#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 -0.17 -0.22 -0.67 -0.85 -1.26 -4.28 117.35 109.89 3g1u s TYR 4 Ca 0.00 -0.03 -0.03 0.00 -0.52 0.00 0.00 57.07 56.49 3g1u s TYR 4 Cb 0.00 0.59 0.10 0.00 0.38 0.00 0.00 41.96 43.03 3g1u s TYR 4 CO 0.00 -0.60 0.24 0.21 -1.52 0.00 0.00 175.55 173.88 3g1u s LYS 5 N -3.02 0.22 0.36 -3.49 2.20 -0.87 -5.01 119.74 110.14 3g1u s LYS 5 Ca 0.10 0.12 0.03 0.00 -0.36 0.00 0.00 55.97 55.87 3g1u s LYS 5 Cb -0.00 -1.07 -0.05 0.00 -1.51 0.00 0.00 37.83 35.20 3g1u s LYS 5 CO -0.02 -0.74 0.09 0.14 -0.36 0.00 0.00 175.35 174.45 3g1u s VAL 6 N 2.33 0.91 0.07 4.02 -7.23 -1.26 -1.15 120.40 118.09 3g1u s VAL 6 Ca 0.08 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 58.05 3g1u s VAL 6 Cb -0.15 -2.60 -0.11 0.00 0.56 0.00 0.00 36.38 34.08 3g1u s VAL 6 CO -0.17 0.00 1.45 0.50 -0.31 0.00 0.00 175.10 176.57 3g1u h LYS 7 N 2.00 0.40 -0.71 4.82 1.63 -1.90 -3.45 116.57 119.36 3g1u h LYS 7 Ca -0.39 -0.16 0.06 0.00 -0.85 0.00 0.00 60.65 59.32 3g1u h LYS 7 Cb 1.26 -0.02 -0.19 0.00 -0.60 0.00 0.00 32.23 32.67 3g1u h LYS 7 CO 0.64 0.66 -0.28 0.34 -3.45 0.00 0.00 179.45 177.36 3g1u s ASP 8 N -6.01 -1.13 0.12 4.20 3.68 -1.26 -5.02 116.67 111.26 3g1u s ASP 8 Ca -0.14 -0.18 0.08 0.00 2.13 0.00 0.00 52.55 54.45 3g1u s ASP 8 Cb 0.06 1.58 0.45 0.00 -1.45 0.00 0.00 42.92 43.56 3g1u s ASP 8 CO 0.75 -0.17 1.25 0.00 0.13 0.00 0.00 175.17 177.13 3g1u n ILE 9 N 4.77 1.61 1.83 4.11 0.13 -1.26 -1.29 119.36 129.27 3g1u n ILE 9 Ca 0.08 0.59 0.13 0.00 -1.10 0.00 0.00 62.75 62.45 3g1u n ILE 9 Cb 0.57 -1.59 0.68 0.00 -0.84 0.00 0.00 39.64 38.46 3g1u n ILE 9 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 3g1u n SER 10 N -1.79 0.42 -0.59 9.51 3.41 -1.26 -2.92 113.62 120.40 3g1u n SER 10 Ca -0.01 -1.30 0.13 0.00 -0.26 0.00 0.00 58.87 57.44 3g1u n SER 10 Cb 0.02 -0.01 0.43 0.00 -0.26 0.00 0.00 64.21 64.38 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 -0.60 1.83 -0.27 1.04 4.77 -0.41 -4.41 117.00 118.95 3g1u n LEU 11 Ca 0.19 -0.64 -0.00 0.00 -0.03 0.00 0.00 56.01 55.53 3g1u n LEU 11 Cb 0.16 -0.02 0.12 0.00 -2.33 0.00 0.00 43.42 41.35 3g1u n LEU 11 CO 0.15 0.32 1.14 0.00 -1.33 0.00 0.00 177.39 177.67 3g1u h ALA 12 N 4.39 1.05 -0.11 -1.18 0.00 -1.74 -0.55 119.26 121.12 3g1u h ALA 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 12 Cb 0.60 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3g1u h ALA 12 CO 0.00 0.17 0.06 1.49 0.00 0.00 0.00 179.25 180.97 3g1u h GLU 13 N 0.84 0.12 0.35 0.00 4.81 -1.86 0.47 114.58 119.31 3g1u h GLU 13 Ca 0.34 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 3g1u h GLU 13 Cb 0.18 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.53 3g1u h GLU 13 CO -0.18 0.08 -0.17 2.35 -0.73 0.00 0.00 179.01 180.36 3g1u h TRP 14 N 0.12 -0.44 -0.89 0.92 7.01 -1.81 -2.74 115.95 118.12 3g1u h TRP 14 Ca 0.04 -0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.14 3g1u h TRP 14 Cb -0.00 0.15 -0.13 0.00 -2.10 0.00 0.00 29.16 27.08 3g1u h TRP 14 CO -0.08 -0.24 -0.50 0.78 -2.79 0.00 0.00 178.44 175.60 3g1u h GLY 15 N -0.52 -0.52 0.49 2.65 0.00 -0.93 -1.99 103.07 102.24 3g1u h GLY 15 Ca -0.05 0.68 0.08 0.00 0.00 0.00 0.00 47.33 48.04 3g1u h GLY 15 CO 0.08 -0.07 0.30 -0.09 0.00 0.00 0.00 176.54 176.76 3g1u h ARG 16 N -0.06 0.52 -0.72 4.80 9.65 -0.86 0.08 114.38 127.78 3g1u h ARG 16 Ca 0.21 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 59.06 3g1u h ARG 16 Cb 0.50 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 3g1u h ARG 16 CO -0.89 0.34 0.43 0.87 2.80 0.00 0.00 179.97 183.52 3g1u h LYS 17 N 0.53 0.98 -0.16 0.20 1.57 -1.13 -1.33 116.57 117.24 3g1u h LYS 17 Ca 0.32 -0.09 -0.17 0.00 -1.87 0.00 0.00 60.65 58.84 3g1u h LYS 17 Cb 0.33 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.44 3g1u h LYS 17 CO -0.26 0.69 -0.56 0.00 -0.57 0.00 0.00 179.45 178.75 3g1u h ALA 18 N 1.48 0.28 -1.00 3.86 0.00 -0.64 -2.77 119.26 120.47 3g1u h ALA 18 Ca 0.26 -0.52 0.02 0.00 0.00 0.00 0.00 54.91 54.67 3g1u h ALA 18 Cb -0.03 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3g1u h ALA 18 CO -0.05 0.50 0.66 0.82 0.00 0.00 0.00 179.25 181.18 3g1u h ILE 19 N 0.33 1.24 -0.52 0.00 2.04 -0.81 -0.01 117.51 119.78 3g1u h ILE 19 Ca -0.03 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 3g1u h ILE 19 Cb 1.19 -0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3g1u h ILE 19 CO 0.12 0.24 0.21 -0.08 0.00 0.00 0.00 178.15 178.64 3g1u h GLU 20 N 1.33 0.78 -0.44 2.37 4.81 -1.18 0.66 114.58 122.91 3g1u h GLU 20 Ca 0.37 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 3g1u h GLU 20 Cb -0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.11 3g1u h GLU 20 CO -0.09 0.69 0.20 -0.07 -0.73 0.00 0.00 179.01 179.01 3g1u h LEU 21 N 0.70 0.59 -0.53 1.64 4.07 -1.19 -2.95 115.31 117.63 3g1u h LEU 21 Ca 0.17 -0.14 0.06 0.00 0.08 0.00 0.00 57.88 58.06 3g1u h LEU 21 Cb 0.20 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 41.73 3g1u h LEU 21 CO -0.01 0.56 0.23 0.00 -1.08 0.00 0.00 178.44 178.14 3g1u h ALA 22 N 1.05 0.68 -0.84 1.53 0.00 -0.63 -2.16 119.26 118.89 3g1u h ALA 22 Ca 0.15 0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.32 3g1u h ALA 22 Cb 0.14 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.79 3g1u h ALA 22 CO -0.02 -0.15 0.22 0.93 0.00 0.00 0.00 179.25 180.24 3g1u h GLU 23 N 0.44 0.23 0.00 0.00 5.08 -0.71 0.47 114.58 120.09 3g1u h GLU 23 Ca 0.25 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 3g1u h GLU 23 Cb 0.23 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 3g1u h GLU 23 CO -0.22 0.15 -0.03 -0.91 -1.00 0.00 0.00 179.01 177.00 3g1u h ASN 24 N 0.24 0.00 -0.46 1.42 2.35 -1.26 -1.94 115.58 115.93 3g1u h ASN 24 Ca 0.51 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.26 3g1u h ASN 24 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 3g1u h ASN 24 CO -0.61 0.03 0.00 -0.62 -1.65 0.00 0.00 177.43 174.58 3g1u n GLU 25 N -3.37 2.57 -2.89 0.81 -0.58 0.16 -4.65 120.64 112.69 3g1u n GLU 25 Ca -0.02 -2.38 -0.21 0.00 -0.42 0.00 0.00 57.16 54.13 3g1u n GLU 25 Cb 0.15 -1.53 -0.02 0.00 -0.57 0.00 0.00 31.44 29.47 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 1.55 2.14 0.23 3.49 2.81 -0.73 -3.18 117.12 123.43 3g1u n MET 26 Ca 0.21 -4.01 0.14 0.00 -1.81 0.00 0.00 57.70 52.22 3g1u n MET 26 Cb 0.62 -1.88 0.77 0.00 -0.71 0.00 0.00 33.22 32.02 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 2.92 0.00 0.50 0.03 0.13 -1.83 -2.12 132.00 131.64 3g1u h PRO 27 Ca 0.11 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.22 3g1u h PRO 27 Cb 0.86 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 3g1u h PRO 27 CO 0.66 0.00 -0.37 0.78 -0.23 0.00 0.00 178.00 178.84 3g1u h GLY 28 N 0.00 -0.94 0.99 1.56 0.00 -1.86 0.91 103.07 103.72 3g1u h GLY 28 Ca 0.05 0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 3g1u h GLY 28 CO -0.00 -0.33 0.28 1.41 0.00 0.00 0.00 176.54 177.90 3g1u h LEU 29 N -0.85 0.72 -1.01 3.11 3.38 -1.64 -2.24 115.31 116.78 3g1u h LEU 29 Ca -0.05 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3g1u h LEU 29 Cb 0.72 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 3g1u h LEU 29 CO 0.02 0.63 0.43 0.24 0.09 0.00 0.00 178.44 179.85 3g1u h MET 30 N 0.75 1.13 -0.18 1.13 2.86 -1.32 -1.99 114.93 117.32 3g1u h MET 30 Ca 0.19 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.59 3g1u h MET 30 Cb 0.09 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 3g1u h MET 30 CO -0.03 0.83 -0.37 0.93 1.06 0.00 0.00 176.91 179.34 3g1u h GLU 31 N 1.13 0.38 -0.59 1.72 3.07 -0.69 -2.60 114.58 117.01 3g1u h GLU 31 Ca 0.28 -0.17 -0.10 0.00 -0.50 0.00 0.00 59.36 58.87 3g1u h GLU 31 Cb 0.04 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 3g1u h GLU 31 CO -0.04 0.70 -0.02 -0.07 -1.40 0.00 0.00 179.01 178.18 3g1u h LEU 32 N 0.32 1.03 -0.34 1.33 3.38 -1.00 0.21 115.31 120.25 3g1u h LEU 32 Ca 0.03 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 57.77 3g1u h LEU 32 Cb 0.80 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 3g1u h LEU 32 CO 0.06 1.09 -0.05 0.03 0.09 0.00 0.00 178.44 179.67 3g1u h ARG 33 N 0.95 0.04 -0.20 1.13 3.08 -1.29 -0.47 114.38 117.63 3g1u h ARG 33 Ca 0.17 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 3g1u h ARG 33 Cb 0.57 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3g1u h ARG 33 