h LEU 145 Ca -0.00 -0.12 0.14 0.00 0.09 0.00 0.00 57.88 57.99 3g1u h LEU 145 Cb 0.06 -0.04 -0.11 0.00 0.09 0.00 0.00 40.66 40.66 3g1u h LEU 145 CO 0.00 0.95 0.02 0.58 0.09 0.00 0.00 178.44 180.08 3g1u h VAL 146 N 0.05 0.47 0.00 1.22 2.07 -1.26 0.42 116.25 119.22 3g1u h VAL 146 Ca -0.03 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3g1u h VAL 146 Cb 1.53 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3g1u h VAL 146 CO 0.13 0.02 0.00 -0.65 0.02 0.00 0.00 177.57 177.09 3g1u h PRO 147 N 0.13 0.00 0.00 1.57 0.11 -1.76 -2.92 132.00 129.13 3g1u h PRO 147 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3g1u h PRO 147 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 3g1u h PRO 147 CO -0.55 0.00 -0.30 1.63 -0.21 0.00 0.00 178.00 178.57 3g1u n LYS 148 N -2.58 0.10 -3.67 1.05 4.76 0.15 -4.84 118.16 113.13 3g1u n LYS 148 Ca -0.01 0.05 -0.38 0.00 -2.87 0.00 0.00 58.31 55.10 3g1u n LYS 148 Cb 0.12 -1.59 -0.12 0.00 -1.84 0.00 0.00 35.03 31.60 3g1u n LYS 148 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3g1u s ILE 149 N -3.05 4.56 -0.82 -0.18 1.01 -1.10 -4.33 121.20 117.28 3g1u s ILE 149 Ca 0.11 -0.37 0.27 0.00 0.00 0.00 0.00 60.65 60.65 3g1u s ILE 149 Cb 0.16 -3.29 0.21 0.00 0.01 0.00 0.00 42.46 39.55 3g1u s ILE 149 CO 0.64 0.12 1.71 0.49 0.00 0.00 0.00 174.94 177.89 3g1u n PHE 150 N 4.97 0.50 0.00 3.97 3.72 0.06 -4.88 117.46 125.80 3g1u n PHE 150 Ca -0.14 0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3g1u n PHE 150 Cb 0.50 -0.70 0.00 0.00 -0.94 0.00 0.00 39.48 38.34 3g1u n PHE 150 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g1u n GLY 151 N 1.39 0.69 3.22 1.37 0.00 -1.26 -4.73 105.19 105.87 3g1u n GLY 151 Ca 0.06 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 3g1u n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g1u s ILE 152 N -2.00 2.04 -0.14 -0.61 1.01 -0.62 -1.60 121.20 119.28 3g1u s ILE 152 Ca 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 60.65 59.61 3g1u s ILE 152 Cb 0.00 -1.76 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 3g1u s ILE 152 CO 0.00 0.56 -0.06 -0.94 0.00 0.00 0.00 174.94 174.49 3g1u s SER 153 N 0.27 4.58 -0.10 3.58 1.04 -0.71 -0.04 113.70 122.32 3g1u s SER 153 Ca -0.16 -0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.13 3g1u s SER 153 Cb -0.17 -1.66 0.01 0.00 0.10 0.00 0.00 66.02 64.30 3g1u s SER 153 CO 0.08 0.20 -0.20 -0.70 0.98 0.00 0.00 173.24 173.60 3g1u s GLU 154 N 0.19 2.66 0.08 4.02 2.56 -0.86 -1.29 118.70 126.05 3g1u s GLU 154 Ca -0.04 -0.74 -0.12 0.00 0.00 0.00 0.00 54.97 54.07 3g1u s GLU 154 Cb -0.14 -2.09 -0.24 0.00 2.00 0.00 0.00 34.13 33.66 3g1u s GLU 154 CO 0.03 0.08 1.17 1.49 -0.56 0.00 0.00 175.26 177.48 3g1u h GLU 155 N 6.98 0.62 -5.25 4.30 4.57 -1.61 -2.42 114.58 121.78 3g1u h GLU 155 Ca -0.25 -0.73 -0.39 0.00 -1.18 0.00 0.00 59.36 56.81 3g1u h GLU 155 Cb 1.21 0.22 -0.20 0.00 -0.16 0.00 0.00 28.75 29.83 3g1u h GLU 155 CO 0.49 1.31 -0.76 -0.08 -1.18 0.00 0.00 179.01 178.79 3g1u s THR 156 N -3.17 1.12 0.19 0.32 -1.32 -1.26 -3.32 115.64 108.20 3g1u s THR 156 Ca -0.09 -1.50 -0.20 0.00 -1.21 0.00 0.00 61.69 58.69 3g1u s THR 156 Cb 0.07 -1.26 0.14 0.00 -1.51 0.00 0.00 72.50 69.94 3g1u s THR 156 CO 0.92 -0.37 1.59 0.74 -2.21 0.00 0.00 174.62 175.29 3g1u h THR 157 N 3.89 0.18 -0.65 5.08 2.02 -1.94 -0.24 112.91 121.26 3g1u h THR 157 Ca -0.40 0.00 0.08 0.00 0.77 0.00 0.00 66.41 66.87 3g1u h THR 157 Cb 1.19 0.18 -0.07 0.00 -1.74 0.00 0.00 68.15 67.72 3g1u h THR 157 CO 0.46 0.00 0.30 0.74 0.37 0.00 0.00 175.52 177.39 3g1u h THR 158 N -0.14 0.85 -0.30 3.16 2.02 -1.94 -0.55 112.91 116.00 3g1u h THR 158 Ca 0.25 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.25 3g1u h THR 158 Cb 0.55 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 3g1u h THR 158 CO -0.69 0.10 0.20 1.23 0.37 0.00 0.00 175.52 176.72 3g1u h GLY 159 N 0.53 0.42 0.92 2.16 0.00 -1.35 -1.76 103.07 104.00 3g1u h GLY 159 Ca 0.31 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.51 3g1u h GLY 159 CO -0.26 0.15 0.51 -2.08 0.00 0.00 0.00 176.54 174.87 3g1u h VAL 160 N 0.40 1.15 -0.79 4.60 2.07 -0.32 -1.24 116.25 122.12 3g1u h VAL 160 Ca 0.11 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 3g1u h VAL 160 Cb -0.04 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 29.73 3g1u h VAL 160 CO -0.03 0.19 0.32 0.11 0.02 0.00 0.00 177.57 178.18 3g1u h LYS 161 N 1.02 1.18 -0.69 1.57 1.57 -0.97 -2.17 116.57 118.08 3g1u h LYS 161 Ca 0.31 -0.21 0.05 0.00 -1.87 0.00 0.00 60.65 58.93 3g1u h LYS 161 Cb -0.03 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.05 3g1u h LYS 161 CO -0.10 0.95 0.45 -0.97 -0.57 0.00 0.00 179.45 179.21 3g1u h ASN 162 N 1.14 0.65 -0.03 0.86 -1.24 -0.65 -0.42 115.58 115.89 3g1u h ASN 162 Ca 0.26 -0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.27 3g1u h ASN 162 Cb 0.21 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.12 3g1u h ASN 162 CO -0.02 0.43 -0.01 -0.07 -1.29 0.00 0.00 177.43 176.47 3g1u h LEU 163 N 0.74 0.06 -1.07 0.34 3.38 -0.64 -2.26 115.31 115.87 3g1u h LEU 163 Ca 0.29 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 3g1u h LEU 163 Cb 0.20 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3g1u h LEU 163 CO -0.09 0.44 0.05 1.88 0.09 0.00 0.00 178.44 180.81 3g1u h TYR 164 N -0.33 0.74 0.20 1.13 0.05 -1.34 -0.46 116.97 116.95 3g1u h TYR 164 Ca 0.01 -0.08 0.01 0.00 0.05 0.00 0.00 58.73 58.72 3g1u h TYR 164 Cb 0.42 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.92 3g1u h TYR 164 CO 0.06 0.67 -0.32 -0.22 -1.05 0.00 0.00 178.16 177.31 3g1u h LYS 165 N 0.68 -0.57 -0.29 4.88 3.11 -1.02 -1.07 116.57 122.29 3g1u h LYS 165 Ca 0.14 0.04 0.04 0.00 -2.81 0.00 0.00 60.65 58.06 3g1u h LYS 165 Cb 0.35 0.13 -0.04 0.00 -1.00 0.00 0.00 32.23 31.67 3g1u h LYS 165 CO 0.01 -0.38 0.05 0.00 -2.81 0.00 0.00 179.45 176.32 3g1u h ARG 166 N -0.59 0.14 0.33 1.90 3.08 -1.29 -3.26 114.38 114.69 3g1u h ARG 166 Ca 0.01 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g1u h ARG 166 Cb 0.58 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3g1u h ARG 166 CO -0.14 0.10 -0.34 1.25 -1.07 0.00 0.00 179.97 179.77 3g1u h LEU 167 N 0.15 -0.94 -1.08 3.04 5.85 -0.75 -0.13 115.31 121.45 3g1u h LEU 167 Ca 0.13 0.08 0.36 0.00 0.84 0.00 0.00 57.88 59.30 3g1u h LEU 167 Cb 0.15 0.32 -0.15 0.00 0.37 0.00 0.00 40.66 41.35 3g1u h LEU 167 CO -0.19 -0.48 0.61 0.77 -0.34 0.00 0.00 178.44 178.82 3g1u h SER 168 N -0.71 0.43 -0.44 1.25 4.64 -1.25 -0.49 113.55 116.98 3g1u h SER 168 Ca -0.02 0.19 -0.23 0.00 -0.47 0.00 0.00 61.79 61.26 3g1u h SER 168 Cb 0.64 0.16 -0.14 0.00 -0.31 0.00 0.00 62.40 62.76 3g1u h SER 168 CO -0.07 -0.20 -0.01 2.29 -0.87 0.00 0.00 176.83 177.97 3g1u n LYS 169 N -5.02 1.91 -2.38 4.77 2.85 -1.07 -4.98 118.16 114.24 3g1u n LYS 169 Ca 0.34 -3.20 -0.17 0.00 -1.05 0.00 0.00 58.31 54.23 3g1u n LYS 169 Cb 1.12 -1.87 -0.01 0.00 -0.65 0.00 0.00 35.03 33.63 3g1u n LYS 169 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3g1u n GLY 170 N -1.12 -0.35 0.70 2.58 0.00 -0.19 -4.90 105.19 101.90 3g1u n GLY 170 Ca 0.37 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.33 3g1u n GLY 170 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g1u n ASN 171 N -1.36 3.46 -4.11 1.61 3.02 -0.09 -4.87 115.26 112.91 3g1u n ASN 171 Ca -0.20 -2.88 -0.35 0.00 -0.03 0.00 0.00 54.58 51.12 3g1u n ASN 171 Cb 0.65 -0.47 -0.12 0.00 -0.61 0.00 0.00 39.78 39.23 3g1u n ASN 171 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3g1u s LEU 172 N -2.57 4.95 0.00 3.41 2.96 -1.25 -4.82 118.68 121.37 3g1u s LEU 172 Ca 0.37 -1.93 0.25 0.00 -0.22 0.00 0.00 54.13 52.60 3g1u s LEU 172 Cb 0.29 -1.78 0.65 0.00 0.50 0.00 0.00 46.19 45.86 3g1u s LEU 172 CO 0.08 -0.47 1.51 -0.81 -1.32 0.00 0.00 176.35 175.35 3g1u n PRO 173 N 4.54 2.00 -4.46 0.98 -0.04 -1.26 -4.64 135.00 132.12 3g1u n PRO 173 Ca -0.03 -1.47 -0.23 0.00 -0.04 0.00 0.00 63.50 61.74 3g1u n PRO 173 Cb 0.42 -1.46 -0.16 0.00 -0.04 0.00 0.00 33.50 32.25 3g1u n PRO 173 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3g1u s ILE 174 N -1.89 0.94 0.56 0.52 1.01 -1.26 -0.20 121.20 120.87 3g1u s ILE 174 Ca 0.34 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.42 3g1u s ILE 174 Cb 0.20 -0.86 -0.05 0.00 0.01 0.00 0.00 42.46 41.76 3g1u s ILE 174 CO 0.31 0.30 1.09 -0.44 0.00 0.00 0.00 174.94 176.20 3g1u s SER 175 N 0.58 5.78 0.14 3.58 0.01 -1.24 -4.73 113.70 117.83 3g1u s SER 175 Ca -0.11 2.03 0.08 0.00 1.31 0.00 0.00 55.95 59.25 3g1u s SER 175 Cb -0.14 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.49 3g1u s SER 175 CO 0.02 -1.17 -0.17 0.00 0.41 0.00 0.00 173.24 172.33 3g1u s ALA 176 N -2.03 1.79 -0.25 1.44 0.00 -0.13 -1.59 121.76 120.99 3g1u s ALA 176 Ca 0.69 -1.38 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 3g1u s ALA 176 Cb -0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 3g1u s ALA 176 CO 0.29 0.21 0.02 0.42 0.00 0.00 0.00 175.76 176.70 3g1u s ILE 177 N -1.94 3.70 -0.58 0.00 1.01 0.94 -0.30 121.20 124.04 3g1u s ILE 177 Ca 0.12 -0.55 -0.27 0.00 0.00 0.00 0.00 60.65 59.95 3g1u s ILE 177 Cb -0.06 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 3g1u s ILE 177 CO 0.05 0.27 1.89 0.21 0.00 0.00 0.00 174.94 177.36 3g1u s ASN 178 N 1.50 5.28 -0.06 3.58 3.84 0.46 -2.04 114.94 127.50 3g1u s ASN 178 Ca 0.04 0.47 0.15 0.00 0.21 0.00 0.00 52.86 53.74 3g1u s ASN 178 Cb -0.16 -2.53 -0.22 0.00 -0.55 0.00 0.00 41.25 37.80 3g1u s ASN 178 CO -0.00 -2.35 0.54 0.52 -2.79 0.00 0.00 177.10 173.02 3g1u n VAL 179 N 7.28 1.38 -0.34 -5.21 0.31 -0.92 -4.21 118.33 116.62 3g1u n VAL 179 Ca 0.22 -0.77 0.16 0.00 -0.01 0.00 0.00 64.34 63.94 3g1u n VAL 179 Cb 0.52 -0.77 0.37 0.00 -0.91 0.00 0.00 33.84 33.04 3g1u n VAL 179 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 3g1u h ASN 180 N 0.00 0.60 -3.53 4.52 -1.24 -1.53 -3.49 115.58 110.90 3g1u h ASN 180 Ca -0.31 0.14 -0.72 0.00 0.71 0.00 0.00 56.30 56.12 3g1u h ASN 180 Cb 1.93 0.05 -0.22 0.00 0.73 0.00 0.00 38.32 40.81 3g1u h ASN 180 CO 0.05 0.08 -0.45 -1.81 -1.29 0.00 0.00 177.43 174.01 3g1u s ASP 181 N -5.20 6.02 -0.41 1.15 1.01 -1.26 -4.98 116.67 113.01 3g1u s ASP 181 Ca -0.11 -0.90 0.00 0.00 0.71 0.00 0.00 52.55 52.25 3g1u s ASP 181 Cb 0.27 -2.13 0.38 0.00 1.01 0.00 0.00 42.92 42.45 3g1u s ASP 181 CO 0.79 -0.43 1.87 0.49 0.21 0.00 0.00 175.17 178.11 3g1u n PHE 188 N 5.12 2.23 -0.29 4.23 0.99 -1.26 -5.01 117.46 123.47 3g1u n PHE 188 Ca -0.11 -2.03 0.05 0.00 -0.00 0.00 0.00 57.45 55.36 3g1u n PHE 188 Cb 0.47 -1.00 0.20 0.00 -1.00 0.00 0.00 39.48 38.15 3g1u n PHE 188 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 3g1u h ASP 189 N 1.29 0.55 1.35 4.37 3.32 -1.96 -1.54 116.42 123.81 3g1u h ASP 189 Ca 0.44 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.55 3g1u h ASP 189 Cb 1.46 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 3g1u h ASP 189 CO 0.98 0.27 -0.08 0.78 -1.72 0.00 0.00 179.24 179.47 3g1u h ASN 190 N 0.66 0.00 0.22 6.45 -0.26 -1.97 0.33 115.58 121.01 3g1u h ASN 190 Ca 0.43 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 56.16 3g1u h ASN 190 Cb 0.55 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 3g1u h ASN 190 CO -0.32 0.08 -0.11 0.25 -1.06 0.00 0.00 177.43 176.26 3g1u h LEU 191 N 0.00 -0.25 -0.89 1.61 6.46 -1.37 -2.65 115.31 118.22 3g1u h LEU 191 Ca -0.00 -0.26 -0.10 0.00 -0.12 0.00 0.00 57.88 57.40 3g1u h LEU 191 Cb 0.77 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 3g1u h LEU 191 CO 0.01 0.18 -0.25 1.88 -0.62 0.00 0.00 178.44 179.64 3g1u h TYR 192 N -0.76 0.60 0.57 1.25 0.05 -1.21 -1.93 116.97 115.54 3g1u h TYR 192 Ca -0.03 -0.13 -0.03 0.00 0.05 0.00 0.00 58.73 58.59 3g1u h TYR 192 Cb 0.50 -0.15 0.01 0.00 1.01 0.00 0.00 36.73 38.10 3g1u h TYR 192 CO 0.05 0.74 -0.27 0.78 -1.05 0.00 0.00 178.16 178.41 3g1u h GLY 193 N 1.01 -0.79 2.00 3.88 0.00 -0.45 -3.03 103.07 105.69 3g1u h GLY 193 Ca 0.07 0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 3g1u h GLY 193 CO 0.05 -0.29 -0.12 0.00 0.00 0.00 0.00 176.54 176.19 3g1u h ARG 195 N 0.00 0.00 0.00 0.00 2.43 -1.22 -2.02 114.38 113.57 3g1u h ARG 195 Ca -0.00 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 3g1u h ARG 195 Cb 0.26 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 3g1u h ARG 195 CO 0.01 0.00 -1.57 0.39 -1.51 0.00 0.00 179.97 177.29 3g1u n GLU 196 N -4.20 0.99 -0.01 0.20 1.02 -0.87 -4.46 120.64 113.32 3g1u n GLU 196 Ca 0.00 -0.07 0.11 0.00 -0.02 0.00 0.00 57.16 57.18 3g1u n GLU 196 Cb 0.24 -1.26 -0.16 0.00 -0.02 0.00 0.00 31.44 30.24 3g1u n GLU 196 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3g1u n SER 197 N -2.05 0.14 0.19 1.62 3.41 -0.55 -3.73 113.62 112.65 3g1u n SER 197 Ca -0.07 -0.11 -0.14 0.00 -0.26 0.00 0.00 58.87 58.29 3g1u n SER 197 Cb 0.47 1.84 -0.08 0.00 -0.26 0.00 0.00 64.21 66.18 3g1u n SER 197 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3g1u h LEU 198 N 0.00 -0.38 -0.63 1.04 5.85 -1.61 -2.21 115.31 117.38 3g1u h LEU 198 Ca 0.00 -0.08 -0.15 0.00 0.84 0.00 0.00 57.88 58.49 3g1u h LEU 198 Cb 0.94 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 3g1u h LEU 198 CO 0.00 -0.15 -0.51 0.58 -0.34 0.00 0.00 178.44 178.02 3g1u h VAL 199 N -0.60 1.33 -0.54 1.05 2.07 -1.80 -2.01 116.25 115.75 3g1u h VAL 199 Ca -0.05 -1.75 0.11 0.00 0.82 0.00 0.00 66.70 65.83 3g1u h VAL 199 Cb 0.44 1.76 -0.10 0.00 -1.52 0.00 0.00 31.29 31.86 3g1u h VAL 199 CO 0.08 0.54 -0.13 -0.78 0.02 0.00 0.00 177.57 177.30 3g1u h ASP 200 N 0.36 -0.49 -0.14 0.57 1.82 -1.64 0.26 116.42 117.16 3g1u h ASP 200 Ca 0.01 0.16 0.03 0.00 -0.39 0.00 0.00 57.03 56.84 3g1u h ASP 200 Cb 1.02 0.33 -0.03 0.00 0.68 0.00 0.00 39.33 41.33 3g1u h ASP 200 CO 0.09 -0.17 -0.04 1.23 -1.61 0.00 0.00 179.24 178.74 3g1u h GLY 201 N 0.01 0.10 0.91 -0.78 0.00 -0.87 -1.18 103.07 101.25 3g1u h GLY 201 Ca 0.26 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.62 3g1u h GLY 201 CO -0.55 -0.06 0.09 -2.22 0.00 0.00 0.00 176.54 173.80 3g1u h ILE 202 N -0.01 1.21 -0.36 2.60 2.04 -0.82 -2.15 117.51 120.02 3g1u h ILE 202 Ca 0.07 -0.70 -0.11 0.00 1.00 0.00 0.00 64.86 65.13 3g1u h ILE 202 Cb 0.12 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 3g1u h ILE 202 CO -0.16 0.24 -0.21 0.11 0.00 0.00 0.00 178.15 178.13 3g1u h LYS 203 N 0.38 0.70 -0.27 2.37 1.57 -0.45 -0.13 116.57 120.75 3g1u h LYS 203 Ca 0.11 -0.27 -0.11 0.00 -1.87 0.00 0.00 60.65 58.51 3g1u h LYS 203 Cb 0.27 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3g1u h LYS 203 CO -0.00 0.86 -0.29 0.00 -0.57 0.00 0.00 179.45 179.45 3g1u h ARG 204 N 0.62 0.54 -0.11 3.15 3.08 -1.08 0.31 114.38 120.89 3g1u h ARG 204 Ca 0.09 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.84 3g1u h ARG 204 Cb 0.70 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.73 3g1u h ARG 204 CO 0.05 0.77 -0.24 0.00 -1.07 0.00 0.00 179.97 179.48 3g1u h ALA 205 N 1.22 0.18 0.00 0.04 0.00 -1.21 -3.41 119.26 116.08 3g1u h ALA 205 Ca 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3g1u h ALA 205 Cb 0.74 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3g1u h ALA 205 CO 0.06 0.16 -0.35 0.25 0.00 0.00 0.00 179.25 179.37 3g1u n THR 206 N -4.47 0.00 -0.82 0.00 -2.24 -0.08 -4.98 114.28 101.69 3g1u n THR 206 Ca -0.07 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 3g1u n THR 206 Cb 0.44 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 3g1u n THR 206 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g1u n ASP 207 N -0.98 -4.74 -4.76 3.42 8.00 0.11 -4.92 116.55 112.67 3g1u n ASP 207 Ca 0.00 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.12 3g1u n ASP 207 Cb 0.00 -2.99 0.02 0.00 -0.02 0.00 0.00 41.12 38.13 3g1u n ASP 207 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g1u s VAL 208 N -0.85 2.44 0.13 2.53 0.11 -1.26 -4.97 120.40 118.53 3g1u s VAL 208 Ca 0.00 0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 59.10 3g1u s VAL 208 Cb 0.00 -3.19 -0.07 0.00 -1.53 0.00 0.00 36.38 31.59 3g1u s VAL 208 CO 0.00 0.01 1.21 -0.32 -3.33 0.00 0.00 175.10 172.68 3g1u s MET 209 N -2.69 4.46 -0.04 1.54 1.75 -1.26 -4.85 119.30 118.20 3g1u s MET 209 Ca 0.66 1.85 -0.13 0.00 -1.25 0.00 0.00 55.69 56.82 3g1u s MET 209 Cb -0.37 -3.28 -0.31 0.00 2.84 0.00 0.00 34.83 33.71 3g1u s MET 209 CO 0.45 -0.18 0.72 0.82 -0.65 0.00 0.00 175.02 176.19 3g1u h ILE 210 N 4.07 1.04 -2.61 10.11 1.08 -1.93 -3.44 117.51 125.83 3g1u h ILE 210 Ca -0.43 -2.53 -0.59 0.00 -0.39 0.00 0.00 64.86 60.92 3g1u h ILE 210 Cb 1.21 2.83 0.08 0.00 -3.07 0.00 0.00 36.82 37.88 3g1u h ILE 210 CO 0.78 0.82 0.58 0.00 -0.69 0.00 0.00 178.15 179.64 3g1u n ALA 211 N -2.85 0.94 0.00 1.87 0.00 -1.04 -2.42 120.51 117.03 3g1u n ALA 211 Ca -0.23 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3g1u n ALA 211 Cb 1.04 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3g1u n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1u n GLY 212 N 2.15 2.45 3.83 0.00 0.00 -0.49 -4.89 105.19 108.24 3g1u n GLY 212 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 3g1u n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g1u s LYS 213 N -0.34 4.17 -0.11 1.61 -0.14 -1.01 -4.86 119.74 119.05 3g1u s LYS 213 Ca 0.00 0.96 -0.15 0.00 -1.36 0.00 0.00 55.97 55.42 3g1u s LYS 213 Cb 0.00 -2.36 -0.05 0.00 -1.68 0.00 0.00 37.83 33.75 3g1u s LYS 213 CO 0.00 0.09 0.36 0.99 -0.76 0.00 0.00 175.35 176.02 3g1u s THR 214 N -2.03 5.22 0.04 2.17 2.01 -1.26 -0.94 115.64 120.86 3g1u s THR 214 Ca 0.57 0.70 0.06 0.00 0.31 0.00 0.00 61.69 63.33 3g1u s THR 214 Cb -0.11 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 3g1u s THR 214 CO 0.16 0.43 -0.18 0.00 -0.69 0.00 0.00 174.62 174.34 3g1u s VAL 217 N 1.28 4.61 -0.33 0.00 1.01 -0.09 -0.77 120.40 126.11 3g1u s VAL 217 Ca -0.04 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.74 3g1u s VAL 217 Cb -0.19 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.01 3g1u s VAL 217 CO -0.02 0.33 0.28 0.00 0.00 0.00 0.00 175.10 175.69 3g1u n GLY 219 N 5.03 2.03 2.73 0.00 0.00 0.15 -0.81 105.19 114.32 3g1u n GLY 219 Ca -0.11 -1.69 -0.04 0.00 0.00 0.00 0.00 46.02 44.17 3g1u n GLY 219 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3g1u n TYR 220 N 1.90 0.33 -0.25 1.61 4.19 -1.26 -4.35 117.16 119.33 3g1u n TYR 220 Ca 0.00 -2.30 0.00 0.00 3.31 0.00 0.00 57.90 58.91 3g1u n TYR 220 Cb 0.00 0.17 0.00 0.00 0.49 0.00 0.00 39.34 40.00 3g1u n TYR 220 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3g1u n GLY 221 N -0.52 -0.98 0.35 