CO 0.03 0.03 0.10 -0.09 -1.07 0.00 0.00 179.97 178.97 3g1u h ARG 34 N 0.04 0.28 0.04 0.04 1.12 -1.08 -1.65 114.38 113.17 3g1u h ARG 34 Ca 0.16 -0.04 -0.26 0.00 -1.11 0.00 0.00 59.98 58.74 3g1u h ARG 34 Cb 0.24 -0.05 0.01 0.00 -0.01 0.00 0.00 29.97 30.16 3g1u h ARG 34 CO -0.32 0.29 -1.06 1.49 -3.11 0.00 0.00 179.97 177.26 3g1u h GLU 35 N 0.20 0.52 -0.01 0.20 4.81 -0.88 -3.35 114.58 116.08 3g1u h GLU 35 Ca 0.07 -0.61 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 3g1u h GLU 35 Cb 0.10 0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3g1u h GLU 35 CO -0.01 1.24 -0.55 0.66 -0.73 0.00 0.00 179.01 179.62 3g1u n TYR 36 N -3.76 0.00 0.13 0.92 4.01 -0.19 -4.65 117.16 113.61 3g1u n TYR 36 Ca -0.10 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.49 3g1u n TYR 36 Cb 0.90 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.85 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 4.42 -0.94 0.04 2.72 0.00 -1.43 -2.18 103.07 105.70 3g1u h GLY 37 Ca 0.00 0.54 0.18 0.00 0.00 0.00 0.00 47.33 48.04 3g1u h GLY 37 CO 0.00 -0.28 0.40 -2.55 0.00 0.00 0.00 176.54 174.11 3g1u h PRO 38 N -0.71 0.49 0.00 4.80 0.11 -1.82 -2.79 132.00 132.08 3g1u h PRO 38 Ca 0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3g1u h PRO 38 Cb 0.72 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.71 3g1u h PRO 38 CO -0.24 0.32 -0.42 -1.13 -0.21 0.00 0.00 178.00 176.33 3g1u n SER 39 N -4.96 0.63 -3.79 -2.05 3.41 -1.15 -4.99 113.62 100.73 3g1u n SER 39 Ca 0.19 0.19 -0.28 0.00 -0.26 0.00 0.00 58.87 58.71 3g1u n SER 39 Cb 0.52 -0.08 0.02 0.00 -0.26 0.00 0.00 64.21 64.41 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 -1.99 -2.59 0.33 4.33 1.13 -0.83 -4.84 117.38 112.92 3g1u n GLN 40 Ca 0.04 0.46 0.21 0.00 -1.94 0.00 0.00 57.00 55.77 3g1u n GLN 40 Cb 0.41 -4.44 1.11 0.00 0.11 0.00 0.00 30.24 27.43 3g1u n GLN 40 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3g1u h PRO 41 N -1.87 0.00 -0.52 -1.09 0.13 -1.70 -1.63 132.00 125.33 3g1u h PRO 41 Ca -0.64 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 3g1u h PRO 41 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3g1u h PRO 41 CO 0.55 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.60 3g1u n LEU 42 N -3.00 3.40 -4.61 1.56 4.77 -0.12 -4.80 117.00 114.21 3g1u n LEU 42 Ca -0.03 -1.93 -0.46 0.00 -0.03 0.00 0.00 56.01 53.56 3g1u n LEU 42 Cb 0.15 -0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 3g1u n LEU 42 CO 0.18 0.84 1.69 1.17 -1.33 0.00 0.00 177.39 179.94 3g1u n LYS 43 N 1.10 2.02 0.00 3.23 4.81 -0.61 -0.29 118.16 128.42 3g1u n LYS 43 Ca 0.18 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 3g1u n LYS 43 Cb 0.52 -2.87 0.00 0.00 0.02 0.00 0.00 35.03 32.70 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 5.28 1.76 3.73 3.14 0.00 -1.25 -5.01 105.19 112.84 3g1u n GLY 44 Ca 0.28 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3g1u n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u n ALA 45 N 0.00 2.62 -3.95 4.61 0.00 0.60 -4.91 120.51 119.47 3g1u n ALA 45 Ca 0.00 0.39 -0.33 0.00 0.00 0.00 0.00 53.44 53.50 3g1u n ALA 45 Cb 0.00 -2.48 -0.14 0.00 0.00 0.00 0.00 19.45 16.82 3g1u n ALA 45 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3g1u s LYS 46 N 0.33 1.87 -0.28 0.00 1.02 -1.26 -1.30 119.74 120.12 3g1u s LYS 46 Ca 0.70 -1.66 -0.10 0.00 0.02 0.00 0.00 55.97 54.93 3g1u s LYS 46 Cb -0.51 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 33.59 3g1u s LYS 46 CO 0.41 -0.83 0.14 0.42 -0.92 0.00 0.00 175.35 174.57 3g1u s ILE 47 N 1.03 4.80 -0.17 2.17 1.01 0.12 -1.31 121.20 128.85 3g1u s ILE 47 Ca 0.03 -0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.29 3g1u s ILE 47 Cb -0.20 -3.32 -0.00 0.00 0.01 0.00 0.00 42.46 38.94 3g1u s ILE 47 CO -0.06 0.22 0.97 0.00 0.00 0.00 0.00 174.94 176.07 3g1u s ALA 48 N 1.67 3.54 -0.10 9.38 0.00 -0.32 -1.84 121.76 134.10 3g1u s ALA 48 Ca 0.06 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.25 3g1u s ALA 48 Cb -0.16 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 3g1u s ALA 48 CO 0.07 -0.79 -0.18 0.20 0.00 0.00 0.00 175.76 175.07 3g1u s GLY 49 N 1.16 1.45 -0.36 0.00 0.00 -0.37 -1.42 107.32 107.77 3g1u s GLY 49 Ca 0.44 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 44.21 3g1u s GLY 49 CO 0.12 -0.39 0.20 0.00 0.00 0.00 0.00 173.10 173.03 3g1u s LEU 51 N 1.03 -0.85 -0.22 0.00 0.20 -0.38 -2.55 118.68 115.91 3g1u s LEU 51 Ca 0.17 1.41 -0.21 0.00 0.69 0.00 0.00 54.13 56.19 3g1u s LEU 51 Cb -0.22 2.32 -0.09 0.00 -0.43 0.00 0.00 46.19 47.77 3g1u s LEU 51 CO -0.04 -0.23 0.74 1.41 -0.29 0.00 0.00 176.35 177.95 3g1u n HIS 52 N 3.84 0.74 -2.00 5.38 8.25 -1.26 -4.33 115.22 125.84 3g1u n HIS 52 Ca -0.18 0.49 -0.42 0.00 -0.26 0.00 0.00 57.72 57.34 3g1u n HIS 52 Cb 0.58 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.70 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 2.00 3.10 -3.24 -0.41 1.56 -1.26 -4.59 117.12 114.28 3g1u n MET 53 Ca 0.15 -2.94 -0.19 0.00 -0.27 0.00 0.00 57.70 54.45 3g1u n MET 53 Cb -0.03 -3.20 -0.01 0.00 2.15 0.00 0.00 33.22 32.13 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 2.50 2.91 0.29 1.12 -4.23 -1.26 -1.66 115.64 115.30 3g1u s THR 54 Ca 0.46 -1.13 0.02 0.00 -1.18 0.00 0.00 61.69 59.85 3g1u s THR 54 Cb 0.11 -3.01 0.32 0.00 1.34 0.00 0.00 72.50 71.26 3g1u s THR 54 CO -0.05 -0.01 1.64 0.58 -0.54 0.00 0.00 174.62 176.25 3g1u h VAL 55 N 0.80 0.29 -0.35 2.29 2.07 -1.91 -0.96 116.25 118.48 3g1u h VAL 55 Ca -0.41 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 3g1u h VAL 55 Cb 1.27 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 3g1u h VAL 55 CO 0.50 0.03 0.04 1.56 0.02 0.00 0.00 177.57 179.73 3g1u h GLN 56 N 0.18 0.60 -0.93 1.57 7.50 -1.94 -2.82 115.11 119.27 3g1u h GLN 56 Ca 0.55 -0.17 -0.01 0.00 0.50 0.00 0.00 58.65 59.52 3g1u h GLN 56 Cb 1.12 -0.07 -0.04 0.00 0.05 0.00 0.00 27.48 28.54 3g1u h GLN 56 CO -0.68 0.68 0.53 1.15 -1.50 0.00 0.00 178.83 179.01 3g1u h THR 57 N 0.43 1.26 -0.57 -0.54 2.02 -1.67 -2.45 112.91 111.37 3g1u h THR 57 Ca 0.11 -0.61 0.10 0.00 0.77 0.00 0.00 66.41 66.77 3g1u h THR 57 Cb 0.38 -0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.70 3g1u h THR 57 CO 0.01 0.28 0.16 0.00 0.37 0.00 0.00 175.52 176.35 3g1u h ALA 58 N 1.29 0.70 -0.94 6.16 0.00 -0.96 0.48 119.26 126.00 3g1u h ALA 58 Ca 0.33 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.35 3g1u h ALA 58 Cb -0.01 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3g1u h ALA 58 CO -0.06 -0.26 0.62 0.28 0.00 0.00 0.00 179.25 179.83 3g1u h VAL 59 N 0.32 1.24 -0.35 0.00 2.07 -1.24 -0.06 116.25 118.22 3g1u h VAL 59 Ca 0.29 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 3g1u h VAL 59 Cb 0.39 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 3g1u h VAL 59 CO -0.34 0.23 0.16 0.25 0.02 0.00 0.00 177.57 177.89 3g1u h LEU 60 N 1.27 0.47 -0.54 2.57 5.85 -0.42 -1.02 115.31 123.49 3g1u h LEU 60 Ca 0.34 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.95 3g1u h LEU 60 Cb -0.14 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 3g1u h LEU 60 CO -0.07 0.48 0.31 0.40 -0.34 0.00 0.00 178.44 179.22 3g1u h ILE 61 N 0.43 1.03 0.00 4.05 2.04 0.28 -1.06 117.51 124.29 3g1u h ILE 61 Ca 0.12 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 3g1u h ILE 61 Cb 0.15 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3g1u h ILE 61 CO -0.01 0.11 -0.10 -0.33 0.00 0.00 0.00 178.15 177.82 3g1u h GLU 62 N 0.62 0.00 -0.08 2.37 5.08 -0.83 -1.15 114.58 120.58 3g1u h GLU 62 Ca 0.22 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.54 3g1u h GLU 62 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3g1u h GLU 62 CO -0.11 0.10 -0.12 1.15 -1.00 0.00 0.00 179.01 179.03 3g1u h THR 63 N 0.00 1.39 -0.58 1.13 2.02 -0.75 -1.27 112.91 114.86 3g1u h THR 63 Ca -0.00 -1.36 0.03 0.00 0.77 0.00 0.00 66.41 65.84 3g1u h THR 63 Cb 0.91 2.11 -0.04 0.00 -1.74 0.00 0.00 68.15 69.39 3g1u h THR 63 CO 0.01 0.38 0.35 -0.07 0.37 0.00 0.00 175.52 176.57 3g1u h LEU 64 N -0.24 0.57 -0.39 2.58 3.38 -0.86 -2.12 115.31 118.24 3g1u h LEU 64 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3g1u h LEU 64 Cb 0.67 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3g1u h LEU 64 CO 0.03 0.40 0.04 0.50 0.09 0.00 0.00 178.44 179.50 3g1u h LYS 65 N 0.70 0.66 -0.01 1.13 3.64 -1.28 -2.50 