2.98 0.00 -1.26 -4.61 105.19 101.15 3g1u n GLY 221 Ca 0.03 -1.62 0.10 0.00 0.00 0.00 0.00 46.02 44.54 3g1u n GLY 221 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g1u h ASP 222 N -0.02 0.46 -0.02 1.61 5.19 -1.96 -0.61 116.42 121.07 3g1u h ASP 222 Ca 0.00 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.39 3g1u h ASP 222 Cb 0.00 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.42 3g1u h ASP 222 CO 0.00 0.28 -0.10 0.58 -3.12 0.00 0.00 179.24 176.88 3g1u h VAL 223 N 0.51 1.52 -0.45 -1.35 2.07 -1.91 -2.41 116.25 114.24 3g1u h VAL 223 Ca 0.29 -1.67 0.08 0.00 0.82 0.00 0.00 66.70 66.22 3g1u h VAL 223 Cb 0.47 2.58 -0.06 0.00 -1.52 0.00 0.00 31.29 32.76 3g1u h VAL 223 CO -0.09 0.45 0.07 1.23 0.02 0.00 0.00 177.57 179.25 3g1u h GLY 224 N -0.55 0.52 0.35 2.17 0.00 -1.71 -0.39 103.07 103.47 3g1u h GLY 224 Ca -0.01 -0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.40 3g1u h GLY 224 CO 0.02 -0.06 0.09 0.50 0.00 0.00 0.00 176.54 177.09 3g1u h LYS 225 N 0.20 0.22 -0.25 4.80 1.57 -1.09 0.31 116.57 122.33 3g1u h LYS 225 Ca 0.22 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 3g1u h LYS 225 Cb 0.29 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 3g1u h LYS 225 CO -0.30 0.14 -0.14 0.78 -0.57 0.00 0.00 179.45 179.36 3g1u h GLY 226 N 0.22 0.59 0.98 3.86 0.00 -1.13 -0.88 103.07 106.72 3g1u h GLY 226 Ca 0.24 -0.54 0.01 0.00 0.00 0.00 0.00 47.33 47.04 3g1u h GLY 226 CO -0.33 0.49 0.36 0.00 0.00 0.00 0.00 176.54 177.07 3g1u h ALA 228 N 1.21 0.74 -0.69 0.00 0.00 -0.28 -2.31 119.26 117.93 3g1u h ALA 228 Ca 0.21 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3g1u h ALA 228 Cb -0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3g1u h ALA 228 CO -0.05 0.54 0.24 0.00 0.00 0.00 0.00 179.25 179.97 3g1u h ALA 229 N 0.97 0.91 0.22 0.00 0.00 -0.92 -1.83 119.26 118.61 3g1u h ALA 229 Ca 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3g1u h ALA 229 Cb 0.51 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3g1u h ALA 229 CO 0.02 0.57 -0.14 0.00 0.00 0.00 0.00 179.25 179.70 3g1u h ALA 230 N 1.11 -0.34 -0.78 0.00 0.00 -0.90 -0.08 119.26 118.26 3g1u h ALA 230 Ca 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3g1u h ALA 230 Cb 0.27 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3g1u h ALA 230 CO -0.01 -0.70 0.35 -0.07 0.00 0.00 0.00 179.25 178.82 3g1u h LEU 231 N -0.35 1.04 -0.83 0.00 3.38 -1.37 -2.68 115.31 114.49 3g1u h LEU 231 Ca -0.02 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 3g1u h LEU 231 Cb 0.29 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3g1u h LEU 231 CO 0.02 0.89 -0.38 -0.09 0.09 0.00 0.00 178.44 178.98 3g1u h ARG 232 N 1.12 0.42 -0.27 1.13 2.43 -1.21 -1.95 114.38 116.05 3g1u h ARG 232 Ca 0.27 -0.19 0.08 0.00 -0.81 0.00 0.00 59.98 59.32 3g1u h ARG 232 Cb 0.15 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3g1u h ARG 232 CO -0.03 0.73 0.20 0.00 -1.51 0.00 0.00 179.97 179.37 3g1u h ALA 233 N 1.25 2.19 -0.50 2.80 0.00 -0.65 -2.37 119.26 121.98 3g1u h ALA 233 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3g1u h ALA 233 Cb 0.82 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3g1u h ALA 233 CO 0.07 -0.34 0.00 1.19 0.00 0.00 0.00 179.25 180.17 3g1u n PHE 234 N -4.34 0.65 -0.35 0.00 3.72 -1.01 -4.94 117.46 111.19 3g1u n PHE 234 Ca 0.03 -0.33 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 3g1u n PHE 234 Cb 0.36 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 3g1u n PHE 234 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g1u n GLY 235 N 1.53 0.79 3.81 1.37 0.00 -0.89 -2.48 105.19 109.32 3g1u n GLY 235 Ca 0.21 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 3g1u n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u s ALA 236 N -2.00 3.07 -0.31 4.61 0.00 -0.77 -1.39 121.76 124.97 3g1u s ALA 236 Ca 0.00 0.43 -0.17 0.00 0.00 0.00 0.00 51.96 52.21 3g1u s ALA 236 Cb 0.00 -3.16 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 3g1u s ALA 236 CO 0.00 0.13 0.48 0.50 0.00 0.00 0.00 175.76 176.87 3g1u s ARG 237 N -2.97 3.80 -0.21 0.00 3.52 -0.11 -4.35 118.95 118.63 3g1u s ARG 237 Ca 0.60 -0.02 -0.09 0.00 -0.13 0.00 0.00 55.73 56.08 3g1u s ARG 237 Cb -0.11 -3.74 -0.05 0.00 -1.56 0.00 0.00 34.95 29.50 3g1u s ARG 237 CO 0.15 -0.49 0.11 0.08 -0.81 0.00 0.00 175.30 174.34 3g1u s VAL 238 N 2.28 5.11 -0.16 7.11 1.01 -1.26 -0.40 120.40 134.10 3g1u s VAL 238 Ca 0.18 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 3g1u s VAL 238 Cb -0.16 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 3g1u s VAL 238 CO 0.12 0.41 0.05 -0.69 0.00 0.00 0.00 175.10 174.98 3g1u s VAL 239 N 0.64 4.66 -0.01 2.92 1.01 0.66 -4.19 120.40 126.10 3g1u s VAL 239 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.95 3g1u s VAL 239 Cb -0.12 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 3g1u s VAL 239 CO 0.01 0.50 0.05 -0.69 0.00 0.00 0.00 175.10 174.97 3g1u s VAL 240 N 0.11 4.54 0.07 2.92 1.01 -0.03 -0.91 120.40 128.10 3g1u s VAL 240 Ca 0.04 -0.45 0.09 0.00 0.00 0.00 0.00 61.98 61.66 3g1u s VAL 240 Cb -0.12 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 3g1u s VAL 240 CO 0.01 0.37 -0.26 0.42 0.00 0.00 0.00 175.10 175.65 3g1u s THR 241 N -1.14 2.09 -0.02 3.92 -4.23 -0.31 -1.25 115.64 114.70 3g1u s THR 241 Ca 0.21 -1.48 -0.22 0.00 -1.18 0.00 0.00 61.69 59.02 3g1u s THR 241 Cb -0.12 -1.82 0.04 0.00 1.34 0.00 0.00 72.50 71.95 3g1u s THR 241 CO 0.12 0.25 0.48 -1.61 -0.54 0.00 0.00 174.62 173.32 3g1u s GLU 242 N -1.49 0.88 0.00 3.99 0.41 -1.26 0.29 118.70 121.51 3g1u s GLU 242 Ca 0.12 -0.04 0.17 0.00 -0.41 0.00 0.00 54.97 54.81 3g1u s GLU 242 Cb -0.10 0.40 -0.19 0.00 -1.78 0.00 0.00 34.13 32.47 3g1u s GLU 242 CO 0.03 -0.27 0.75 1.33 -0.49 0.00 0.00 175.26 176.61 3g1u n VAL 243 N 0.98 0.00 -4.04 2.63 0.24 -1.26 -4.96 118.33 111.93 3g1u n VAL 243 Ca -0.20 -0.09 -0.35 0.00 -2.04 0.00 0.00 64.34 61.66 3g1u n VAL 243 Cb 0.57 1.01 -0.12 0.00 -1.47 0.00 0.00 33.84 33.82 3g1u n VAL 243 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3g1u s ASP 244 N -2.65 4.98 0.35 -1.34 -1.08 -1.26 -5.01 116.67 110.68 3g1u s ASP 244 Ca 0.07 -0.16 0.02 0.00 -0.52 0.00 0.00 52.55 51.96 3g1u s ASP 244 Cb 0.13 -1.86 0.65 0.00 -1.46 0.00 0.00 42.92 40.38 3g1u s ASP 244 CO 0.72 0.07 2.01 1.55 0.52 0.00 0.00 175.17 180.04 3g1u h PRO 245 N 7.46 0.82 0.05 4.34 0.13 -1.99 -1.58 132.00 141.23 3g1u h PRO 245 Ca -0.36 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3g1u h PRO 245 Cb 1.18 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.12 3g1u h PRO 245 CO 0.62 0.54 -0.02 0.82 -0.23 0.00 0.00 178.00 179.73 3g1u h ILE 246 N 0.84 1.13 -0.18 -3.56 2.04 -2.00 -2.00 117.51 113.79 3g1u h ILE 246 Ca 0.23 -0.56 -0.09 0.00 1.00 0.00 0.00 64.86 65.43 3g1u h ILE 246 Cb -0.10 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3g1u h ILE 246 CO -0.05 0.14 -0.30 0.78 0.00 0.00 0.00 178.15 178.72 3g1u h ASN 247 N -0.31 0.35 -0.35 1.72 4.21 -1.84 -2.10 115.58 117.26 3g1u h ASN 247 Ca -0.01 -0.12 -0.03 0.00 1.21 0.00 0.00 56.30 57.35 3g1u h ASN 247 Cb 0.28 -0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.37 3g1u h ASN 247 CO 0.01 0.64 0.09 0.00 -1.29 0.00 0.00 177.43 176.88 3g1u h ALA 248 N 1.39 0.46 -0.44 -0.83 0.00 -1.24 -0.31 119.26 118.28 3g1u h ALA 248 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3g1u h ALA 248 Cb 0.69 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3g1u h ALA 248 CO 0.05 0.12 0.29 1.25 0.00 0.00 0.00 179.25 180.97 3g1u h LEU 249 N 0.41 0.51 -0.43 0.00 5.85 -1.22 -1.52 115.31 118.91 3g1u h LEU 249 Ca 0.11 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3g1u h LEU 249 Cb 0.29 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 3g1u h LEU 249 CO 0.00 0.37 0.22 1.56 -0.34 0.00 0.00 178.44 180.25 3g1u h GLN 250 N 0.60 0.43 -0.50 1.25 4.20 -1.19 -0.21 115.11 119.68 3g1u h GLN 250 Ca 0.16 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.89 3g1u h GLN 250 Cb -0.07 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.57 3g1u h GLN 250 CO -0.04 0.28 0.27 0.00 -0.67 0.00 0.00 178.83 178.67 3g1u h ALA 251 N 1.23 0.64 -0.79 3.87 0.00 -0.81 -1.68 119.26 121.72 3g1u h ALA 251 Ca 0.19 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3g1u h ALA 251 Cb 0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3g1u h ALA 251 CO -0.13 -0.07 0.50 0.77 0.00 0.00 0.00 179.25 180.33 3g1u h SER 252 N 0.52 0.83 0.75 0.00 0.02 -0.91 -1.28 113.55 113.48 3g1u h SER 252 Ca 0.22 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3g1u h SER 252 Cb 0.10 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.46 3g1u h SER 252 CO -0.14 0.57 0.00 0.24 -1.14 0.00 0.00 176.83 176.36 3g1u h MET 253 N 0.98 0.00 -0.02 3.45 2.07 -0.55 -1.01 114.93 119.84 3g1u h MET 253 Ca 0.31 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.94 3g1u h MET 253 Cb 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.74 3g1u h MET 253 CO -0.11 0.00 -0.05 -1.91 1.07 0.00 0.00 176.91 175.91 3g1u n GLU 254 N -2.96 1.96 -0.06 1.72 4.07 -0.67 -4.94 120.64 119.78 3g1u n GLU 254 Ca -0.00 -1.49 0.00 0.00 -0.06 0.00 0.00 57.16 55.61 3g1u n GLU 254 Cb 0.24 -1.47 0.00 0.00 -0.06 0.00 0.00 31.44 30.15 3g1u n GLU 254 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3g1u n GLY 255 N 1.30 0.97 3.71 8.31 0.00 -0.38 -5.07 105.19 114.02 3g1u n GLY 255 Ca 0.15 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 3g1u n GLY 255 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g1u s TYR 256 N -2.00 3.29 0.19 1.61 2.02 -0.57 -5.00 117.35 116.89 3g1u s TYR 256 Ca 0.00 0.21 -0.32 0.00 -0.37 0.00 0.00 57.07 56.59 3g1u s TYR 256 Cb 0.00 -1.94 -0.11 0.00 -0.40 0.00 0.00 41.96 39.51 3g1u s TYR 256 CO 0.00 0.40 1.65 -1.14 -1.57 0.00 0.00 175.55 174.89 3g1u s GLN 257 N -0.41 4.16 -0.23 -0.62 0.74 -1.26 -3.55 119.66 118.50 3g1u s GLN 257 Ca 0.09 2.50 -0.07 0.00 0.05 0.00 0.00 55.36 57.93 3g1u s GLN 257 Cb -0.12 -3.11 -0.03 0.00 1.10 0.00 0.00 33.01 30.86 3g1u s GLN 257 CO 0.02 -0.68 0.05 0.08 -0.55 0.00 0.00 175.29 174.20 3g1u s VAL 258 N 1.10 4.20 0.30 1.34 1.01 -1.26 -0.85 120.40 126.24 3g1u s VAL 258 Ca 0.72 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.51 3g1u s VAL 258 Cb -0.47 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 3g1u s VAL 258 CO 0.32 0.37 0.31 0.00 0.00 0.00 0.00 175.10 176.10 3g1u s ALA 259 N 1.39 1.31 0.49 5.51 0.00 -0.38 -4.98 121.76 125.10 3g1u s ALA 259 Ca 0.05 -1.78 -0.12 0.00 0.00 0.00 0.00 51.96 50.10 3g1u s ALA 259 Cb -0.15 1.35 -0.06 0.00 0.00 0.00 0.00 23.12 24.26 3g1u s ALA 259 CO 0.03 -0.69 0.90 -0.51 0.00 0.00 0.00 175.76 175.49 3g1u s LEU 260 N -3.27 3.62 0.26 0.00 1.43 -1.26 -4.23 118.68 115.23 3g1u s LEU 260 Ca 0.37 1.34 -0.01 0.00 -1.03 0.00 0.00 54.13 54.79 3g1u s LEU 260 Cb 0.03 -4.28 0.50 0.00 0.03 0.00 0.00 46.19 42.47 3g1u s LEU 260 CO 0.21 -0.58 1.80 0.58 0.23 0.00 0.00 176.35 178.60 3g1u h VAL 261 N 0.69 0.85 -0.55 -1.59 2.07 -1.96 -2.19 116.25 113.56 3g1u h VAL 261 Ca -0.46 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 66.81 3g1u h VAL 261 Cb 1.19 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3g1u h VAL 261 CO 0.62 0.15 0.37 -0.33 0.02 0.00 0.00 177.57 178.40 3g1u h GLU 262 N 0.80 0.63 0.00 1.57 3.07 -1.97 -0.05 114.58 118.63 3g1u h GLU 262 Ca 0.45 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.27 3g1u h GLU 262 Cb 0.51 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.28 3g1u h GLU 262 CO -0.29 0.42 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.28 3g1u h ASP 263 N 0.65 0.00 0.00 1.42 3.32 -1.78 -3.25 116.42 116.79 3g1u h ASP 263 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3g1u h ASP 263 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3g1u h ASP 263 CO -0.06 0.02 0.00 1.33 -1.72 0.00 0.00 179.24 178.81 3g1u n VAL 264 N -4.11 0.11 0.26 -1.35 0.24 -0.87 -4.82 118.33 107.79 3g1u n VAL 264 Ca -0.03 -0.41 0.13 0.00 -2.04 0.00 0.00 64.34 62.00 3g1u n VAL 264 Cb 0.10 1.20 0.81 0.00 -1.47 0.00 0.00 33.84 34.48 3g1u n VAL 264 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g1u h MET 265 N 0.00 0.00 0.00 7.34 -0.00 -1.05 -1.51 114.93 119.71 3g1u h MET 265 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3g1u h MET 265 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.82 3g1u h MET 265 CO 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 176.91 176.31 3g1u n ALA 266 N -2.40 3.05 -0.02 -3.00 0.00 -1.26 -4.05 120.51 112.83 3g1u n ALA 266 Ca -0.02 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.15 3g1u n ALA 266 Cb 0.13 -1.16 -0.07 0.00 0.00 0.00 0.00 19.45 18.35 3g1u n ALA 266 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3g1u n ASP 267 N -1.97 2.94 -4.70 0.00 8.00 -0.80 -4.02 116.55 116.01 3g1u n ASP 267 Ca 0.04 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.12 3g1u n ASP 267 Cb 0.42 1.07 -0.03 0.00 -0.02 0.00 0.00 41.12 42.56 3g1u n ASP 267 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1u s ALA 268 N -2.42 3.67 0.17 2.24 0.00 -0.64 -4.68 121.76 120.10 3g1u s ALA 268 Ca -0.04 1.17 0.10 0.00 0.00 0.00 0.00 51.96 53.20 3g1u s ALA 268 Cb 0.04 -3.65 0.15 0.00 0.00 0.00 0.00 23.12 19.66 3g1u s ALA 268 CO 0.36 -0.97 1.48 0.45 0.00 0.00 0.00 175.76 177.08 3g1u h HIS 269 N 7.84 0.00 -3.60 0.00 3.86 -1.28 -3.42 115.15 118.56 3g1u h HIS 269 Ca -0.42 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.54 3g1u h HIS 269 Cb 1.20 0.00 -0.30 0.00 1.06 0.00 0.00 27.41 29.36 3g1u h HIS 269 CO 0.74 0.73 -0.71 0.42 0.86 0.00 0.00 177.93 179.98 3g1u s ILE 270 N -3.22 -0.03 -0.07 2.45 1.01 -1.13 -0.74 121.20 119.47 3g1u s ILE 270 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.79 3g1u s ILE 270 Cb 0.11 -0.06 -0.01 0.00 0.01 0.00 0.00 42.46 42.50 3g1u s ILE 270 CO 0.78 0.04 -0.22 -0.36 0.00 0.00 0.00 174.94 175.18 3g1u s PHE 271 N 0.50 2.54 -0.08 3.97 0.08 0.63 -0.57 117.98 125.04 3g1u s PHE 271 Ca -0.04 -0.67 -0.01 0.00 0.12 0.00 0.00 56.93 56.33 3g1u s PHE 271 Cb -0.06 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.77 3g1u s PHE 271 CO -0.02 -0.19 -0.03 0.08 -0.10 0.00 0.00 175.22 174.97 3g1u s VAL 272 N -0.11 0.58 -0.19 -0.44 1.01 0.05 -1.81 120.40 119.49 3g1u s VAL 272 Ca -0.04 -0.02 -0.10 0.00 0.00 0.00 0.00 61.98 61.82 3g1u s VAL 272 Cb -0.14 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.50 3g1u s VAL 272 CO 0.04 0.29 0.15 0.42 0.00 0.00 0.00 175.10 176.00 3g1u s THR 273 N 1.82 5.40 -0.04 3.92 -4.23 -0.78 -0.86 115.64 120.87 3g1u s THR 273 Ca 0.04 0.23 0.09 0.00 -1.18 0.00 0.00 61.69 60.87 3g1u s THR 273 Cb -0.12 -3.48 0.16 0.00 1.34 0.00 0.00 72.50 70.39 3g1u s THR 273 CO -0.06 0.44 1.08 0.35 -0.54 0.00 0.00 174.62 175.89 3g1u n THR 274 N 3.48 0.58 0.10 3.99 -2.24 0.01 -0.99 114.28 119.22 3g1u n THR 274 Ca -0.16 -0.89 0.04 0.00 -2.27 0.00 0.00 64.05 60.77 3g1u n THR 274 Cb 0.52 0.36 -0.00 0.00 -2.10 0.00 0.00 70.33 69.11 3g1u n THR 274 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3g1u h THR 275 N 4.99 0.51 -0.40 4.28 1.35 -1.92 -3.43 112.91 118.29 3g1u h THR 275 Ca -0.04 -1.82 -0.17 0.00 -0.55 0.00 0.00 66.41 63.84 3g1u h THR 275 Cb 1.36 2.09 -0.07 0.00 -1.73 0.00 0.00 68.15 69.81 3g1u h THR 275 CO 0.02 0.29 -0.16 0.61 -0.25 0.00 0.00 175.52 176.03 3g1u n GLY 276 N 1.26 0.90 3.33 5.82 0.00 -1.26 -5.00 105.19 110.25 3g1u n GLY 276 Ca -0.02 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 3g1u n GLY 276 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g1u s ASN 277 N -2.43 2.47 0.41 1.61 2.47 -1.26 -4.99 114.94 113.23 3g1u s ASN 277 Ca 0.00 -1.02 -0.04 0.00 0.42 0.00 0.00 52.86 52.22 3g1u s ASN 277 Cb 0.00 -0.12 -0.04 0.00 -1.45 0.00 0.00 41.25 39.64 3g1u s ASN 277 CO 0.00 -0.20 0.68 -1.81 -3.72 0.00 0.00 177.10 172.05 3g1u s ASP 278 N -3.30 6.31 -1.06 -4.21 1.01 -1.26 -4.09 116.67 110.06 3g1u s ASP 278 Ca 0.22 0.75 -0.03 0.00 0.71 0.00 0.00 52.55 54.20 3g1u s ASP 278 Cb -0.00 -2.17 -0.03 0.00 1.01 0.00 0.00 42.92 41.73 3g1u s ASP 278 CO 0.06 -0.43 0.91 0.47 0.21 0.00 0.00 175.17 176.39 3g1u n ASP 279 N -1.89 -4.11 -0.09 0.27 8.00 -0.61 -4.88 116.55 113.24 3g1u n ASP 279 Ca -0.01 -0.63 -0.22 0.00 0.71 0.00 0.00 54.79 54.64 3g1u n ASP 279 Cb 0.55 -4.91 -0.12 0.00 -0.02 0.00 0.00 41.12 36.63 3g1u n ASP 279 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3g1u n ILE 280 N -3.56 1.58 -3.88 0.53 2.08 0.53 -4.79 119.36 111.85 3g1u n ILE 280 Ca -0.17 -0.47 -0.36 0.00 0.56 0.00 0.00 62.75 62.31 3g1u n ILE 280 Cb 0.64 -1.69 -0.13 0.00 -0.75 0.00 0.00 39.64 37.70 3g1u n ILE 280 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3g1u s ILE 281 N -2.51 3.19 0.49 1.39 -1.09 -0.69 -5.04 121.20 116.95 3g1u s ILE 281 Ca -0.32 -1.20 0.01 0.00 -2.23 0.00 0.00 60.65 56.91 3g1u s ILE 281 Cb 0.09 -2.77 -0.01 0.00 -1.58 0.00 0.00 42.46 38.20 3g1u s ILE 281 CO 0.62 -0.04 0.05 0.35 -1.23 0.00 0.00 174.94 174.69 3g1u n THR 282 N 4.69 0.00 0.27 2.92 -2.24 -1.26 -0.66 114.28 118.00 3g1u n THR 282 Ca -0.14 -2.45 0.18 0.00 -2.27 0.00 0.00 64.05 59.36 3g1u n THR 282 Cb 0.45 0.62 0.94 0.00 -2.10 0.00 0.00 70.33 70.24 3g1u n THR 282 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3g1u h SER 283 N 1.39 0.00 0.84 3.42 4.64 -1.98 -0.56 113.55 121.30 3g1u h SER 283 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3g1u h SER 283 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3g1u h SER 283 CO 0.65 0.00 -0.15 0.47 -0.87 0.00 0.00 176.83 176.93 3g1u n ASP 284 N -2.75 0.15 -0.08 4.97 8.00 -1.26 -4.31 116.55 121.27 3g1u n ASP 284 Ca -0.02 0.27 -0.16 0.00 0.71 0.00 0.00 54.79 55.58 3g1u n ASP 284 Cb 0.10 -0.27 -0.07 0.00 -0.02 0.00 0.00 41.12 40.87 3g1u n ASP 284 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3g1u n HIS 285 N -1.50 0.00 -0.23 1.24 8.25 -0.25 -4.76 115.22 117.97 3g1u n HIS 285 Ca 0.07 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.57 3g1u n HIS 285 Cb 0.34 -0.62 0.16 0.00 1.12 0.00 0.00 29.99 30.99 3g1u n HIS 285 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3g1u h PHE 286 N -0.45 0.27 0.00 4.41 0.04 -1.65 -0.74 116.94 118.82 3g1u h PHE 286 Ca -0.42 0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.39 3g1u h PHE 286 Cb 1.43 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.57 3g1u h PHE 286 CO -0.04 -0.06 -0.01 -1.35 -0.60 0.00 0.00 178.31 176.26 3g1u h PRO 287 N 0.28 0.00 -0.02 1.51 0.11 -1.86 -2.44 132.00 129.59 3g1u h PRO 287 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 