116.57 118.90 3g1u h LYS 65 Ca 0.23 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3g1u h LYS 65 Cb 0.02 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3g1u h LYS 65 CO -0.10 0.73 0.13 0.00 -2.27 0.00 0.00 179.45 177.94 3g1u h ALA 66 N 0.90 1.17 -0.28 5.00 0.00 -0.95 -0.71 119.26 124.40 3g1u h ALA 66 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g1u h ALA 66 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3g1u h ALA 66 CO 0.01 -0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.41 3g1u n LEU 67 N -3.07 3.16 0.00 0.00 4.77 -0.82 -4.71 117.00 116.33 3g1u n LEU 67 Ca -0.02 -1.28 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 3g1u n LEU 67 Cb 0.19 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3g1u n LEU 67 CO 0.18 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 3g1u n GLY 68 N 1.43 0.84 3.84 -0.72 0.00 -0.27 -0.94 105.19 109.37 3g1u n GLY 68 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 3.17 -0.17 4.61 0.00 -0.97 -3.54 121.76 122.86 3g1u s ALA 69 Ca 0.00 0.20 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 3g1u s ALA 69 Cb 0.00 -2.97 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 3g1u s ALA 69 CO 0.00 0.15 0.26 -1.21 0.00 0.00 0.00 175.76 174.96 3g1u s GLU 70 N -3.26 4.24 0.02 0.00 2.02 -0.42 -4.43 118.70 116.87 3g1u s GLU 70 Ca 0.58 0.02 0.09 0.00 0.02 0.00 0.00 54.97 55.67 3g1u s GLU 70 Cb -0.10 -3.43 -0.02 0.00 0.10 0.00 0.00 34.13 30.68 3g1u s GLU 70 CO 0.18 0.24 -0.26 -0.51 0.02 0.00 0.00 175.26 174.93 3g1u s LEU 71 N 0.48 2.12 -0.10 1.80 1.43 -1.26 0.12 118.68 123.28 3g1u s LEU 71 Ca 0.14 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3g1u s LEU 71 Cb -0.13 -1.29 0.02 0.00 0.03 0.00 0.00 46.19 44.83 3g1u s LEU 71 CO 0.03 0.28 -0.09 -0.13 0.23 0.00 0.00 176.35 176.66 3g1u s ARG 72 N -0.98 1.58 -0.04 1.70 0.52 -0.76 -4.06 118.95 116.91 3g1u s ARG 72 Ca 0.11 -0.31 0.07 0.00 -0.52 0.00 0.00 55.73 55.08 3g1u s ARG 72 Cb -0.10 -1.52 -0.02 0.00 0.52 0.00 0.00 34.95 33.83 3g1u s ARG 72 CO 0.01 -0.17 -0.24 -0.46 0.02 0.00 0.00 175.30 174.46 3g1u s TRP 73 N 1.35 2.41 0.16 -0.53 -0.11 0.20 -1.24 118.94 121.18 3g1u s TRP 73 Ca -0.02 -0.52 0.06 0.00 1.22 0.00 0.00 56.10 56.84 3g1u s TRP 73 Cb -0.14 -1.55 -0.04 0.00 -1.50 0.00 0.00 33.47 30.24 3g1u s TRP 73 CO -0.04 -0.09 -0.12 -1.54 -4.62 0.00 0.00 176.95 170.54 3g1u s SER 74 N -0.44 2.09 0.53 5.86 1.04 0.04 -0.12 113.70 122.70 3g1u s SER 74 Ca 0.05 -0.98 -0.18 0.00 0.48 0.00 0.00 55.95 55.31 3g1u s SER 74 Cb -0.12 -0.06 -0.06 0.00 0.10 0.00 0.00 66.02 65.88 3g1u s SER 74 CO 0.01 -0.25 1.04 -0.55 0.98 0.00 0.00 173.24 174.47 3g1u s SER 75 N -3.11 6.13 -0.03 7.02 0.15 -1.25 -1.25 113.70 121.36 3g1u s SER 75 Ca 0.17 1.85 0.20 0.00 0.70 0.00 0.00 55.95 58.88 3g1u s SER 75 Cb 0.00 -2.54 0.63 0.00 -1.71 0.00 0.00 66.02 62.40 3g1u s SER 75 CO 0.03 -0.93 1.53 0.00 1.20 0.00 0.00 173.24 175.07 3g1u s ASN 77 N -0.99 -0.29 0.51 0.00 3.84 -1.26 -4.95 114.94 111.80 3g1u s ASN 77 Ca 0.47 0.45 0.15 0.00 0.21 0.00 0.00 52.86 54.15 3g1u s ASN 77 Cb 0.26 0.55 1.23 0.00 -0.55 0.00 0.00 41.25 42.74 3g1u s ASN 77 CO 0.29 -0.23 2.14 0.40 -2.79 0.00 0.00 177.10 176.91 3g1u h ILE 78 N 4.36 1.00 -0.06 -5.21 2.04 -1.91 -3.26 117.51 114.47 3g1u h ILE 78 Ca -0.28 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3g1u h ILE 78 Cb 1.18 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 3g1u h ILE 78 CO 0.33 0.01 0.00 0.49 0.00 0.00 0.00 178.15 178.98 3g1u n PHE 79 N -4.53 0.08 0.07 1.37 3.72 -1.26 -0.90 117.46 116.01 3g1u n PHE 79 Ca -0.02 -0.31 0.11 0.00 -0.05 0.00 0.00 57.45 57.18 3g1u n PHE 79 Cb 0.10 -0.03 -0.07 0.00 -0.94 0.00 0.00 39.48 38.54 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 -0.07 0.47 -4.73 4.37 3.41 -1.23 -4.26 113.62 111.58 3g1u n SER 80 Ca 0.03 0.17 -0.42 0.00 -0.26 0.00 0.00 58.87 58.38 3g1u n SER 80 Cb 0.22 1.13 -0.01 0.00 -0.26 0.00 0.00 64.21 65.29 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 -2.47 1.67 -3.54 6.66 -1.04 -1.26 -4.53 114.28 109.76 3g1u n THR 81 Ca -0.02 -0.42 -0.41 0.00 -2.04 0.00 0.00 64.05 61.16 3g1u n THR 81 Cb 0.56 -1.78 -0.10 0.00 -1.82 0.00 0.00 70.33 67.18 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 -1.49 2.82 0.41 -2.82 -0.21 -0.67 -4.13 119.66 113.57 3g1u s GLN 82 Ca 0.58 -1.20 0.10 0.00 0.02 0.00 0.00 55.36 54.86 3g1u s GLN 82 Cb -0.53 -3.85 0.92 0.00 1.00 0.00 0.00 33.01 30.56 3g1u s GLN 82 CO 0.58 -0.82 2.01 -0.44 -2.12 0.00 0.00 175.29 174.50 3g1u h ASP 83 N 8.51 0.45 -0.72 5.90 3.32 -1.93 -0.06 116.42 131.88 3g1u h ASP 83 Ca -0.26 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 3g1u h ASP 83 Cb 1.10 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.52 3g1u h ASP 83 CO 0.73 0.30 0.42 -0.55 -1.72 0.00 0.00 179.24 178.41 3g1u h ASN 84 N 0.51 0.89 -0.09 6.45 -1.07 -1.92 -1.14 115.58 119.23 3g1u h ASN 84 Ca 0.24 -0.06 -0.11 0.00 0.07 0.00 0.00 56.30 56.43 3g1u h ASN 84 Cb 0.28 -0.23 0.00 0.00 -2.07 0.00 0.00 38.32 36.30 3g1u h ASN 84 CO -0.06 0.71 -0.37 0.00 0.07 0.00 0.00 177.43 177.77 3g1u h ALA 85 N 1.44 0.16 -0.73 4.14 0.00 -1.32 -1.70 119.26 121.25 3g1u h ALA 85 Ca 0.26 -0.46 0.04 0.00 0.00 0.00 0.00 54.91 54.75 3g1u h ALA 85 Cb -0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 85 CO -0.05 0.25 0.45 0.00 0.00 0.00 0.00 179.25 179.91 3g1u h ALA 86 N 0.45 0.97 -0.44 0.00 0.00 -1.35 -1.71 119.26 117.18 3g1u h ALA 86 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3g1u h ALA 86 Cb 1.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3g1u h ALA 86 CO 0.08 0.21 0.15 0.00 0.00 0.00 0.00 179.25 179.69 3g1u h ALA 87 N 1.33 0.58 -0.78 0.00 0.00 -1.18 -0.11 119.26 119.10 3g1u h ALA 87 Ca 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3g1u h ALA 87 Cb 0.07 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3g1u h ALA 87 CO -0.13 0.21 0.45 0.00 0.00 0.00 0.00 179.25 179.79 3g1u h ALA 88 N 1.00 1.33 -0.17 0.00 0.00 -1.07 -1.62 119.26 118.73 3g1u h ALA 88 Ca 0.14 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3g1u h ALA 88 Cb 0.24 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3g1u h ALA 88 CO -0.01 0.57 -0.16 0.82 0.00 0.00 0.00 179.25 180.47 3g1u h ILE 89 N 1.08 1.34 -0.59 0.00 1.08 -1.03 -3.21 117.51 116.19 3g1u h ILE 89 Ca 0.28 -1.31 0.01 0.00 -0.39 0.00 0.00 64.86 63.44 3g1u h ILE 89 Cb -0.02 1.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.53 3g1u h ILE 89 CO -0.05 0.39 0.39 0.00 -0.69 0.00 0.00 178.15 178.19 3g1u h ALA 90 N 0.63 0.74 0.00 1.87 0.00 -0.80 -1.70 119.26 120.00 3g1u h ALA 90 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g1u h ALA 90 Cb 0.69 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3g1u h ALA 90 CO 0.04 0.18 0.11 -0.22 0.00 0.00 0.00 179.25 179.36 3g1u h LYS 91 N 0.80 0.00 -0.00 0.00 1.63 -1.34 0.11 116.57 117.77 3g1u h LYS 91 Ca 0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 3g1u h LYS 91 Cb -0.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.54 3g1u h LYS 91 CO -0.05 0.00 -0.50 0.25 -3.45 0.00 0.00 179.45 175.70 3g1u n THR 92 N -2.54 0.00 -0.56 1.00 -2.24 -0.64 -4.95 114.28 104.34 3g1u n THR 92 Ca -0.02 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3g1u n THR 92 Cb 0.15 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 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 1.46 0.74 3.66 3.38 0.00 0.39 -5.06 105.19 109.76 3g1u n GLY 93 Ca 0.07 -0.54 -0.39 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.00 5.10 -0.18 1.61 1.01 -1.21 -5.03 120.40 119.70 3g1u s VAL 94 Ca 0.00 0.94 -0.29 0.00 0.00 0.00 0.00 61.98 62.63 3g1u s VAL 94 Cb 0.00 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 3g1u s VAL 94 CO 0.00 0.17 1.94 -2.84 0.00 0.00 0.00 175.10 174.37 3g1u s PRO 95 N 1.71 3.55 -0.04 2.72 0.02 -1.26 -4.26 135.00 137.45 3g1u s PRO 95 Ca 0.24 1.97 0.01 0.00 0.02 0.00 0.00 61.00 63.24 3g1u s PRO 95 Cb -0.15 -4.21 0.02 0.00 0.02 0.00 0.00 34.50 30.17 3g1u s PRO 95 CO 0.09 -1.61 -0.06 0.54 -0.33 0.00 0.00 177.00 175.64 3g1u s VAL 96 N 6.45 0.59 -0.41 3.83 0.11 -1.26 -0.63 120.40 129.08 3g1u s VAL 96 Ca 0.87 -0.19 0.03 0.00 -2.93 0.00 0.00 61.98 59.76 3g1u s VAL 96 Cb -0.31 -0.58 0.12 0.00 -1.53 0.00 0.00 36.38 34.07 3g1u s VAL 96 CO 0.35 0.22 0.17 -0.36 -3.33 0.00 0.00 175.10 172.15 3g1u s PHE 97 N 0.66 2.77 -0.29 1.54 0.08 0.83 -2.05 117.98 121.53 3g1u s PHE 97 Ca -0.09 -2.69 -0.17 0.00 0.12 0.00 0.00 56.93 54.10 3g1u s PHE 97 Cb -0.12 -2.42 0.14 0.00 -0.57 0.00 0.00 43.02 40.05 3g1u s PHE 97 CO 0.00 -0.83 0.96 0.00 -0.10 0.00 0.00 175.22 175.25 3g1u s ALA 98 N 0.53 -2.21 -0.01 5.36 0.00 -0.30 -3.89 121.76 121.24 3g1u s ALA 98 Ca 0.14 2.19 -0.14 0.00 0.00 0.00 0.00 51.96 54.15 3g1u s ALA 98 Cb -0.22 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.26 3g1u s ALA 98 CO -0.06 -0.34 0.29 1.67 0.00 0.00 0.00 175.76 177.32 3g1u s TRP 99 N 1.25 -0.15 0.18 0.00 -2.14 -1.26 -4.19 118.94 112.63 3g1u s TRP 99 Ca -0.08 0.20 -0.31 0.00 2.66 0.00 0.00 56.10 58.56 3g1u s TRP 99 Cb -0.04 0.08 -0.10 0.00 -3.10 0.00 0.00 33.47 30.31 3g1u s TRP 99 CO -0.14 -0.39 1.55 0.21 -2.66 0.00 0.00 176.95 175.52 3g1u s LYS 100 N -1.42 4.22 0.00 3.25 2.20 -1.26 -3.44 119.74 123.30 3g1u s LYS 100 Ca -0.13 2.36 0.00 0.00 -0.36 0.00 0.00 55.97 57.84 3g1u s LYS 100 Cb -0.05 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 3g1u s LYS 100 CO 0.03 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 3g1u n GLY 101 N 3.49 0.81 3.64 5.54 0.00 -0.08 -5.01 105.19 113.57 3g1u n GLY 101 Ca 0.13 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 3g1u n GLY 101 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3g1u n GLU 102 N -2.27 0.79 -2.15 1.61 1.02 -1.04 -5.03 120.64 113.57 3g1u n GLU 102 Ca 0.00 0.32 -0.29 0.00 -0.02 0.00 0.00 57.16 57.17 3g1u n GLU 102 Cb 0.02 -2.26 0.03 0.00 -0.02 0.00 0.00 31.44 29.21 3g1u n GLU 102 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3g1u s THR 103 N -1.60 3.77 0.20 2.62 -4.23 -1.26 -4.88 115.64 110.26 3g1u s THR 103 Ca 0.77 0.30 -0.14 0.00 -1.18 0.00 0.00 61.69 61.44 3g1u s THR 103 Cb -0.38 -3.53 0.18 0.00 1.34 0.00 0.00 72.50 70.11 3g1u s THR 103 CO 0.46 -0.63 1.64 0.44 -0.54 0.00 0.00 174.62 176.00 3g1u h ASP 104 N -0.36 -0.47 -0.26 3.99 3.32 -1.99 0.15 116.42 120.80 3g1u h ASP 104 Ca -0.45 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3g1u h ASP 104 Cb 1.24 0.33 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 3g1u h ASP 104 CO 0.62 -0.17 0.17 -0.33 -1.72 0.00 0.00 179.24 177.81 3g1u h GLU 105 N 0.02 0.34 -0.54 3.56 3.07 -2.00 -1.77 114.58 117.25 3g1u h GLU 105 Ca 0.27 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.10 3g1u h GLU 105 Cb 0.42 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.22 3g1u h GLU 105 CO -0.56 0.22 0.29 0.93 -1.40 0.00 0.00 179.01 178.50 3g1u h GLU 106 N 0.35 0.74 -0.28 2.33 5.08 -1.78 -2.06 114.58 118.96 3g1u h GLU 106 Ca 0.10 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3g1u h GLU 106 Cb -0.04 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3g1u h GLU 106 CO -0.02 0.55 0.17 -0.92 -1.00 0.00 0.00 179.01 177.79 3g1u h TYR 107 N 0.75 0.33 -0.30 4.33 3.20 0.13 -0.34 116.97 125.07 3g1u h TYR 107 Ca 0.19 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 3g1u h TYR 107 Cb 0.03 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 3g1u h TYR 107 CO 0.00 0.20 -0.10 0.93 -1.64 0.00 0.00 178.16 177.56 3g1u h GLU 108 N 0.36 0.59 -0.50 1.82 5.08 -1.21 -2.68 114.58 118.04 3g1u h GLU 108 Ca 0.11 -0.24 0.10 0.00 -1.00 0.00 0.00 59.36 58.33 3g1u h GLU 108 Cb -0.02 -0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.10 3g1u h GLU 108 CO -0.04 0.80 -0.13 2.35 -1.00 0.00 0.00 179.01 180.99 3g1u h TRP 109 N 0.36 -0.29 -0.39 4.33 7.01 -1.19 -0.30 115.95 125.48 3g1u h TRP 109 Ca 0.07 0.05 0.07 0.00 2.11 0.00 0.00 58.89 61.19 3g1u h TRP 109 Cb 0.59 0.20 -0.06 0.00 -2.10 0.00 0.00 29.16 27.80 3g1u h TRP 109 CO 0.05 -0.22 -0.00 0.00 -2.79 0.00 0.00 178.44 175.48 3g1u h ILE 111 N 0.10 1.22 -0.55 0.00 2.04 -1.05 -2.41 117.51 116.86 3g1u h ILE 111 Ca 0.19 -0.67 0.13 0.00 1.00 0.00 0.00 64.86 65.51 3g1u h ILE 111 Cb 0.27 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 3g1u h ILE 111 CO -0.32 0.26 0.38 0.00 0.00 0.00 0.00 178.15 178.48 3g1u h ALA 112 N 1.09 2.27 0.00 1.87 0.00 -0.38 -0.70 119.26 123.41 3g1u h ALA 112 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3g1u h ALA 112 Cb 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3g1u h ALA 112 CO -0.02 -0.42 -0.02 1.96 0.00 0.00 0.00 179.25 180.76 3g1u h GLN 113 N 0.18 0.00 -0.00 0.00 1.08 -0.85 -2.93 115.11 112.59 3g1u h GLN 113 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 3g1u h GLN 113 Cb 0.79 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 3g1u h GLN 113 CO -0.04 0.02 -0.29 0.25 -0.95 0.00 0.00 178.83 177.81 3g1u n THR 114 N -3.12 0.00 0.09 -0.54 -2.24 -0.27 -3.97 114.28 104.23 3g1u n THR 114 Ca 0.00 -0.02 0.10 0.00 -2.27 0.00 0.00 64.05 61.87 3g1u n THR 114 Cb 0.31 0.02 0.22 0.00 -2.10 0.00 0.00 70.33 68.77 3g1u n THR 114 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3g1u n VAL 115 N -1.35 0.65 -4.05 2.28 0.31 -1.11 -4.64 118.33 110.43 3g1u n VAL 115 Ca 0.08 -0.82 -0.10 0.00 -0.01 0.00 0.00 64.34 63.49 3g1u n VAL 115 Cb 0.33 0.83 -0.06 0.00 -0.91 0.00 0.00 33.84 34.02 3g1u n VAL 115 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3g1u s LYS 116 N -1.26 1.46 0.00 5.55 -2.85 -1.25 -4.52 119.74 116.86 3g1u s LYS 116 Ca 0.37 -1.34 0.00 0.00 -1.00 0.00 0.00 55.97 54.00 3g1u s LYS 116 Cb 0.21 0.42 0.00 0.00 -2.06 0.00 0.00 37.83 36.40 3g1u s LYS 116 CO 0.28 -0.58 0.00 0.41 0.10 0.00 0.00 175.35 175.56 3g1u n GLY 117 N -0.35 0.83 3.92 0.59 0.00 -0.13 -4.94 105.19 105.10 3g1u n GLY 117 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.08 1.36 0.94 1.61 0.40 -1.00 -4.95 117.98 114.26 3g1u s PHE 118 Ca 0.00 0.27 -0.13 0.00 -0.60 0.00 0.00 56.93 56.48 3g1u s PHE 118 Cb 0.00 -4.16 0.16 0.00 0.51 0.00 0.00 43.02 39.52 3g1u s PHE 118 CO 0.00 -2.84 1.13 -1.54 0.70 0.00 0.00 175.22 172.67 3g1u s SER 119 N -4.88 3.21 0.87 1.36 1.04 -1.26 -3.24 113.70 110.80 3g1u s SER 119 Ca 0.75 0.98 0.00 0.00 0.48 0.00 0.00 55.95 58.17 3g1u s SER 119 Cb -0.03 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.53 3g1u s SER 119 CO 0.54 -2.74 0.00 0.61 0.98 0.00 0.00 173.24 172.63 3g1u n GLY 120 N -1.96 2.37 0.00 7.32 0.00 -1.26 -2.34 105.19 109.32 3g1u n GLY 120 Ca 0.07 -0.48 0.03 0.00 0.00 0.00 0.00 46.02 45.63 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 2.28 0.00 -0.33 1.61 5.68 -1.26 -4.79 116.55 119.74 3g1u n ASP 121 Ca 0.00 -0.16 -0.04 0.00 -0.50 0.00 0.00 54.79 54.09 3g1u n ASP 121 Cb 0.00 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 39.95 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 -0.65 0.67 3.61 6.12 0.00 -0.99 -4.88 105.19 109.07 3g1u n GLY 122 Ca 0.04 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.97 3.21 0.44 0.99 1.43 -1.26 -0.95 118.68 121.58 3g1u s LEU 123 Ca 0.00 -0.12 -0.22 0.00 -1.03 0.00 0.00 54.13 52.76 3g1u s LEU 123 Cb 0.00 -1.83 -0.08 0.00 0.03 0.00 0.00 46.19 44.31 3g1u s LEU 123 CO 0.00 0.29 1.06 -2.16 0.23 0.00 0.00 176.35 175.77 3g1u s PRO 124 N -1.38 3.94 0.00 1.29 0.04 -1.26 -4.81 135.00 132.81 3g1u s PRO 124 Ca 0.17 1.50 0.03 0.00 0.04 0.00 0.00 61.00 62.73 3g1u s PRO 124 Cb -0.11 -2.34 0.04 0.00 0.04 0.00 0.00 34.50 32.13 3g1u s PRO 124 CO 0.07 -0.33 0.74 0.27 0.04 0.00 0.00 177.00 177.79 3g1u n ASN 125 N -0.51 1.55 -3.94 6.66 0.23 -0.57 -4.56 115.26 114.14 3g1u n ASN 125 Ca 0.07 -1.41 -0.10 0.00 -0.53 0.00 0.00 54.58 52.62 3g1u n ASN 125 Cb 0.50 -0.02 -0.11 0.00 -2.08 0.00 0.00 39.78 38.07 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 -0.48 0.29 -0.08 -3.83 -1.94 -0.43 -0.54 119.30 112.29 3g1u s MET 126 Ca 0.04 -0.45 0.03 0.00 -1.71 0.00 0.00 55.69 53.61 3g1u s MET 126 Cb 0.02 0.11 0.01 0.00 2.01 0.00 0.00 34.83 36.98 3g1u s MET 126 CO 0.04 -0.05 -0.19 0.42 -0.01 0.00 0.00 175.02 175.22 3g1u s ILE 127 N -1.16 1.66 -0.27 2.53 1.01 -0.77 -1.18 121.20 123.02 3g1u s ILE 127 Ca -0.13 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.76 3g1u s ILE 127 Cb -0.08 -1.46 0.06 0.00 0.01 0.00 0.00 42.46 41.00 3g1u s ILE 127 CO -0.00 0.47 -0.08 -0.22 0.00 0.00 0.00 174.94 175.10 3g1u s LEU 128 N 0.47 3.58 0.32 2.97 0.20 -0.51 -1.39 118.68 124.31 3g1u s LEU 128 Ca -0.17 -1.39 0.08 0.00 0.69 0.00 0.00 54.13 53.35 3g1u s LEU 128 Cb -0.17 -1.59 -0.06 0.00 -0.43 0.00 0.00 46.19 43.94 3g1u s LEU 128 CO 0.07 -0.21 -0.08 -0.62 -0.29 0.00 0.00 176.35 175.22 3g1u s ASP 129 N 1.13 3.36 -0.37 3.68 2.15 