3g1u h PRO 287 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3g1u h PRO 287 CO -0.47 0.01 -0.19 0.72 -0.21 0.00 0.00 178.00 177.86 3g1u n HIS 288 N -3.47 0.00 -2.49 0.65 8.25 -0.29 -4.99 115.22 112.89 3g1u n HIS 288 Ca -0.03 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.04 3g1u n HIS 288 Cb 0.10 -0.04 -0.04 0.00 1.12 0.00 0.00 29.99 31.13 3g1u n HIS 288 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3g1u s MET 289 N -2.27 4.45 0.90 -0.41 -1.94 -0.92 -4.01 119.30 115.10 3g1u s MET 289 Ca 0.27 1.71 -0.11 0.00 -1.71 0.00 0.00 55.69 55.85 3g1u s MET 289 Cb 0.20 -2.94 0.13 0.00 2.01 0.00 0.00 34.83 34.23 3g1u s MET 289 CO 0.44 0.06 1.12 -0.98 -0.01 0.00 0.00 175.02 175.65 3g1u s ARG 290 N -1.84 1.17 0.17 2.03 1.70 -1.26 -4.90 118.95 116.02 3g1u s ARG 290 Ca 0.50 1.32 -0.32 0.00 -0.47 0.00 0.00 55.73 56.76 3g1u s ARG 290 Cb -0.29 -1.76 -0.10 0.00 -0.57 0.00 0.00 34.95 32.23 3g1u s ARG 290 CO 0.36 -2.45 1.62 0.34 -1.08 0.00 0.00 175.30 174.09 3g1u s ASP 291 N -2.91 6.53 -1.56 -2.89 2.15 -1.26 -2.07 116.67 114.66 3g1u s ASP 291 Ca 0.65 2.67 0.00 0.00 0.43 0.00 0.00 52.55 56.30 3g1u s ASP 291 Cb -0.21 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.82 3g1u s ASP 291 CO 0.58 -0.87 0.00 0.47 -0.17 0.00 0.00 175.17 175.18 3g1u n ASP 292 N 4.17 -4.97 -4.64 -0.34 8.00 0.17 -4.87 116.55 114.07 3g1u n ASP 292 Ca 0.15 0.15 -0.44 0.00 0.71 0.00 0.00 54.79 55.36 3g1u n ASP 292 Cb 0.38 -4.02 -0.01 0.00 -0.02 0.00 0.00 41.12 37.44 3g1u n ASP 292 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1u n ALA 293 N -0.63 0.52 -2.71 2.24 0.00 -0.88 -4.59 120.51 114.46 3g1u n ALA 293 Ca -0.19 0.38 -0.36 0.00 0.00 0.00 0.00 53.44 53.28 3g1u n ALA 293 Cb 0.61 -2.14 -0.08 0.00 0.00 0.00 0.00 19.45 17.84 3g1u n ALA 293 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3g1u s ILE 294 N -1.03 5.38 -0.12 0.00 1.01 0.08 -0.98 121.20 125.54 3g1u s ILE 294 Ca 0.58 0.26 0.02 0.00 0.00 0.00 0.00 60.65 61.50 3g1u s ILE 294 Cb -0.64 -3.51 0.01 0.00 0.01 0.00 0.00 42.46 38.33 3g1u s ILE 294 CO 0.61 0.41 -0.19 -0.69 0.00 0.00 0.00 174.94 175.08 3g1u s VAL 295 N 0.55 1.77 0.14 2.92 1.01 0.78 -0.27 120.40 127.29 3g1u s VAL 295 Ca 0.09 -0.80 -0.15 0.00 0.00 0.00 0.00 61.98 61.12 3g1u s VAL 295 Cb -0.12 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.71 3g1u s VAL 295 CO 0.00 0.49 0.40 0.00 0.00 0.00 0.00 175.10 176.00 3g1u s ASN 297 N -2.83 1.85 0.00 0.00 2.47 -1.26 -1.86 114.94 113.31 3g1u s ASN 297 Ca 0.05 -0.50 0.00 0.00 0.42 0.00 0.00 52.86 52.83 3g1u s ASN 297 Cb 0.02 -0.12 0.00 0.00 -1.45 0.00 0.00 41.25 39.70 3g1u s ASN 297 CO -0.10 0.04 0.20 0.00 -3.72 0.00 0.00 177.10 173.53 3g1u n ILE 298 N 1.77 0.00 -1.32 -5.21 3.06 -0.16 -0.20 119.36 117.30 3g1u n ILE 298 Ca -0.18 -0.34 -0.32 0.00 -2.50 0.00 0.00 62.75 59.41 3g1u n ILE 298 Cb 0.54 1.20 0.09 0.00 0.54 0.00 0.00 39.64 42.01 3g1u n ILE 298 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3g1u s GLY 299 N -0.26 1.90 0.25 4.50 0.00 -1.10 -4.84 107.32 107.76 3g1u s GLY 299 Ca 0.00 0.48 -0.04 0.00 0.00 0.00 0.00 44.72 45.16 3g1u s GLY 299 CO 0.00 0.85 1.83 0.84 0.00 0.00 0.00 173.10 176.61 3g1u h HIS 300 N -0.83 0.93 -3.46 1.90 2.76 -1.94 -3.39 115.15 111.12 3g1u h HIS 300 Ca -0.45 0.03 -0.67 0.00 -2.20 0.00 0.00 60.37 57.08 3g1u h HIS 300 Cb 1.25 -0.29 -0.19 0.00 1.55 0.00 0.00 27.41 29.73 3g1u h HIS 300 CO 0.54 0.41 -0.67 -0.06 -1.30 0.00 0.00 177.93 176.85 3g1u s PHE 301 N -6.03 3.01 -0.34 5.26 0.08 -1.26 -4.74 117.98 113.96 3g1u s PHE 301 Ca -0.12 -0.07 0.20 0.00 0.12 0.00 0.00 56.93 57.06 3g1u s PHE 301 Cb 0.19 -1.82 1.02 0.00 -0.57 0.00 0.00 43.02 41.84 3g1u s PHE 301 CO 0.79 0.22 1.60 -0.40 -0.10 0.00 0.00 175.22 177.33 3g1u n ASP 302 N 2.69 0.52 0.00 1.36 5.68 -1.26 -3.46 116.55 122.08 3g1u n ASP 302 Ca -0.18 0.72 0.10 0.00 -0.50 0.00 0.00 54.79 54.93 3g1u n ASP 302 Cb 0.53 -0.79 0.60 0.00 -1.14 0.00 0.00 41.12 40.32 3g1u n ASP 302 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3g1u n THR 303 N -2.17 0.01 0.18 2.12 -2.24 -1.26 -2.34 114.28 108.58 3g1u n THR 303 Ca -0.01 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 3g1u n THR 303 Cb 0.07 -0.68 0.73 0.00 -2.10 0.00 0.00 70.33 68.34 3g1u n THR 303 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3g1u h GLU 304 N 0.00 0.00 -5.93 -0.78 5.08 -1.70 -1.62 114.58 109.63 3g1u h GLU 304 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 3g1u h GLU 304 Cb 0.00 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 28.97 3g1u h GLU 304 CO 0.00 0.00 -0.82 0.42 -1.00 0.00 0.00 179.01 177.61 3g1u s ILE 305 N -4.91 2.58 -1.43 3.13 1.01 -0.99 -0.35 121.20 120.24 3g1u s ILE 305 Ca -0.05 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.59 3g1u s ILE 305 Cb 0.17 -2.00 0.05 0.00 0.01 0.00 0.00 42.46 40.70 3g1u s ILE 305 CO 0.65 0.57 2.16 0.00 0.00 0.00 0.00 174.94 178.32 3g1u n GLN 306 N 2.91 2.94 -0.06 2.79 6.02 0.16 -4.69 117.38 127.44 3g1u n GLN 306 Ca -0.18 -2.73 -0.10 0.00 -0.01 0.00 0.00 57.00 53.99 3g1u n GLN 306 Cb 0.52 -3.27 -0.03 0.00 1.02 0.00 0.00 30.24 28.48 3g1u n GLN 306 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3g1u h VAL 307 N 4.09 1.07 -0.57 5.09 2.07 -1.87 -1.78 116.25 124.35 3g1u h VAL 307 Ca 0.55 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 68.02 3g1u h VAL 307 Cb 0.66 0.73 -0.11 0.00 -1.52 0.00 0.00 31.29 31.04 3g1u h VAL 307 CO 1.84 0.07 -0.29 1.23 0.02 0.00 0.00 177.57 180.44 3g1u h GLY 308 N 0.33 0.00 0.99 2.17 0.00 -1.97 0.84 103.07 105.43 3g1u h GLY 308 Ca 0.09 0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.80 3g1u h GLY 308 CO -0.02 -0.22 0.32 -0.25 0.00 0.00 0.00 176.54 176.37 3g1u h TRP 309 N -0.14 0.69 -0.49 5.60 7.01 -1.88 -2.04 115.95 124.69 3g1u h TRP 309 Ca 0.24 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.23 3g1u h TRP 309 Cb 0.53 -0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.34 3g1u h TRP 309 CO -0.59 0.47 0.27 1.25 -2.79 0.00 0.00 178.44 177.05 3g1u h LEU 310 N 0.70 0.61 -0.43 0.65 5.85 -0.26 -0.97 115.31 121.47 3g1u h LEU 310 Ca 0.19 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 3g1u h LEU 310 Cb -0.01 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3g1u h LEU 310 CO -0.04 0.52 -0.13 -0.33 -0.34 0.00 0.00 178.44 178.13 3g1u h GLU 311 N 0.65 0.84 0.00 1.25 5.08 -0.75 -1.77 114.58 119.88 3g1u h GLU 311 Ca 0.17 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 3g1u h GLU 311 Cb 0.05 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3g1u h GLU 311 CO -0.03 0.97 -0.10 0.00 -1.00 0.00 0.00 179.01 178.85 3g1u h ALA 312 N 0.85 1.08 -0.00 3.43 0.00 -1.15 -3.29 119.26 120.18 3g1u h ALA 312 Ca 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 312 Cb 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3g1u h ALA 312 CO 0.05 0.12 -0.30 0.09 0.00 0.00 0.00 179.25 179.22 3g1u n ASN 313 N -3.33 0.79 -4.77 0.00 3.02 -0.39 -5.00 115.26 105.58 3g1u n ASN 313 Ca -0.01 -0.89 -0.37 0.00 -0.03 0.00 0.00 54.58 53.28 3g1u n ASN 313 Cb 0.30 0.73 -0.01 0.00 -0.61 0.00 0.00 39.78 40.19 3g1u n ASN 313 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g1u s ALA 314 N -1.54 2.97 0.00 5.41 0.00 -0.69 -4.67 121.76 123.23 3g1u s ALA 314 Ca 0.05 0.93 0.14 0.00 0.00 0.00 0.00 51.96 53.09 3g1u s ALA 314 Cb 0.07 -3.38 0.20 0.00 0.00 0.00 0.00 23.12 20.01 3g1u s ALA 314 CO 0.29 -0.65 1.50 0.87 0.00 0.00 0.00 175.76 177.77 3g1u h LYS 315 N 2.03 0.00 -3.06 0.00 1.57 -0.36 -3.47 116.57 113.28 3g1u h LYS 315 Ca -0.49 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.15 3g1u h LYS 315 Cb 1.25 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.33 3g1u h LYS 315 CO 0.60 0.56 -0.34 -2.00 -0.57 0.00 0.00 179.45 177.71 3g1u s GLU 316 N -3.12 0.51 -0.06 3.15 2.12 -0.98 -4.99 118.70 115.33 3g1u s GLU 316 Ca 0.02 0.07 0.02 0.00 0.36 0.00 0.00 54.97 55.45 3g1u s GLU 316 Cb 0.09 0.23 0.01 0.00 0.26 0.00 0.00 34.13 34.72 3g1u s GLU 316 CO 0.74 -0.11 -0.11 -1.58 -0.54 0.00 0.00 175.26 173.66 3g1u s HIS 317 N -0.64 1.31 -0.07 5.30 5.65 -1.26 -0.72 115.29 124.85 3g1u s HIS 317 Ca -0.07 -0.45 0.03 0.00 0.25 0.00 0.00 55.06 54.82 3g1u s HIS 317 Cb -0.04 -0.97 0.01 0.00 -1.18 0.00 0.00 32.58 30.40 3g1u s HIS 317 CO 0.02 -0.23 -0.15 0.08 -0.65 0.00 0.00 174.74 173.81 3g1u s VAL 318 N 0.60 1.33 -0.31 0.89 1.01 -0.04 -5.02 120.40 118.86 3g1u s VAL 318 Ca -0.12 -0.60 -0.25 0.00 0.00 0.00 0.00 61.98 61.01 3g1u s VAL 318 Cb -0.14 -1.18 0.01 0.00 0.00 0.00 0.00 36.38 35.06 3g1u s VAL 318 CO 0.03 0.40 0.87 -0.70 0.00 0.00 0.00 175.10 175.69 3g1u s GLU 319 N 0.52 3.98 0.05 2.72 2.12 -1.26 -0.36 118.70 126.48 3g1u s GLU 319 Ca -0.14 0.71 -0.19 0.00 0.36 0.00 0.00 54.97 55.71 3g1u s GLU 319 Cb -0.16 -3.73 -0.13 0.00 0.26 0.00 0.00 34.13 30.38 3g1u s GLU 319 CO 0.04 -0.75 1.38 0.82 -0.54 0.00 0.00 175.26 176.22 3g1u h ILE 320 N 5.64 1.33 -1.56 -3.70 1.08 -1.50 -3.48 117.51 115.31 3g1u h ILE 320 Ca -0.23 -1.26 0.26 0.00 -0.39 0.00 0.00 64.86 63.23 3g1u h ILE 320 Cb 1.09 1.75 -0.17 0.00 -3.07 0.00 0.00 36.82 36.42 3g1u h ILE 320 CO 0.93 0.38 0.78 -1.59 -0.69 0.00 0.00 178.15 177.96 3g1u s LYS 321 N -4.42 0.39 0.25 2.37 -2.85 -1.21 -5.06 119.74 109.20 3g1u s LYS 321 Ca -0.14 -0.17 -0.30 0.00 -1.00 0.00 0.00 55.97 54.36 3g1u s LYS 321 Cb 0.06 0.17 -0.14 0.00 -2.06 0.00 0.00 37.83 35.86 3g1u s LYS 321 CO 0.76 -0.17 1.19 -2.30 0.10 0.00 0.00 175.35 174.93 3g1u n PRO 322 N -0.20 1.57 -1.20 1.78 -0.02 -1.26 -1.33 135.00 134.34 3g1u n PRO 322 Ca -0.02 0.56 -0.07 0.00 -2.02 0.00 0.00 63.50 61.94 3g1u n PRO 322 Cb 0.60 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 3g1u n PRO 322 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3g1u n GLN 323 N 1.33 -0.83 -3.64 -0.52 3.00 -1.26 -4.96 117.38 110.49 3g1u n GLN 323 Ca 0.11 0.66 -0.29 0.00 -0.01 0.00 0.00 57.00 57.47 3g1u n GLN 323 Cb 0.30 -4.54 -0.15 0.00 0.00 0.00 0.00 30.24 25.85 3g1u n GLN 323 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3g1u s VAL 324 N -2.08 0.33 -0.10 5.09 1.01 -0.44 -0.38 120.40 123.82 3g1u s VAL 324 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.14 3g1u s VAL 324 Cb 0.00 -1.17 -0.00 0.00 0.00 0.00 0.00 36.38 35.21 3g1u s VAL 324 CO 0.00 -0.59 -0.23 -1.81 0.00 0.00 0.00 175.10 172.47 3g1u s ASP 325 N 1.91 3.18 -0.19 3.32 1.01 -0.65 -1.14 116.67 124.11 3g1u s ASP 325 Ca 0.07 -0.54 -0.04 0.00 0.71 0.00 0.00 52.55 52.75 3g1u s ASP 325 Cb -0.17 -1.43 -0.02 0.00 1.01 0.00 0.00 42.92 42.31 3g1u s ASP 325 CO -0.26 0.16 -0.02 -0.60 0.21 0.00 0.00 175.17 174.66 3g1u s ARG 326 N 0.35 3.58 -0.12 8.23 3.52 0.52 -0.09 118.95 134.94 3g1u s ARG 326 Ca -0.18 -0.54 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 3g1u s ARG 326 Cb -0.18 -3.02 -0.01 0.00 -1.56 0.00 0.00 34.95 30.18 3g1u s ARG 326 CO 0.09 0.03 -0.16 0.71 -0.81 0.00 0.00 175.30 175.15 3g1u s TYR 327 N 0.93 2.73 -0.20 5.12 2.02 0.12 -0.86 117.35 127.21 3g1u s TYR 327 Ca 0.01 -0.74 -0.15 0.00 -0.37 0.00 0.00 57.07 55.82 3g1u s TYR 327 Cb -0.14 -1.79 -0.04 0.00 -0.40 0.00 0.00 41.96 39.58 3g1u s TYR 327 CO 0.01 -0.25 0.35 0.99 -1.57 0.00 0.00 175.55 175.08 3g1u s THR 328 N 0.29 5.24 0.63 -0.71 2.01 0.10 -0.75 115.64 122.45 3g1u s THR 328 Ca -0.12 0.60 0.01 0.00 0.31 0.00 0.00 61.69 62.49 3g1u s THR 328 Cb -0.16 -3.68 0.08 0.00 0.01 0.00 0.00 72.50 68.75 3g1u s THR 328 CO 0.06 0.28 0.87 -0.04 -0.69 0.00 0.00 174.62 175.10 3g1u s MET 329 N 1.20 2.14 0.34 4.92 1.00 -0.58 0.34 119.30 128.66 3g1u s MET 329 Ca 0.17 -1.00 0.02 0.00 0.00 0.00 0.00 55.69 54.88 3g1u s MET 329 Cb -0.14 -2.43 0.60 0.00 0.00 0.00 0.00 34.83 32.86 3g1u s MET 329 CO 0.07 -1.05 1.98 0.93 0.00 0.00 0.00 175.02 176.96 3g1u h GLU 330 N -0.18 0.83 0.00 2.03 4.39 -1.89 -1.87 114.58 117.89 3g1u h GLU 330 Ca -0.39 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.25 3g1u h GLU 330 Cb 1.28 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 3g1u h GLU 330 CO 0.46 0.58 0.00 0.27 -1.16 0.00 0.00 179.01 179.16 3g1u n ASN 331 N -4.41 0.00 0.00 1.42 0.23 -1.26 -4.88 115.26 106.35 3g1u n ASN 331 Ca 0.06 0.05 0.00 0.00 -0.53 0.00 0.00 54.58 54.16 3g1u n ASN 331 Cb 0.07 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.49 3g1u n ASN 331 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g1u n GLY 332 N 0.01 2.46 3.91 4.83 0.00 -0.70 -5.06 105.19 110.63 3g1u n GLY 332 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 3g1u n GLY 332 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g1u s ARG 333 N -0.74 3.14 0.18 1.61 0.52 -1.26 -4.75 118.95 117.64 3g1u s ARG 333 Ca 0.00 0.12 0.07 0.00 -0.52 0.00 0.00 55.73 55.40 3g1u s ARG 333 Cb 0.00 -2.28 -0.04 0.00 0.52 0.00 0.00 34.95 33.15 3g1u s ARG 333 CO 0.00 -0.56 0.03 -1.01 0.02 0.00 0.00 175.30 173.78 3g1u s HIS 334 N -2.94 2.91 -0.05 -0.53 3.76 -1.26 -1.52 115.29 115.65 3g1u s HIS 334 Ca 0.52 -0.11 0.02 0.00 -0.15 0.00 0.00 55.06 55.34 3g1u s HIS 334 Cb -0.10 -1.40 0.01 0.00 1.11 0.00 0.00 32.58 32.20 3g1u s HIS 334 CO 0.46 0.52 -0.10 0.42 -0.85 0.00 0.00 174.74 175.19 3g1u s ILE 335 N -1.76 0.91 -0.29 0.60 1.01 0.07 -0.66 121.20 121.09 3g1u s ILE 335 Ca 0.28 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.46 3g1u s ILE 335 Cb -0.09 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.50 3g1u s ILE 335 CO 0.20 0.30 0.17 -0.63 0.00 0.00 0.00 174.94 174.97 3g1u s ILE 336 N 0.60 4.94 -0.13 2.92 1.01 -0.15 0.15 121.20 130.55 3g1u s ILE 336 Ca -0.11 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 3g1u s ILE 336 Cb -0.14 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3g1u s ILE 336 CO 0.02 0.18 0.05 -0.22 0.00 0.00 0.00 174.94 174.96 3g1u s LEU 337 N 1.69 3.81 -0.12 2.97 2.96 0.87 -0.16 118.68 130.70 3g1u s LEU 337 Ca 0.06 0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 54.12 3g1u s LEU 337 Cb -0.16 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 3g1u s LEU 337 CO 0.08 0.31 0.01 -0.76 -1.32 0.00 0.00 176.35 174.67 3g1u s LEU 338 N -0.47 3.56 -0.69 -0.68 1.43 -0.53 -1.63 118.68 119.66 3g1u s LEU 338 Ca 0.09 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 3g1u s LEU 338 Cb -0.12 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3g1u s LEU 338 CO 0.02 0.28 0.00 0.00 0.23 0.00 0.00 176.35 176.88 3g1u n ALA 339 N 2.78 -0.84 -3.36 4.21 0.00 0.49 -0.88 120.51 122.90 3g1u n ALA 339 Ca -0.18 0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.09 3g1u n ALA 339 Cb 0.53 -1.15 0.01 0.00 0.00 0.00 0.00 19.45 18.84 3g1u n ALA 339 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3g1u n LYS 340 N -2.68 -4.09 -0.61 0.00 4.76 -1.26 -1.56 118.16 112.72 3g1u n LYS 340 Ca -0.10 0.60 0.00 0.00 -2.87 0.00 0.00 58.31 55.95 3g1u n LYS 340 Cb 0.57 -5.38 0.00 0.00 -1.84 0.00 0.00 35.03 28.38 3g1u n LYS 340 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3g1u n GLY 341 N -1.34 1.29 3.84 0.72 0.00 -0.05 -4.95 105.19 104.70 3g1u n GLY 341 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 3g1u n GLY 341 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g1u s ARG 342 N -0.18 3.88 -0.42 1.61 3.00 -0.60 -4.12 118.95 122.12 3g1u s ARG 342 Ca 0.00 0.94 -0.41 0.00 0.00 0.00 0.00 55.73 56.26 3g1u s ARG 342 Cb 0.00 -2.12 -0.16 0.00 0.00 0.00 0.00 34.95 32.66 3g1u s ARG 342 CO 0.00 -0.33 2.06 1.47 0.00 0.00 0.00 175.30 178.50 3g1u n LEU 343 N -1.73 1.44 0.13 2.53 -0.00 -1.25 -4.54 117.00 113.59 3g1u n LEU 343 Ca 0.07 0.69 0.00 0.00 -0.00 0.00 0.00 56.01 56.77 3g1u n LEU 343 Cb 0.54 -1.05 0.29 0.00 -0.00 0.00 0.00 43.42 43.20 3g1u n LEU 343 CO 0.48 -0.72 0.70 1.62 -0.00 0.00 0.00 177.39 179.47 3g1u h VAL 344 N 6.62 1.28 -0.52 1.47 3.04 -0.91 0.95 116.25 128.19 3g1u h VAL 344 Ca -0.23 -1.34 -0.08 0.00 -1.01 0.00 0.00 66.70 64.04 3g1u h VAL 344 Cb 1.37 1.62 -0.02 0.00 -2.01 0.00 0.00 31.29 32.25 3g1u h VAL 344 CO 1.04 0.40 0.02 -0.55 -1.01 0.00 0.00 177.57 177.47 3g1u h ASN 345 N 0.14 0.83 0.60 3.17 -1.07 -1.83 -0.73 115.58 116.68 3g1u h ASN 345 Ca 0.02 -0.20 -0.21 0.00 0.07 0.00 0.00 56.30 55.97 3g1u h ASN 345 Cb 0.70 -0.22 -0.04 0.00 -2.07 0.00 0.00 38.32 36.70 3g1u h ASN 345 CO 0.05 0.88 -1.55 0.18 0.07 0.00 0.00 177.43 177.06 3g1u n LEU 346 N -4.21 0.83 0.06 6.14 4.77 -1.08 -0.45 117.00 123.05 3g1u n LEU 346 Ca 0.03 0.37 -0.16 0.00 -0.03 0.00 0.00 56.01 56.22 3g1u n LEU 346 Cb 0.30 0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 3g1u n LEU 346 CO 0.42 0.24 0.14 1.23 -1.33 0.00 0.00 177.39 178.08 3g1u h GLY 347 N 3.66 0.61 0.00 -0.72 0.00 -0.71 -3.38 103.07 102.53 3g1u h GLY 347 Ca -0.22 -1.06 0.00 0.00 0.00 0.00 0.00 47.33 46.05 3g1u h GLY 347 CO 0.06 0.94 -0.80 0.00 0.00 0.00 0.00 176.54 176.73 3g1u n ALA 349 N -1.44 0.00 -0.07 0.00 0.00 -1.07 -4.53 120.51 113.41 3g1u n ALA 349 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 3g1u n ALA 349 Cb 0.13 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.75 3g1u n ALA 349 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3g1u n SER 350 N 0.00 2.99 -0.06 0.00 7.64 -1.13 -4.56 113.62 118.51 3g1u n SER 350 Ca 0.00 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.96 3g1u n SER 350 Cb 0.00 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 3g1u n SER 350 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g1u n GLY 351 N 0.79 -0.12 3.76 0.23 0.00 0.41 -4.85 105.19 105.41 3g1u n GLY 351 Ca 0.14 -1.03 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 3g1u n GLY 351 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g1u s HIS 352 N 0.00 2.59 0.78 1.61 3.76 -1.26 -4.77 115.29 118.00 3g1u s HIS 352 Ca 0.00 1.44 -0.12 0.00 -0.15 0.00 0.00 55.06 56.23 3g1u s HIS 352 Cb 0.00 -3.62 0.07 0.00 1.11 0.00 0.00 32.58 30.14 3g1u s HIS 352 CO 0.00 -2.24 1.12 -2.14 -0.85 0.00 0.00 174.74 170.63 3g1u s PRO 353 N -2.72 2.01 0.26 8.40 0.02 -1.26 -4.84 135.00 136.87 3g1u s PRO 353 Ca 0.66 1.38 -0.07 0.00 0.02 0.00 0.00 61.00 62.99 3g1u s PRO 353 Cb -0.35 -1.85 0.47 0.00 0.02 0.00 0.00 34.50 32.78 3g1u s PRO 353 CO 0.43 -1.86 1.60 0.77 -0.33 0.00 0.00 177.00 177.62 3g1u h SER 354 N -1.03 -0.55 -0.22 2.53 0.02 -1.93 -2.83 113.55 109.54 3g1u h SER 354 Ca -0.44 0.23 0.03 0.00 -0.84 0.00 0.00 61.79 60.77 3g1u h SER 354 Cb 1.25 0.44 -0.03 0.00 0.14 0.00 0.00 62.40 64.21 3g1u h SER 354 CO 0.49 -0.25 0.06 0.15 -1.14 0.00 0.00 176.83 176.14 3g1u h PHE 355 N 0.04 0.11 -0.33 3.45 3.57 -1.91 0.15 116.94 122.02 3g1u h PHE 355 Ca 0.44 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.88 3g1u h PHE 355 