0.03 -1.75 116.67 124.91 3g1u s ASP 129 Ca -0.08 -1.20 0.04 0.00 0.43 0.00 0.00 52.55 51.74 3g1u s ASP 129 Cb -0.20 -0.28 0.16 0.00 -0.30 0.00 0.00 42.92 42.30 3g1u s ASP 129 CO -0.04 -0.26 0.43 -0.62 -0.17 0.00 0.00 175.17 174.51 3g1u s ASP 130 N -3.55 0.52 0.00 -0.34 -1.08 -1.06 -1.74 116.67 109.43 3g1u s ASP 130 Ca 0.31 -1.23 0.00 0.00 -0.52 0.00 0.00 52.55 51.11 3g1u s ASP 130 Cb 0.03 0.92 0.00 0.00 -1.46 0.00 0.00 42.92 42.41 3g1u s ASP 130 CO 0.15 -0.26 0.00 0.61 0.52 0.00 0.00 175.17 176.19 3g1u n GLY 131 N 4.46 2.00 0.00 2.66 0.00 -1.26 -4.66 105.19 108.39 3g1u n GLY 131 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.36 0.33 0.23 -0.02 0.00 -1.26 -3.83 105.19 100.29 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 -0.54 -0.51 1.61 3.32 -1.96 0.16 116.42 118.51 3g1u h ASP 133 Ca 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 3g1u h ASP 133 Cb 0.00 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3g1u h ASP 133 CO 0.00 -0.27 0.26 0.25 -1.72 0.00 0.00 179.24 177.76 3g1u h LEU 134 N -0.36 0.65 -0.34 1.55 5.85 -1.93 -0.35 115.31 120.37 3g1u h LEU 134 Ca 0.03 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.71 3g1u h LEU 134 Cb 0.39 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 3g1u h LEU 134 CO -0.11 0.57 -0.12 0.74 -0.34 0.00 0.00 178.44 179.18 3g1u h THR 135 N 0.68 0.58 -0.23 1.05 2.02 -1.94 -0.98 112.91 114.08 3g1u h THR 135 Ca 0.18 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.27 3g1u h THR 135 Cb 0.08 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3g1u h THR 135 CO -0.03 0.00 -0.23 0.78 0.37 0.00 0.00 175.52 176.42 3g1u h ASN 136 N -0.05 0.43 -0.16 4.18 2.35 -0.32 -1.59 115.58 120.40 3g1u h ASN 136 Ca 0.17 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 3g1u h ASN 136 Cb 0.31 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3g1u h ASN 136 CO -0.38 0.66 0.01 0.25 -1.65 0.00 0.00 177.43 176.32 3g1u h LEU 137 N 0.39 0.28 -0.23 1.61 5.85 -0.74 -1.51 115.31 120.95 3g1u h LEU 137 Ca 0.06 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 3g1u h LEU 137 Cb 0.62 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3g1u h LEU 137 CO 0.04 0.51 0.10 0.58 -0.34 0.00 0.00 178.44 179.33 3g1u h VAL 138 N 0.04 1.16 0.36 1.05 2.07 -0.97 0.30 116.25 120.26 3g1u h VAL 138 Ca 0.05 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3g1u h VAL 138 Cb 0.36 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3g1u h VAL 138 CO 0.01 0.16 -0.17 0.40 0.02 0.00 0.00 177.57 177.98 3g1u h ILE 139 N 0.22 0.57 -0.06 4.57 2.04 -1.36 -1.80 117.51 121.69 3g1u h ILE 139 Ca 0.08 -0.59 -0.18 0.00 1.00 0.00 0.00 64.86 65.17 3g1u h ILE 139 Cb 0.16 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3g1u h ILE 139 CO -0.01 0.10 -0.72 0.44 0.00 0.00 0.00 178.15 177.96 3g1u h ASP 140 N -0.85 0.37 0.00 1.72 3.32 -1.31 -3.35 116.42 116.32 3g1u h ASP 140 Ca -0.05 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3g1u h ASP 140 Cb 0.53 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3g1u h ASP 140 CO 0.08 0.97 -1.00 0.54 -1.72 0.00 0.00 179.24 178.11 3g1u n ARG 141 N -3.81 1.90 -3.02 3.56 5.12 0.10 -4.72 116.66 115.80 3g1u n ARG 141 Ca -0.04 -0.05 -0.22 0.00 -1.93 0.00 0.00 57.85 55.61 3g1u n ARG 141 Cb 0.70 -1.11 -0.03 0.00 -1.16 0.00 0.00 32.46 30.86 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 -1.57 2.21 0.30 -1.55 4.01 -0.68 -4.92 117.16 114.96 3g1u n TYR 142 Ca -0.00 -3.85 0.18 0.00 -0.16 0.00 0.00 57.90 54.07 3g1u n TYR 142 Cb 0.21 -0.44 0.93 0.00 -0.31 0.00 0.00 39.34 39.73 3g1u n TYR 142 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3g1u h PRO 143 N 2.97 0.00 0.00 -0.72 0.13 -1.69 0.22 132.00 132.92 3g1u h PRO 143 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3g1u h PRO 143 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3g1u h PRO 143 CO 0.67 0.04 0.00 0.93 -0.23 0.00 0.00 178.00 179.40 3g1u h GLU 144 N 0.00 0.00 0.00 0.86 5.08 -1.91 -3.09 114.58 115.52 3g1u h GLU 144 Ca -0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 3g1u h GLU 144 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3g1u h GLU 144 CO 0.00 0.00 -1.49 -0.11 -1.00 0.00 0.00 179.01 176.42 3g1u n LEU 145 N -2.57 0.67 -0.25 1.33 7.94 0.78 -4.49 117.00 120.41 3g1u n LEU 145 Ca 0.02 0.28 -0.04 0.00 -1.11 0.00 0.00 56.01 55.16 3g1u n LEU 145 Cb 0.26 0.07 0.02 0.00 0.53 0.00 0.00 43.42 44.30 3g1u n LEU 145 CO 0.23 0.08 0.62 0.58 -1.11 0.00 0.00 177.39 177.79 3g1u h VAL 146 N 0.00 0.13 0.00 1.96 2.07 -1.44 0.12 116.25 119.09 3g1u h VAL 146 Ca -0.14 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3g1u h VAL 146 Cb 1.44 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 3g1u h VAL 146 CO 0.03 0.00 0.16 -2.65 0.02 0.00 0.00 177.57 175.12 3g1u n PRO 147 N -5.45 0.12 0.07 1.57 -0.02 -1.26 -2.17 135.00 127.86 3g1u n PRO 147 Ca 0.06 0.61 0.07 0.00 -2.02 0.00 0.00 63.50 62.22 3g1u n PRO 147 Cb 0.37 -2.04 -0.04 0.00 -0.02 0.00 0.00 33.50 31.77 3g1u n PRO 147 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3g1u n LYS 148 N -2.17 0.61 -3.12 -0.52 4.01 0.41 -4.86 118.16 112.51 3g1u n LYS 148 Ca -0.01 0.16 -0.41 0.00 -0.51 0.00 0.00 58.31 57.54 3g1u n LYS 148 Cb 0.18 -1.81 -0.06 0.00 -0.51 0.00 0.00 35.03 32.83 3g1u n LYS 148 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3g1u s ILE 149 N -3.19 4.99 -0.79 -0.18 1.01 -0.92 -4.47 121.20 117.64 3g1u s ILE 149 Ca -0.02 1.11 0.26 0.00 0.00 0.00 0.00 60.65 62.00 3g1u s ILE 149 Cb 0.09 -3.92 0.16 0.00 0.01 0.00 0.00 42.46 38.80 3g1u s ILE 149 CO 0.80 0.03 1.60 0.49 0.00 0.00 0.00 174.94 177.87 3g1u n PHE 150 N 5.68 0.50 0.00 3.97 3.72 0.30 -4.89 117.46 126.75 3g1u n PHE 150 Ca -0.01 0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 3g1u n PHE 150 Cb 0.49 -0.66 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 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 1.38 1.19 3.28 1.37 0.00 -1.26 -4.75 105.19 106.40 3g1u n GLY 151 Ca 0.05 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 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 2.22 -0.19 -0.61 1.01 -0.18 -1.85 121.20 119.60 3g1u s ILE 152 Ca 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.63 3g1u s ILE 152 Cb 0.00 -1.83 -0.01 0.00 0.01 0.00 0.00 42.46 40.63 3g1u s ILE 152 CO 0.00 0.57 -0.08 -0.94 0.00 0.00 0.00 174.94 174.48 3g1u s SER 153 N -0.05 4.14 -0.15 3.58 1.04 -0.49 0.26 113.70 122.03 3g1u s SER 153 Ca -0.06 -0.38 -0.03 0.00 0.48 0.00 0.00 55.95 55.95 3g1u s SER 153 Cb -0.15 -1.68 -0.03 0.00 0.10 0.00 0.00 66.02 64.27 3g1u s SER 153 CO 0.05 0.05 -0.05 -0.70 0.98 0.00 0.00 173.24 173.57 3g1u s GLU 154 N 1.07 3.63 -0.00 4.02 2.56 -0.79 -0.79 118.70 128.40 3g1u s GLU 154 Ca 0.00 -0.54 -0.14 0.00 0.00 0.00 0.00 54.97 54.29 3g1u s GLU 154 Cb -0.15 -2.89 -0.34 0.00 2.00 0.00 0.00 34.13 32.76 3g1u s GLU 154 CO -0.01 0.22 0.87 1.49 -0.56 0.00 0.00 175.26 177.27 3g1u h GLU 155 N 6.75 0.48 -5.66 4.30 4.57 -1.67 -2.24 114.58 121.11 3g1u h GLU 155 Ca -0.31 -0.82 -0.49 0.00 -1.18 0.00 0.00 59.36 56.56 3g1u h GLU 155 Cb 1.19 0.31 -0.14 0.00 -0.16 0.00 0.00 28.75 29.95 3g1u h GLU 155 CO 0.62 1.39 -0.72 -0.08 -1.18 0.00 0.00 179.01 179.04 3g1u s THR 156 N -2.58 1.85 0.12 0.32 -1.32 -1.26 -3.35 115.64 109.42 3g1u s THR 156 Ca -0.12 -2.22 -0.23 0.00 -1.21 0.00 0.00 61.69 57.91 3g1u s THR 156 Cb 0.04 -2.20 -0.04 0.00 -1.51 0.00 0.00 72.50 68.79 3g1u s THR 156 CO 0.91 -0.48 1.67 0.74 -2.21 0.00 0.00 174.62 175.24 3g1u h THR 157 N 2.43 0.60 -0.50 5.08 2.02 -1.95 -1.61 112.91 118.98 3g1u h THR 157 Ca -0.39 0.00 0.10 0.00 0.77 0.00 0.00 66.41 66.89 3g1u h THR 157 Cb 1.23 0.60 -0.09 0.00 -1.74 0.00 0.00 68.15 68.16 3g1u h THR 157 CO 0.63 0.00 -0.02 0.74 0.37 0.00 0.00 175.52 177.24 3g1u h THR 158 N -0.22 0.58 -0.92 3.16 2.02 -1.95 -0.82 112.91 114.77 3g1u h THR 158 Ca 0.08 -0.03 0.05 0.00 0.77 0.00 0.00 66.41 67.27 3g1u h THR 158 Cb 0.33 0.48 -0.06 0.00 -1.74 0.00 0.00 68.15 67.16 3g1u h THR 158 CO -0.20 0.02 0.59 1.23 0.37 0.00 0.00 175.52 177.52 3g1u h GLY 159 N 0.09 1.38 0.92 2.16 0.00 -1.56 -0.46 103.07 105.60 3g1u h GLY 159 Ca 0.25 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 3g1u h GLY 159 CO -0.44 0.34 0.05 -2.08 0.00 0.00 0.00 176.54 174.40 3g1u h VAL 160 N 1.11 1.24 -0.79 4.60 2.07 -0.43 -1.44 116.25 122.61 3g1u h VAL 160 Ca 0.39 -0.87 0.08 0.00 0.82 0.00 0.00 66.70 67.11 3g1u h VAL 160 Cb 0.10 1.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 3g1u h VAL 160 CO -0.15 0.29 0.46 0.11 0.02 0.00 0.00 177.57 178.30 3g1u h LYS 161 N 0.44 0.78 -0.87 1.57 1.57 -0.92 -1.93 116.57 117.20 3g1u h LYS 161 Ca 0.11 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 3g1u h LYS 161 Cb 0.38 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.47 3g1u h LYS 161 CO 0.01 0.52 0.57 -0.97 -0.57 0.00 0.00 179.45 179.01 3g1u h ASN 162 N 0.80 0.95 -0.04 0.86 -1.24 -0.58 -1.14 115.58 115.18 3g1u h ASN 162 Ca 0.36 -0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.35 3g1u h ASN 162 Cb 0.27 -0.22 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 3g1u h ASN 162 CO -0.21 0.66 -0.03 -0.07 -1.29 0.00 0.00 177.43 176.48 3g1u h LEU 163 N 1.10 0.10 -1.20 0.34 3.38 -0.55 -1.56 115.31 116.93 3g1u h LEU 163 Ca 0.34 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.86 3g1u h LEU 163 Cb 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 3g1u h LEU 163 CO -0.10 0.54 0.52 1.88 0.09 0.00 0.00 178.44 181.37 3g1u h TYR 164 N -0.33 1.01 0.62 1.13 0.05 -1.32 0.19 116.97 118.32 3g1u h TYR 164 Ca 0.01 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.78 3g1u h TYR 164 Cb 0.50 -0.34 0.01 0.00 1.01 0.00 0.00 36.73 37.91 3g1u h TYR 164 CO 0.08 0.64 -0.30 -0.22 -1.05 0.00 0.00 178.16 177.32 3g1u h LYS 165 N 1.09 -0.80 -0.42 4.88 3.64 -1.17 -1.83 116.57 121.95 3g1u h LYS 165 Ca 0.29 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.80 3g1u h LYS 165 Cb -0.11 0.18 -0.09 0.00 -0.41 0.00 0.00 32.23 31.80 3g1u h LYS 165 CO -0.06 -0.51 -0.44 0.00 -2.27 0.00 0.00 179.45 176.17 3g1u h ARG 166 N -0.91 -0.31 -0.40 1.90 3.08 -0.94 -2.72 114.38 114.07 3g1u h ARG 166 Ca -0.09 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.07 3g1u h ARG 166 Cb 0.66 0.07 -0.09 0.00 0.08 0.00 0.00 29.97 30.69 3g1u h ARG 166 CO 0.14 -0.21 -0.28 1.25 -1.07 0.00 0.00 179.97 179.80 3g1u h LEU 167 N -0.32 -0.95 -1.07 3.04 5.85 -0.50 0.01 115.31 121.37 3g1u h LEU 167 Ca 0.14 0.18 0.00 0.00 0.84 0.00 0.00 57.88 59.04 3g1u h LEU 167 Cb 0.58 0.46 0.00 0.00 0.37 0.00 0.00 40.66 42.08 3g1u h LEU 167 CO -0.59 -0.29 0.00 -1.54 -0.34 0.00 0.00 178.44 175.68 3g1u n SER 168 N -5.41 0.42 -0.73 1.25 3.41 -0.70 -0.52 113.62 111.35 3g1u n SER 168 Ca 0.02 0.70 0.06 0.00 -0.26 0.00 0.00 58.87 59.39 3g1u n SER 168 Cb 0.33 -0.75 0.19 0.00 -0.26 0.00 0.00 64.21 63.71 3g1u n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3g1u n LYS 169 N -2.07 2.91 -1.56 4.33 5.02 -0.14 -4.97 118.16 121.68 3g1u n LYS 169 Ca -0.01 -2.28 -0.12 0.00 -2.02 0.00 0.00 58.31 53.88 3g1u n LYS 169 Cb 0.03 -1.44 -0.04 0.00 -0.02 0.00 0.00 35.03 33.56 3g1u n LYS 169 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g1u n GLY 170 N 0.25 0.97 1.35 0.72 0.00 0.32 -4.92 105.19 103.88 3g1u n GLY 170 Ca 0.14 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.05 4.16 -4.03 1.61 3.02 -0.42 -4.81 115.26 114.75 3g1u n ASN 171 Ca -0.13 -3.18 -0.33 0.00 -0.03 0.00 0.00 54.58 50.91 3g1u n ASN 171 Cb 0.45 -0.63 -0.12 0.00 -0.61 0.00 0.00 39.78 38.87 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 -2.93 4.81 0.00 3.41 2.96 -1.25 -4.74 118.68 120.94 3g1u s LEU 172 Ca 0.48 -2.79 0.23 0.00 -0.22 0.00 0.00 54.13 51.82 3g1u s LEU 172 Cb 0.39 -1.74 0.56 0.00 0.50 0.00 0.00 46.19 45.89 3g1u s LEU 172 CO 0.10 -0.33 1.46 -0.81 -1.32 0.00 0.00 176.35 175.45 3g1u n PRO 173 N 3.49 2.13 -5.15 0.98 -0.04 -1.26 -4.41 135.00 130.73 3g1u n PRO 173 Ca 0.06 -1.68 -0.30 0.00 -0.04 0.00 0.00 63.50 61.54 3g1u n PRO 173 Cb 0.36 -1.46 -0.16 0.00 -0.04 0.00 0.00 33.50 32.20 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 -1.74 1.87 0.35 0.52 1.01 -1.26 0.01 121.20 121.94 3g1u s ILE 174 Ca 0.35 -0.97 -0.26 0.00 0.00 0.00 0.00 60.65 59.76 3g1u s ILE 174 Cb 0.20 -1.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.00 3g1u s ILE 174 CO 0.30 0.52 1.04 -0.44 0.00 0.00 0.00 174.94 176.37 3g1u s SER 175 N -0.19 7.03 -0.00 3.58 0.01 -1.22 -4.61 113.70 118.30 3g1u s SER 175 Ca -0.01 2.07 0.07 0.00 1.31 0.00 0.00 55.95 59.39 3g1u s SER 175 Cb -0.12 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.49 3g1u s SER 175 CO 0.02 -0.30 -0.21 0.00 0.41 0.00 0.00 173.24 173.17 3g1u s ALA 176 N -1.48 1.75 -0.31 1.44 0.00 -0.73 -1.01 121.76 121.42 3g1u s ALA 176 Ca 0.52 -0.94 -0.12 0.00 0.00 0.00 0.00 51.96 51.42 3g1u s ALA 176 Cb -0.25 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 3g1u s ALA 176 CO 0.31 0.42 0.23 0.42 0.00 0.00 0.00 175.76 177.14 3g1u s ILE 177 N -0.57 5.28 -0.70 0.00 1.01 0.14 -0.64 121.20 125.73 3g1u s ILE 177 Ca 0.08 0.05 -0.26 0.00 0.00 0.00 0.00 60.65 60.51 3g1u s ILE 177 Cb -0.08 -3.63 -0.02 0.00 0.01 0.00 0.00 42.46 38.74 3g1u s ILE 177 CO -0.00 0.12 1.80 0.21 0.00 0.00 0.00 174.94 177.07 3g1u s ASN 178 N 1.74 5.38 0.02 3.58 3.84 0.47 -1.88 114.94 128.09 3g1u s ASN 178 Ca 0.07 -0.01 0.04 0.00 0.21 0.00 0.00 52.86 53.17 3g1u s ASN 178 Cb -0.17 -2.54 -0.24 0.00 -0.55 0.00 0.00 41.25 37.75 3g1u s ASN 178 CO 0.11 -2.36 0.93 0.58 -2.79 0.00 0.00 177.10 173.56 3g1u h VAL 179 N 6.87 1.23 -0.90 -5.21 2.07 -1.71 -3.35 116.25 115.25 3g1u h VAL 179 Ca -0.17 -2.96 0.24 0.00 0.82 0.00 0.00 66.70 64.63 3g1u h VAL 179 Cb 1.11 2.69 -0.14 0.00 -1.52 0.00 0.00 31.29 33.44 3g1u h VAL 179 CO 1.23 0.78 0.34 -1.13 0.02 0.00 0.00 177.57 178.81 3g1u h ASN 180 N 0.03 0.19 -3.34 0.57 -1.24 -1.54 -3.43 115.58 106.82 3g1u h ASN 180 Ca -0.19 0.18 -0.76 0.00 0.71 0.00 0.00 56.30 56.24 3g1u h ASN 180 Cb 1.94 0.20 -0.31 0.00 0.73 0.00 0.00 38.32 40.88 3g1u h ASN 180 CO 0.13 -0.10 0.29 0.47 -1.29 0.00 0.00 177.43 176.93 3g1u n ASP 181 N -5.14 5.16 0.00 1.15 8.00 -1.26 -1.01 116.55 123.46 3g1u n ASP 181 Ca 0.23 -3.14 0.00 0.00 0.71 0.00 0.00 54.79 52.59 3g1u n ASP 181 Cb 0.72 -1.23 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 3g1u n ASP 181 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3g1u n LYS 185 N 2.29 0.00 0.08 -1.24 0.00 -1.26 -5.01 118.16 113.02 3g1u n LYS 185 Ca 0.24 0.00 0.04 0.00 0.00 0.00 0.00 58.31 58.59 3g1u n LYS 185 Cb 0.38 0.00 0.44 0.00 0.00 0.00 0.00 35.03 35.84 3g1u n LYS 185 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 3g1u h SER 186 N 0.00 0.32 0.38 3.14 4.64 -1.34 0.91 113.55 121.60 3g1u h SER 186 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3g1u h SER 186 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3g1u h SER 186 CO 0.00 0.32 0.00 0.11 -0.87 0.00 0.00 176.83 176.39 3g1u h LYS 187 N 0.36 0.00 0.00 4.77 1.57 -1.95 -3.03 116.57 118.28 3g1u h LYS 187 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3g1u h LYS 187 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3g1u h LYS 187 CO -0.01 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.06 3g1u n PHE 188 N -2.72 0.00 -0.27 -1.35 3.72 0.45 -4.50 117.46 112.79 3g1u n PHE 188 Ca -0.01 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.33 3g1u n PHE 188 Cb 0.15 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.64 3g1u n PHE 188 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3g1u n ASP 189 N -1.59 -0.63 0.07 4.37 4.64 0.29 -1.41 116.55 122.29 3g1u n ASP 189 Ca 0.00 1.15 -0.09 0.00 -1.38 0.00 0.00 54.79 54.46 3g1u n ASP 189 Cb 0.00 -0.17 -0.06 0.00 -1.04 0.00 0.00 41.12 39.84 3g1u n ASP 189 CO 0.00 0.00 0.00 0.78 -0.82 0.00 0.00 177.20 177.16 3g1u h ASN 190 N 0.00 -0.22 0.36 1.67 4.21 -1.63 0.02 115.58 119.99 3g1u h ASN 190 Ca 0.13 -0.27 -0.02 0.00 1.21 0.00 0.00 56.30 57.35 3g1u h ASN 190 Cb 0.29 0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.55 3g1u h ASN 190 CO -0.61 0.32 -0.17 0.25 -1.29 0.00 0.00 177.43 175.92 3g1u h LEU 191 N -0.94 -0.41 -1.33 1.61 6.46 -1.62 -2.11 115.31 116.97 3g1u h LEU 191 Ca -0.03 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.73 3g1u h LEU 191 Cb 0.48 0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.48 3g1u h LEU 191 CO 0.04 -0.20 0.28 1.88 -0.62 0.00 0.00 178.44 179.83 3g1u h TYR 192 N -0.67 0.73 0.07 1.25 0.05 -1.38 -1.01 116.97 115.99 3g1u h TYR 192 Ca -0.05 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 3g1u h TYR 192 Cb 0.37 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 37.88 3g1u h TYR 192 CO 0.07 0.52 -0.03 0.78 -1.05 0.00 0.00 