Cb 0.77 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 3g1u h PHE 355 CO -0.53 0.04 -0.09 -0.24 -2.23 0.00 0.00 178.31 175.26 3g1u h VAL 356 N 0.16 1.28 -0.40 1.41 3.04 -1.86 -2.91 116.25 116.97 3g1u h VAL 356 Ca 0.10 -1.16 0.12 0.00 -1.01 0.00 0.00 66.70 64.75 3g1u h VAL 356 Cb 0.08 1.36 -0.02 0.00 -2.01 0.00 0.00 31.29 30.71 3g1u h VAL 356 CO -0.12 0.37 0.29 0.24 -1.01 0.00 0.00 177.57 177.35 3g1u h MET 357 N 0.41 0.00 -0.90 4.17 2.86 -1.20 -1.09 114.93 119.18 3g1u h MET 357 Ca 0.08 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.78 3g1u h MET 357 Cb 0.60 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.19 3g1u h MET 357 CO 0.04 0.00 0.57 1.03 1.06 0.00 0.00 176.91 179.60 3g1u h SER 358 N 0.00 0.90 0.71 1.22 0.87 -0.51 -0.52 113.55 116.22 3g1u h SER 358 Ca 0.19 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 3g1u h SER 358 Cb 0.78 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.56 3g1u h SER 358 CO -0.00 0.57 -0.44 0.78 -0.53 0.00 0.00 176.83 177.21 3g1u h ASN 359 N 1.03 -1.11 -0.79 6.23 2.35 -1.27 -0.53 115.58 121.49 3g1u h ASN 359 Ca 0.39 0.06 0.04 0.00 -0.55 0.00 0.00 56.30 56.24 3g1u h ASN 359 Cb 0.17 0.32 -0.05 0.00 0.05 0.00 0.00 38.32 38.81 3g1u h ASN 359 CO -0.17 -0.68 0.52 -1.28 -1.65 0.00 0.00 177.43 174.17 3g1u h SER 360 N -1.08 0.82 0.75 5.81 0.87 -1.50 -2.91 113.55 116.32 3g1u h SER 360 Ca -0.09 -0.01 -0.25 0.00 -1.23 0.00 0.00 61.79 60.21 3g1u h SER 360 Cb 0.87 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.62 3g1u h SER 360 CO 0.09 0.56 -1.25 -0.26 -0.53 0.00 0.00 176.83 175.44 3g1u h PHE 361 N 0.95 0.17 -0.79 2.24 0.04 -0.96 -1.85 116.94 116.74 3g1u h PHE 361 Ca 0.32 -0.13 0.04 0.00 2.80 0.00 0.00 57.97 61.01 3g1u h PHE 361 Cb 0.08 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.18 3g1u h PHE 361 CO -0.00 1.12 0.50 1.15 -0.60 0.00 0.00 178.31 180.48 3g1u h THR 362 N 0.03 1.09 -0.63 -1.55 2.02 -1.00 -0.81 112.91 112.07 3g1u h THR 362 Ca -0.12 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 66.68 3g1u h THR 362 Cb 1.89 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 3g1u h THR 362 CO 0.14 0.17 0.18 0.78 0.37 0.00 0.00 175.52 177.17 3g1u h ASN 363 N 0.96 0.93 -0.27 4.18 2.35 -1.35 -1.65 115.58 120.72 3g1u h ASN 363 Ca 0.33 -0.22 0.07 0.00 -0.55 0.00 0.00 56.30 55.92 3g1u h ASN 363 Cb 0.06 -0.25 -0.07 0.00 0.05 0.00 0.00 38.32 38.11 3g1u h ASN 363 CO -0.13 0.91 -0.20 -0.61 -1.65 0.00 0.00 177.43 175.74 3g1u h GLN 364 N 0.91 -0.18 -0.43 0.81 5.75 -0.92 0.37 115.11 121.43 3g1u h GLN 364 Ca 0.20 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.73 3g1u h GLN 364 Cb 0.32 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 3g1u h GLN 364 CO -0.00 -0.12 0.27 0.28 -2.65 0.00 0.00 178.83 176.60 3g1u h VAL 365 N -0.19 1.07 -0.58 2.39 2.07 -0.96 -1.19 116.25 118.87 3g1u h VAL 365 Ca 0.15 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 3g1u h VAL 365 Cb 0.41 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3g1u h VAL 365 CO -0.38 0.10 0.15 -0.07 0.02 0.00 0.00 177.57 177.38 3g1u h LEU 366 N 0.54 0.83 -0.72 2.57 3.38 -0.90 -1.17 115.31 119.84 3g1u h LEU 366 Ca 0.17 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3g1u h LEU 366 Cb -0.02 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3g1u h LEU 366 CO -0.06 0.80 0.18 0.00 0.09 0.00 0.00 178.44 179.45 3g1u h ALA 367 N 1.31 0.94 -0.43 1.53 0.00 0.09 -0.36 119.26 122.34 3g1u h ALA 367 Ca 0.19 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3g1u h ALA 367 Cb 0.30 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3g1u h ALA 367 CO -0.00 0.66 0.13 1.96 0.00 0.00 0.00 179.25 182.00 3g1u h GLN 368 N 1.08 0.66 0.04 0.00 1.08 -0.85 -1.98 115.11 115.14 3g1u h GLN 368 Ca 0.23 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3g1u h GLN 368 Cb 0.36 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.69 3g1u h GLN 368 CO 0.00 0.65 -0.03 0.82 -0.95 0.00 0.00 178.83 179.33 3g1u h ILE 369 N 0.55 0.94 -0.87 2.54 2.04 -1.03 -0.90 117.51 120.78 3g1u h ILE 369 Ca 0.14 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.01 3g1u h ILE 369 Cb 0.27 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 3g1u h ILE 369 CO -0.00 0.00 0.58 -0.08 0.00 0.00 0.00 178.15 178.64 3g1u h GLU 370 N -0.07 1.14 -0.12 2.37 4.57 -1.01 0.23 114.58 121.69 3g1u h GLU 370 Ca -0.00 -0.07 -0.16 0.00 -1.18 0.00 0.00 59.36 57.95 3g1u h GLU 370 Cb 0.06 -0.26 0.01 0.00 -0.16 0.00 0.00 28.75 28.40 3g1u h GLU 370 CO -0.00 0.75 -0.55 -0.07 -1.18 0.00 0.00 179.01 177.96 3g1u h LEU 371 N 1.17 0.69 -0.20 1.64 3.38 -1.33 -3.14 115.31 117.53 3g1u h LEU 371 Ca 0.32 -0.64 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 3g1u h LEU 371 Cb -0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 3g1u h LEU 371 CO -0.07 1.21 0.02 -0.25 0.09 0.00 0.00 178.44 179.44 3g1u h TRP 372 N 0.21 0.35 0.00 1.13 2.91 -0.86 -2.61 115.95 117.08 3g1u h TRP 372 Ca -0.04 -0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.93 3g1u h TRP 372 Cb 1.19 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 29.74 3g1u h TRP 372 CO 0.11 0.49 0.00 -1.13 -1.03 0.00 0.00 178.44 176.88 3g1u n SER 373 N -4.73 0.00 -0.59 2.65 3.41 0.04 -2.67 113.62 111.72 3g1u n SER 373 Ca -0.04 -0.18 0.06 0.00 -0.26 0.00 0.00 58.87 58.45 3g1u n SER 373 Cb 0.20 -0.24 0.15 0.00 -0.26 0.00 0.00 64.21 64.06 3g1u n SER 373 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3g1u n ASN 374 N -1.24 1.65 0.25 4.04 3.02 -1.11 -4.87 115.26 117.00 3g1u n ASN 374 Ca 0.13 -3.30 0.10 0.00 -0.03 0.00 0.00 54.58 51.48 3g1u n ASN 374 Cb 0.18 -0.45 0.64 0.00 -0.61 0.00 0.00 39.78 39.54 3g1u n ASN 374 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 3g1u h ARG 375 N 0.68 0.00 -0.29 3.52 0.11 -1.24 -3.07 114.38 114.10 3g1u h ARG 375 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 3g1u h ARG 375 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 3g1u h ARG 375 CO 0.01 0.15 0.00 -0.25 0.10 0.00 0.00 179.97 179.99 3g1u n ASP 376 N -3.87 3.77 0.00 0.08 8.00 -1.26 -4.69 116.55 118.58 3g1u n ASP 376 Ca -0.02 -2.82 0.05 0.00 0.71 0.00 0.00 54.79 52.70 3g1u n ASP 376 Cb 0.25 -0.49 -0.12 0.00 -0.02 0.00 0.00 41.12 40.74 3g1u n ASP 376 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3g1u n ASN 377 N -0.28 0.36 -0.00 -2.24 5.03 -1.16 -4.95 115.26 112.02 3g1u n ASN 377 Ca 0.20 0.15 -0.00 0.00 0.87 0.00 0.00 54.58 55.80 3g1u n ASN 377 Cb 0.82 1.09 -0.00 0.00 -1.02 0.00 0.00 39.78 40.67 3g1u n ASN 377 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3g1u n GLY 378 N 1.37 0.29 0.22 7.41 0.00 -1.26 -4.90 105.19 108.31 3g1u n GLY 378 Ca -0.10 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 3g1u n GLY 378 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3g1u h LYS 379 N 0.58 0.64 -2.90 1.61 3.64 -1.93 -3.35 116.57 114.86 3g1u h LYS 379 Ca -0.00 -0.45 -0.61 0.00 -1.27 0.00 0.00 60.65 58.32 3g1u h LYS 379 Cb 0.42 0.07 -0.41 0.00 -0.41 0.00 0.00 32.23 31.90 3g1u h LYS 379 CO 0.00 1.07 -0.70 0.71 -2.27 0.00 0.00 179.45 178.25 3g1u s TYR 380 N -3.91 2.68 0.54 1.91 1.51 -1.26 -5.07 117.35 113.75 3g1u s TYR 380 Ca -0.08 -2.94 -0.21 0.00 -1.01 0.00 0.00 57.07 52.83 3g1u s TYR 380 Cb 0.10 -2.13 -0.05 0.00 -0.11 0.00 0.00 41.96 39.77 3g1u s TYR 380 CO 0.86 -0.66 1.21 -1.25 -1.11 0.00 0.00 175.55 174.60 3g1u s PRO 381 N -0.73 3.28 0.05 -1.71 0.04 -1.26 -4.69 135.00 129.98 3g1u s PRO 381 Ca 0.25 1.85 -0.03 0.00 0.04 0.00 0.00 61.00 63.11 3g1u s PRO 381 Cb -0.06 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 3g1u s PRO 381 CO -0.14 -0.96 0.26 1.03 0.04 0.00 0.00 177.00 177.22 3g1u s ARG 382 N -3.07 3.52 0.85 4.56 3.00 -1.26 -3.61 118.95 122.93 3g1u s ARG 382 Ca 0.72 -0.24 0.00 0.00 0.00 0.00 0.00 55.73 56.21 3g1u s ARG 382 Cb -0.31 -3.02 0.00 0.00 0.00 0.00 0.00 34.95 31.62 3g1u s ARG 382 CO 0.35 0.60 0.00 0.41 0.00 0.00 0.00 175.30 176.66 3g1u n GLY 383 N 0.60 1.02 0.06 -3.53 0.00 0.72 -4.40 105.19 99.66 3g1u n GLY 383 Ca -0.07 -0.89 0.04 0.00 0.00 0.00 0.00 46.02 45.10 3g1u n GLY 383 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g1u n ASP 384 N 1.33 0.25 -0.35 1.61 9.92 -1.26 -3.84 116.55 124.21 3g1u n ASP 384 Ca 0.00 0.11 0.13 0.00 -0.53 0.00 0.00 54.79 54.50 3g1u n ASP 384 Cb 0.00 1.26 0.43 0.00 -0.64 0.00 0.00 41.12 42.17 3g1u n ASP 384 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3g1u n LYS 385 N -2.53 1.18 -1.61 -1.24 5.02 -1.26 -4.95 118.16 112.76 3g1u n LYS 385 Ca -0.11 -0.70 -0.48 0.00 -2.02 0.00 0.00 58.31 55.00 3g1u n LYS 385 Cb 0.75 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.24 3g1u n LYS 385 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g1u n ALA 386 N -0.30 -0.11 -3.37 7.82 0.00 -1.24 -4.69 120.51 118.61 3g1u n ALA 386 Ca 0.15 0.45 -0.03 0.00 0.00 0.00 0.00 53.44 54.00 3g1u n ALA 386 Cb 0.35 -2.12 -0.01 0.00 0.00 0.00 0.00 19.45 17.68 3g1u n ALA 386 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1u n GLY 387 N 2.12 3.93 3.30 0.00 0.00 -1.26 -4.93 105.19 108.35 3g1u n GLY 387 Ca 0.14 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 3g1u n GLY 387 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1u s VAL 388 N -1.97 2.68 0.27 1.61 1.01 -1.26 -0.96 120.40 121.79 3g1u s VAL 388 Ca 0.04 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3g1u s VAL 388 Cb 0.00 -2.11 -0.06 0.00 0.00 0.00 0.00 36.38 34.22 3g1u s VAL 388 CO 0.03 0.53 -0.04 -0.36 0.00 0.00 0.00 175.10 175.25 3g1u s PHE 389 N 0.52 1.89 0.14 5.22 0.08 0.58 -4.94 117.98 121.48 3g1u s PHE 389 Ca -0.11 -0.74 0.05 0.00 0.12 0.00 0.00 56.93 56.25 3g1u s PHE 389 Cb -0.16 -1.09 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 3g1u s PHE 389 CO 0.04 0.22 0.09 -0.06 -0.10 0.00 0.00 175.22 175.41 3g1u s PHE 390 N -3.09 3.09 0.54 0.36 0.08 -1.26 -0.40 117.98 117.30 3g1u s PHE 390 Ca 0.30 -0.02 -0.22 0.00 0.12 0.00 0.00 56.93 57.11 3g1u s PHE 390 Cb 0.04 -1.51 -0.05 0.00 -0.57 0.00 0.00 43.02 40.93 3g1u s PHE 390 CO 0.12 0.52 1.31 1.28 -0.10 0.00 0.00 175.22 178.34 3g1u n LEU 391 N -0.07 5.19 -4.66 -0.37 4.77 -1.26 -4.92 117.00 115.67 3g1u n LEU 391 Ca -0.09 0.98 -0.45 0.00 -0.03 0.00 0.00 56.01 56.42 3g1u n LEU 391 Cb 0.54 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 3g1u n LEU 391 CO 0.42 -0.71 0.95 -2.65 -1.33 0.00 0.00 177.39 174.08 3g1u n PRO 392 N -0.89 1.91 0.31 3.23 -0.02 -1.26 -4.85 135.00 133.44 3g1u n PRO 392 Ca 0.10 0.68 0.20 0.00 -2.02 0.00 0.00 63.50 62.46 3g1u n PRO 392 Cb 0.44 -2.30 0.99 0.00 -0.02 0.00 0.00 33.50 32.62 3g1u n PRO 392 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3g1u h LYS 393 N 3.85 0.00 0.00 -0.52 -0.00 -2.04 -1.15 116.57 116.71 3g1u h LYS 393 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.20 3g1u h LYS 393 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.52 3g1u h LYS 393 CO 0.73 0.01 0.00 0.00 -0.00 0.00 0.00 179.45 180.19 3g1u h ALA 394 N 1.99 1.00 0.00 0.07 0.00 -2.02 -2.97 119.26 117.33 3g1u h ALA 394 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3g1u h ALA 394 Cb 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3g1u h ALA 394 CO 0.00 0.00 -0.24 -0.07 0.00 0.00 0.00 179.25 178.94 3g1u h LEU 395 N 0.00 0.00 -0.40 0.00 3.38 -1.56 -2.68 115.31 114.05 3g1u h LEU 395 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3g1u h LEU 395 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3g1u h LEU 395 CO 0.00 0.24 0.01 0.44 0.09 0.00 0.00 178.44 179.22 3g1u h ASP 396 N 0.00 0.68 -0.84 -0.43 3.45 -1.70 -0.40 116.42 117.18 3g1u h ASP 396 Ca -0.00 -0.30 -0.02 0.00 0.43 0.00 0.00 57.03 57.14 3g1u h ASP 396 Cb 0.90 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 39.44 3g1u h ASP 396 CO 0.03 0.81 0.45 -0.33 -1.57 0.00 0.00 179.24 178.64 3g1u h GLU 397 N 0.53 1.18 0.40 3.56 5.08 -1.70 -2.09 114.58 121.54 3g1u h GLU 397 Ca 0.12 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3g1u h GLU 397 Cb 0.45 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3g1u h GLU 397 CO 0.02 0.87 -0.19 -0.22 -1.00 0.00 0.00 179.01 178.49 3g1u h LYS 398 N 1.19 -0.51 0.18 2.33 3.64 -1.12 -2.05 116.57 120.23 3g1u h LYS 398 Ca 0.30 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 3g1u h LYS 398 Cb 0.04 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 3g1u h LYS 398 CO -0.05 -0.33 -0.19 0.28 -2.27 0.00 0.00 179.45 176.89 3g1u h VAL 399 N -0.54 0.58 -0.23 2.00 2.07 -1.03 -2.83 116.25 116.26 3g1u h VAL 399 Ca -0.05 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.52 3g1u h VAL 399 Cb 0.41 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 3g1u h VAL 399 CO 0.09 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.54 3g1u h ALA 400 N 0.36 0.03 -0.77 1.67 0.00 -1.39 -1.68 119.26 117.48 3g1u h ALA 400 Ca 0.00 0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.13 3g1u h ALA 400 Cb 0.39 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3g1u h ALA 400 CO -0.06 -0.56 0.51 0.00 0.00 0.00 0.00 179.25 179.14 3g1u h ALA 401 N 1.04 1.98 0.00 0.00 0.00 -1.27 -0.61 119.26 120.40 3g1u h ALA 401 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3g1u h ALA 401 Cb 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3g1u h ALA 401 CO -0.31 -0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.05 3g1u n LEU 402 N -4.50 0.53 -0.21 0.00 4.77 -0.63 -2.51 117.00 114.45 3g1u n LEU 402 Ca 0.14 0.68 0.07 0.00 -0.03 0.00 0.00 56.01 56.88 3g1u n LEU 402 Cb 0.46 -0.68 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 3g1u n LEU 402 CO 0.32 -0.71 0.15 1.41 -1.33 0.00 0.00 177.39 177.23 3g1u n HIS 403 N -2.14 0.00 -0.17 -1.77 8.25 -0.24 -4.28 115.22 114.87 3g1u n HIS 403 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 3g1u n HIS 403 Cb 0.12 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.23 3g1u n HIS 403 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3g1u h LEU 404 N 1.03 0.98 -0.73 2.41 3.38 -1.49 -3.17 115.31 117.72 3g1u h LEU 404 Ca 0.00 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.64 3g1u h LEU 404 Cb 0.43 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3g1u h LEU 404 CO 0.00 1.13 0.45 0.00 0.09 0.00 0.00 178.44 180.11 3g1u h ALA 405 N 0.89 0.96 -0.94 1.53 0.00 -1.80 -1.72 119.26 118.19 3g1u h ALA 405 Ca 0.12 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.15 3g1u h ALA 405 Cb 0.71 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 3g1u h ALA 405 CO 0.05 0.21 0.60 1.25 0.00 0.00 0.00 179.25 181.36 3g1u h HIS 406 N 0.86 0.98 -0.02 0.00 -0.00 -1.86 -1.80 115.15 113.30 3g1u h HIS 406 Ca 0.30 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.70 3g1u h HIS 406 Cb 0.07 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.17 3g1u h HIS 406 CO -0.05 0.38 -0.01 1.33 -0.00 0.00 0.00 177.93 179.58 3g1u n VAL 407 N -4.58 0.00 -1.25 5.26 0.24 -0.94 -4.93 118.33 112.12 3g1u n VAL 407 Ca 0.18 -0.39 -0.04 0.00 -2.04 0.00 0.00 64.34 62.04 3g1u n VAL 407 Cb 0.40 1.10 -0.02 0.00 -1.47 0.00 0.00 33.84 33.85 3g1u n VAL 407 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g1u n GLY 408 N 1.28 0.62 3.68 7.63 0.00 -0.68 -5.00 105.19 112.73 3g1u n GLY 408 Ca 0.16 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 3g1u n GLY 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u s ALA 409 N -2.16 3.51 -0.27 4.61 0.00 -0.71 -5.01 121.76 121.74 3g1u s ALA 409 Ca 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 51.96 52.34 3g1u s ALA 409 Cb 0.00 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.63 3g1u s ALA 409 CO 0.00 -0.80 0.03 0.15 0.00 0.00 0.00 175.76 175.14 3g1u s LYS 410 N 2.46 3.08 0.12 0.00 1.02 -1.26 -4.56 119.74 120.61 3g1u s LYS 410 Ca 0.51 -0.84 -0.28 0.00 0.02 0.00 0.00 55.97 55.37 3g1u s LYS 410 Cb -0.20 -3.23 -0.07 0.00 -0.52 0.00 0.00 37.83 33.81 3g1u s LYS 410 CO 0.17 -0.39 0.88 -1.17 -0.92 0.00 0.00 175.35 173.91 3g1u s LEU 411 N 1.46 4.52 0.34 3.17 2.96 -1.26 -5.05 118.68 124.82 3g1u s LEU 411 Ca 0.02 1.70 -0.26 0.00 -0.22 0.00 0.00 54.13 55.37 3g1u s LEU 411 Cb -0.17 -3.45 -0.10 0.00 0.50 0.00 0.00 46.19 42.98 3g1u s LEU 411 CO 0.00 0.03 0.98 -0.89 -1.32 0.00 0.00 176.35 175.16 3g1u s THR 412 N -0.37 4.02 -0.23 3.68 2.01 -1.26 -5.06 115.64 118.44 3g1u s THR 412 Ca 0.42 1.67 -0.09 0.00 0.31 0.00 0.00 61.69 64.00 3g1u s THR 412 Cb -0.23 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 3g1u s THR 412 CO 0.28 0.13 0.13 -0.54 -0.69 0.00 0.00 174.62 173.92 3g1u s LYS 413 N -2.11 4.00 0.46 4.92 -0.14 -1.26 -5.08 119.74 120.53 3g1u s LYS 413 Ca 0.52 -0.31 -0.25 0.00 -1.36 0.00 0.00 55.97 54.57 3g1u s LYS 413 Cb -0.21 -3.45 -0.08 0.00 -1.68 0.00 0.00 37.83 32.42 3g1u s LYS 413 CO 0.26 0.07 1.37 -0.51 -0.76 0.00 0.00 175.35 175.78 3g1u s LEU 414 N 1.00 4.09 0.60 3.17 1.43 -1.26 -5.01 118.68 122.69 3g1u s LEU 414 Ca 0.06 2.79 -0.13 0.00 -1.03 0.00 0.00 54.13 55.83 3g1u s LEU 414 Cb -0.14 -4.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.04 3g1u s LEU 414 CO 0.04 -1.15 1.02 0.42 0.23 0.00 0.00 176.35 176.91 3g1u s THR 415 N -1.25 4.54 0.25 5.49 -4.23 -1.26 -4.85 115.64 114.33 3g1u s THR 415 Ca 0.62 0.95 -0.08 0.00 -1.18 0.00 0.00 61.69 62.01 3g1u s THR 415 Cb -0.41 -3.75 0.32 0.00 1.34 0.00 0.00 72.50 69.99 3g1u s THR 415 CO 0.52 -0.95 1.61 -0.65 -0.54 0.00 0.00 174.62 174.61 3g1u h PRO 416 N 0.04 0.05 -0.66 3.99 0.11 -2.00 -0.69 132.00 132.83 3g1u h PRO 416 Ca -0.45 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.71 3g1u h PRO 416 Cb 1.19 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 3g1u h PRO 416 CO 0.61 0.03 0.38 -0.22 -0.21 0.00 0.00 178.00 178.59 3g1u h LYS 417 N 0.05 0.70 -0.38 1.05 3.64 -1.98 -2.95 116.57 116.71 3g1u h LYS 417 Ca 0.42 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.65 3g1u h LYS 417 Cb 0.72 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 3g1u h LYS 417 CO -0.75 0.46 -0.20 1.96 -2.27 0.00 0.00 179.45 178.65 3g1u h GLN 418 N 0.72 0.80 -0.73 1.90 4.20 -1.54 -3.05 115.11 117.42 3g1u h GLN 418 Ca 0.29 -0.36 0.09 0.00 0.06 0.00 0.00 58.65 58.72 3g1u h GLN 418 Cb 0.13 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.82 3g1u h GLN 418 CO -0.15 0.98 0.39 0.00 -0.67 0.00 0.00 178.83 179.38 3g1u h ALA 419 N 0.80 1.01 -0.03 3.87 0.00 -1.17 -3.48 119.26 120.26 3g1u h ALA 419 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3g1u h ALA 419 Cb 0.76 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3g1u h ALA 419 CO 0.06 0.01 0.00 -1.91 0.00 0.00 0.00 179.25 177.40