178.16 178.44 3g1u h GLY 193 N 0.83 -0.09 1.58 3.88 0.00 -0.88 -3.12 103.07 105.27 3g1u h GLY 193 Ca 0.19 0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.45 3g1u h GLY 193 CO -0.03 -0.03 -0.29 0.00 0.00 0.00 0.00 176.54 176.18 3g1u h ARG 195 N 0.42 0.00 0.00 0.00 2.43 -1.14 -0.37 114.38 115.72 3g1u h ARG 195 Ca 0.06 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.95 3g1u h ARG 195 Cb 0.72 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.22 3g1u h ARG 195 CO 0.06 0.00 -2.05 0.39 -1.51 0.00 0.00 179.97 176.85 3g1u n GLU 196 N -4.00 1.38 0.07 0.20 1.02 -0.90 -4.47 120.64 113.94 3g1u n GLU 196 Ca 0.11 0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.34 3g1u n GLU 196 Cb 0.73 -1.39 -0.04 0.00 -0.02 0.00 0.00 31.44 30.71 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 -2.63 0.75 0.36 1.62 3.41 -0.23 -3.52 113.62 113.38 3g1u n SER 197 Ca -0.26 0.30 -0.18 0.00 -0.26 0.00 0.00 58.87 58.47 3g1u n SER 197 Cb 0.98 0.53 -0.09 0.00 -0.26 0.00 0.00 64.21 65.37 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 -0.82 -1.20 1.04 5.85 -1.30 -1.88 115.31 117.00 3g1u h LEU 198 Ca -0.06 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 3g1u h LEU 198 Cb 1.19 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 3g1u h LEU 198 CO 0.01 -0.56 -0.38 0.58 -0.34 0.00 0.00 178.44 177.75 3g1u h VAL 199 N -0.92 1.16 -0.18 1.05 2.07 -1.79 -2.48 116.25 115.16 3g1u h VAL 199 Ca -0.09 -1.36 0.01 0.00 0.82 0.00 0.00 66.70 66.08 3g1u h VAL 199 Cb 0.72 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 3g1u h VAL 199 CO 0.13 0.38 0.08 -0.78 0.02 0.00 0.00 177.57 177.40 3g1u h ASP 200 N 0.00 0.11 -0.11 0.57 3.58 -1.57 0.11 116.42 119.11 3g1u h ASP 200 Ca -0.00 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 3g1u h ASP 200 Cb 0.73 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.76 3g1u h ASP 200 CO 0.05 0.09 0.07 1.23 -2.88 0.00 0.00 179.24 177.80 3g1u h GLY 201 N 0.18 0.17 0.83 -0.78 0.00 -1.00 -1.54 103.07 100.93 3g1u h GLY 201 Ca 0.07 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.36 3g1u h GLY 201 CO -0.06 0.07 0.31 -2.22 0.00 0.00 0.00 176.54 174.64 3g1u h ILE 202 N 0.11 1.03 -0.22 2.60 2.04 -1.29 -2.08 117.51 119.71 3g1u h ILE 202 Ca 0.04 -0.21 -0.17 0.00 1.00 0.00 0.00 64.86 65.53 3g1u h ILE 202 Cb 0.04 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3g1u h ILE 202 CO -0.01 0.11 -0.52 0.11 0.00 0.00 0.00 178.15 177.84 3g1u h LYS 203 N 0.60 0.74 -0.82 2.37 1.57 -0.86 0.15 116.57 120.32 3g1u h LYS 203 Ca 0.22 -0.50 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 3g1u h LYS 203 Cb 0.06 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 3g1u h LYS 203 CO -0.11 1.12 0.43 0.00 -0.57 0.00 0.00 179.45 180.33 3g1u h ARG 204 N 0.46 1.15 0.06 3.15 3.08 -1.24 0.59 114.38 121.62 3g1u h ARG 204 Ca -0.00 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 3g1u h ARG 204 Cb 1.13 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.96 3g1u h ARG 204 CO 0.11 0.86 -0.03 0.00 -1.07 0.00 0.00 179.97 179.85 3g1u h ALA 205 N 1.23 -0.08 0.00 0.04 0.00 -1.26 -3.41 119.26 115.79 3g1u h ALA 205 Ca 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3g1u h ALA 205 Cb 0.05 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3g1u h ALA 205 CO -0.04 -0.43 -0.52 0.25 0.00 0.00 0.00 179.25 178.50 3g1u n THR 206 N -5.02 0.00 -1.66 0.00 -2.24 0.03 -4.97 114.28 100.42 3g1u n THR 206 Ca -0.08 -0.21 -0.15 0.00 -2.27 0.00 0.00 64.05 61.34 3g1u n THR 206 Cb 0.15 0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 69.04 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 -1.20 -4.09 -4.80 3.42 8.00 0.20 -4.94 116.55 113.14 3g1u n ASP 207 Ca 0.00 0.32 -0.34 0.00 0.71 0.00 0.00 54.79 55.48 3g1u n ASP 207 Cb 0.00 -3.68 -0.01 0.00 -0.02 0.00 0.00 41.12 37.40 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 -2.38 3.74 0.13 2.53 0.11 -1.26 -5.01 120.40 118.26 3g1u s VAL 208 Ca 0.00 0.98 -0.30 0.00 -2.93 0.00 0.00 61.98 59.73 3g1u s VAL 208 Cb 0.00 -3.41 -0.07 0.00 -1.53 0.00 0.00 36.38 31.37 3g1u s VAL 208 CO 0.00 -0.33 1.13 -0.32 -3.33 0.00 0.00 175.10 172.25 3g1u s MET 209 N -3.55 4.54 -0.10 1.54 1.75 -1.26 -4.87 119.30 117.35 3g1u s MET 209 Ca 0.66 1.73 -0.20 0.00 -1.25 0.00 0.00 55.69 56.63 3g1u s MET 209 Cb -0.17 -3.30 -0.27 0.00 2.84 0.00 0.00 34.83 33.92 3g1u s MET 209 CO 0.27 -0.04 0.64 0.82 -0.65 0.00 0.00 175.02 176.06 3g1u h ILE 210 N 4.01 1.27 -1.76 10.11 1.08 -1.95 -3.44 117.51 126.83 3g1u h ILE 210 Ca -0.43 -2.41 -0.67 0.00 -0.39 0.00 0.00 64.86 60.96 3g1u h ILE 210 Cb 1.21 2.90 0.06 0.00 -3.07 0.00 0.00 36.82 37.92 3g1u h ILE 210 CO 0.75 0.65 0.46 0.00 -0.69 0.00 0.00 178.15 179.32 3g1u n ALA 211 N -2.88 -0.76 0.00 1.87 0.00 -1.03 -1.66 120.51 116.05 3g1u n ALA 211 Ca -0.20 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.74 3g1u n ALA 211 Cb 0.79 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 18.15 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 2.54 2.14 3.86 0.00 0.00 -0.71 -4.90 105.19 108.11 3g1u n GLY 212 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.47 3.83 -0.19 1.61 -0.14 -0.66 -4.87 119.74 118.84 3g1u s LYS 213 Ca 0.00 0.76 -0.09 0.00 -1.36 0.00 0.00 55.97 55.28 3g1u s LYS 213 Cb 0.00 -2.21 -0.04 0.00 -1.68 0.00 0.00 37.83 33.90 3g1u s LYS 213 CO 0.00 -0.25 0.09 0.99 -0.76 0.00 0.00 175.35 175.42 3g1u s THR 214 N -2.65 5.05 -0.04 2.17 2.01 -1.26 -0.44 115.64 120.49 3g1u s THR 214 Ca 0.56 0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.67 3g1u s THR 214 Cb -0.10 -3.29 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 3g1u s THR 214 CO 0.35 0.44 -0.21 0.00 -0.69 0.00 0.00 174.62 174.52 3g1u s VAL 217 N 1.64 4.26 -0.26 0.00 1.01 0.11 -0.42 120.40 126.74 3g1u s VAL 217 Ca 0.04 -0.50 -0.15 0.00 0.00 0.00 0.00 61.98 61.37 3g1u s VAL 217 Cb -0.19 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 3g1u s VAL 217 CO 0.09 0.12 0.37 0.00 0.00 0.00 0.00 175.10 175.68 3g1u n GLY 219 N 4.58 -0.29 2.67 0.00 0.00 0.13 -1.38 105.19 110.90 3g1u n GLY 219 Ca -0.09 -1.48 -0.08 0.00 0.00 0.00 0.00 46.02 44.38 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 0.37 0.26 -0.88 1.61 9.36 -1.26 -4.40 117.16 122.23 3g1u n TYR 220 Ca 0.00 -2.56 0.00 0.00 3.32 0.00 0.00 57.90 58.66 3g1u n TYR 220 Cb 0.00 0.11 0.00 0.00 -0.63 0.00 0.00 39.34 38.82 3g1u n TYR 220 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3g1u n GLY 221 N -0.22 -0.16 0.37 2.98 0.00 -1.26 -4.67 105.19 102.23 3g1u n GLY 221 Ca 0.06 -1.76 0.03 0.00 0.00 0.00 0.00 46.02 44.36 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 0.00 0.99 0.12 1.61 3.32 -1.95 -0.57 116.42 119.94 3g1u h ASP 222 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3g1u h ASP 222 Cb 0.00 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3g1u h ASP 222 CO 0.00 0.63 -0.06 0.58 -1.72 0.00 0.00 179.24 178.68 3g1u h VAL 223 N 1.13 0.98 -0.68 -1.35 2.07 -1.90 -1.67 116.25 114.83 3g1u h VAL 223 Ca 0.42 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.58 3g1u h VAL 223 Cb 0.19 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3g1u h VAL 223 CO -0.17 0.09 0.45 1.23 0.02 0.00 0.00 177.57 179.20 3g1u h GLY 224 N -0.33 0.96 0.96 2.17 0.00 -1.68 0.09 103.07 105.24 3g1u h GLY 224 Ca -0.02 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 3g1u h GLY 224 CO 0.03 0.34 0.11 0.50 0.00 0.00 0.00 176.54 177.51 3g1u h LYS 225 N 0.91 0.74 -0.46 4.80 1.57 -0.92 0.86 116.57 124.07 3g1u h LYS 225 Ca 0.25 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 3g1u h LYS 225 Cb -0.08 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 3g1u h LYS 225 CO -0.06 0.74 -0.01 0.78 -0.57 0.00 0.00 179.45 180.33 3g1u h GLY 226 N 0.62 0.89 1.09 3.86 0.00 -0.88 -1.52 103.07 107.13 3g1u h GLY 226 Ca 0.14 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.71 3g1u h GLY 226 CO 0.00 0.61 -0.03 0.00 0.00 0.00 0.00 176.54 177.13 3g1u h ALA 228 N 0.97 0.80 -0.53 0.00 0.00 -0.78 -2.62 119.26 117.10 3g1u h ALA 228 Ca 0.16 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 3g1u h ALA 228 Cb 0.59 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3g1u h ALA 228 CO 0.04 0.62 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 3g1u h ALA 229 N 0.99 0.82 0.27 0.00 0.00 -1.08 -1.39 119.26 118.87 3g1u h ALA 229 Ca 0.17 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3g1u h ALA 229 Cb 0.53 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3g1u h ALA 229 CO 0.03 0.66 -0.19 0.00 0.00 0.00 0.00 179.25 179.74 3g1u h ALA 230 N 0.99 -0.45 -0.35 0.00 0.00 -1.21 -1.13 119.26 117.12 3g1u h ALA 230 Ca 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3g1u h ALA 230 Cb 0.65 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3g1u h ALA 230 CO 0.04 -0.77 0.12 -0.07 0.00 0.00 0.00 179.25 178.58 3g1u h LEU 231 N -0.46 0.50 -0.89 0.00 3.38 -1.38 -2.95 115.31 113.51 3g1u h LEU 231 Ca -0.02 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.78 3g1u h LEU 231 Cb 0.40 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 3g1u h LEU 231 CO 0.00 0.56 0.58 -0.09 0.09 0.00 0.00 178.44 179.59 3g1u h ARG 232 N 0.42 1.13 -0.97 1.13 2.43 -1.19 -2.10 114.38 115.23 3g1u h ARG 232 Ca 0.11 -0.07 0.14 0.00 -0.81 0.00 0.00 59.98 59.35 3g1u h ARG 232 Cb 0.23 -0.25 -0.08 0.00 -0.42 0.00 0.00 29.97 29.45 3g1u h ARG 232 CO -0.01 0.75 0.61 0.00 -1.51 0.00 0.00 179.97 179.81 3g1u h ALA 233 N 1.35 1.65 -0.11 2.80 0.00 -1.03 -0.37 119.26 123.56 3g1u h ALA 233 Ca 0.34 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3g1u h ALA 233 Cb -0.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3g1u h ALA 233 CO -0.10 0.10 0.00 1.19 0.00 0.00 0.00 179.25 180.44 3g1u n PHE 234 N -4.61 0.13 -0.35 0.00 3.72 -0.94 -4.90 117.46 110.51 3g1u n PHE 234 Ca 0.19 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.52 3g1u n PHE 234 Cb 0.42 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 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 0.97 0.79 3.87 1.37 0.00 -0.15 -2.46 105.19 109.59 3g1u n GLY 235 Ca 0.14 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 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 3.38 -0.25 4.61 0.00 -0.83 -1.75 121.76 124.92 3g1u s ALA 236 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 51.96 51.62 3g1u s ALA 236 Cb 0.00 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 20.41 3g1u s ALA 236 CO 0.00 0.06 0.25 0.50 0.00 0.00 0.00 175.76 176.56 3g1u s ARG 237 N -3.71 4.06 -0.18 0.00 3.52 0.41 -4.20 118.95 118.85 3g1u s ARG 237 Ca 0.51 -0.14 -0.05 0.00 -0.13 0.00 0.00 55.73 55.92 3g1u s ARG 237 Cb -0.10 -3.58 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 3g1u s ARG 237 CO 0.30 -0.06 0.00 0.08 -0.81 0.00 0.00 175.30 174.81 3g1u s VAL 238 N 1.41 4.16 -0.18 7.11 1.01 -1.26 0.19 120.40 132.84 3g1u s VAL 238 Ca 0.11 -0.25 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 3g1u s VAL 238 Cb -0.15 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 3g1u s VAL 238 CO 0.07 0.46 0.01 -0.69 0.00 0.00 0.00 175.10 174.96 3g1u s VAL 239 N 0.55 4.30 -0.06 2.92 1.01 0.12 -3.94 120.40 125.30 3g1u s VAL 239 Ca -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 3g1u s VAL 239 Cb -0.14 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 3g1u s VAL 239 CO 0.02 0.46 0.07 -0.69 0.00 0.00 0.00 175.10 174.96 3g1u s VAL 240 N 0.51 4.80 0.06 2.92 1.01 -0.01 -0.71 120.40 128.97 3g1u s VAL 240 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.87 3g1u s VAL 240 Cb -0.14 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 3g1u s VAL 240 CO 0.02 0.51 -0.16 0.42 0.00 0.00 0.00 175.10 175.89 3g1u s THR 241 N -1.05 2.93 -0.03 3.92 -4.23 -0.34 -1.08 115.64 115.77 3g1u s THR 241 Ca 0.18 -1.21 -0.23 0.00 -1.18 0.00 0.00 61.69 59.25 3g1u s THR 241 Cb -0.12 -2.27 0.05 0.00 1.34 0.00 0.00 72.50 71.50 3g1u s THR 241 CO 0.07 0.28 0.51 -1.61 -0.54 0.00 0.00 174.62 173.33 3g1u s GLU 242 N -1.62 0.88 -0.02 3.99 0.41 -1.26 0.19 118.70 121.28 3g1u s GLU 242 Ca 0.16 0.04 0.16 0.00 -0.41 0.00 0.00 54.97 54.92 3g1u s GLU 242 Cb -0.11 0.41 -0.24 0.00 -1.78 0.00 0.00 34.13 32.41 3g1u s GLU 242 CO 0.07 -0.27 0.39 1.33 -0.49 0.00 0.00 175.26 176.30 3g1u n VAL 243 N 1.05 0.00 -3.56 2.63 0.24 -1.26 -4.95 118.33 112.48 3g1u n VAL 243 Ca -0.20 -0.34 -0.37 0.00 -2.04 0.00 0.00 64.34 61.39 3g1u n VAL 243 Cb 0.57 0.24 -0.09 0.00 -1.47 0.00 0.00 33.84 33.09 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 -3.68 6.20 0.36 -1.34 -1.08 -1.26 -4.99 116.67 110.87 3g1u s ASP 244 Ca -0.04 0.21 0.04 0.00 -0.52 0.00 0.00 52.55 52.23 3g1u s ASP 244 Cb 0.10 -2.15 0.69 0.00 -1.46 0.00 0.00 42.92 40.11 3g1u s ASP 244 CO 0.67 -0.00 2.01 1.55 0.52 0.00 0.00 175.17 179.91 3g1u h PRO 245 N 7.63 0.77 0.76 4.34 0.13 -1.99 -1.49 132.00 142.15 3g1u h PRO 245 Ca -0.37 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.68 3g1u h PRO 245 Cb 1.17 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 32.13 3g1u h PRO 245 CO 0.66 0.51 -0.36 0.82 -0.23 0.00 0.00 178.00 179.39 3g1u h ILE 246 N 0.79 0.24 -0.95 -3.56 2.04 -2.00 -1.76 117.51 112.31 3g1u h ILE 246 Ca 0.23 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 66.10 3g1u h ILE 246 Cb -0.05 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 36.22 3g1u h ILE 246 CO -0.05 0.00 0.61 0.78 0.00 0.00 0.00 178.15 179.49 3g1u h ASN 247 N -1.05 0.98 -0.72 1.72 4.21 -1.86 -1.94 115.58 116.91 3g1u h ASN 247 Ca -0.10 0.01 0.02 0.00 1.21 0.00 0.00 56.30 57.44 3g1u h ASN 247 Cb 0.79 -0.20 -0.04 0.00 -1.12 0.00 0.00 38.32 37.75 3g1u h ASN 247 CO 0.17 0.63 0.47 0.00 -1.29 0.00 0.00 177.43 177.40 3g1u h ALA 248 N 1.43 0.93 -0.46 -0.83 0.00 -1.20 -1.02 119.26 118.11 3g1u h ALA 248 Ca 0.41 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 3g1u h ALA 248 Cb 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3g1u h ALA 248 CO -0.17 0.29 0.08 1.25 0.00 0.00 0.00 179.25 180.70 3g1u h LEU 249 N 0.93 0.73 -0.37 0.00 5.85 -1.01 -1.82 115.31 119.62 3g1u h LEU 249 Ca 0.28 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.79 3g1u h LEU 249 Cb -0.05 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.74 3g1u h LEU 249 CO -0.08 0.80 0.09 1.56 -0.34 0.00 0.00 178.44 180.47 3g1u h GLN 250 N 0.63 0.21 -0.58 1.25 4.20 -1.07 0.10 115.11 119.86 3g1u h GLN 250 Ca 0.14 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.87 3g1u h GLN 250 Cb 0.38 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 3g1u h GLN 250 CO 0.01 0.14 0.34 0.00 -0.67 0.00 0.00 178.83 178.64 3g1u h ALA 251 N 1.27 0.75 -0.82 3.87 0.00 -1.08 -0.70 119.26 122.55 3g1u h ALA 251 Ca 0.18 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3g1u h ALA 251 Cb 0.20 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3g1u h ALA 251 CO -0.22 0.04 0.39 1.03 0.00 0.00 0.00 179.25 180.49 3g1u h SER 252 N 0.66 1.07 0.93 0.00 0.87 -1.03 -1.36 113.55 114.68 3g1u h SER 252 Ca 0.24 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 3g1u h SER 252 Cb 0.06 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 3g1u h SER 252 CO -0.12 0.91 0.00 0.23 -0.53 0.00 0.00 176.83 177.32 3g1u n MET 253 N -4.31 0.17 -0.15 2.24 2.00 0.33 -2.32 117.12 115.08 3g1u n MET 253 Ca 0.08 0.30 0.11 0.00 0.00 0.00 0.00 57.70 58.19 3g1u n MET 253 Cb 0.14 -1.77 0.27 0.00 0.00 0.00 0.00 33.22 31.87 3g1u n MET 253 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 3g1u n GLU 254 N -2.07 2.21 -0.35 0.03 -0.58 -0.34 -4.95 120.64 114.59 3g1u n GLU 254 Ca 0.04 -1.83 0.00 0.00 -0.42 0.00 0.00 57.16 54.95 3g1u n GLU 254 Cb 0.29 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.69 3g1u n GLU 254 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g1u n GLY 255 N 1.36 0.81 3.76 0.62 0.00 -0.98 -5.06 105.19 105.70 3g1u n GLY 255 Ca 0.18 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 3.35 0.22 1.61 2.02 -0.81 -5.02 117.35 116.71 3g1u s TYR 256 Ca 0.00 0.32 -0.30 0.00 -0.37 0.00 0.00 57.07 56.72 3g1u s TYR 256 Cb 0.00 -1.87 -0.09 0.00 -0.40 0.00 0.00 41.96 39.60 3g1u s TYR 256 CO 0.00 0.55 1.31 -1.14 -1.57 0.00 0.00 175.55 174.70 3g1u s GLN 257 N -0.84 4.39 -0.22 -0.62 0.74 -1.25 -3.92 119.66 117.93 3g1u s GLN 257 Ca 0.13 2.08 -0.05 0.00 0.05 0.00 0.00 55.36 57.57 3g1u s GLN 257 Cb -0.12 -3.17 -0.02 0.00 1.10 0.00 0.00 33.01 30.80 3g1u s GLN 257 CO 0.03 -0.23 0.01 0.08 -0.55 0.00 0.00 175.29 174.63 3g1u s VAL 258 N -0.11 3.94 0.18 1.34 1.01 -1.26 -0.83 120.40 124.67 3g1u s VAL 258 Ca 0.55 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.22 3g1u s VAL 258 Cb -0.37 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3g1u s VAL 258 CO 0.40 0.40 0.25 0.00 0.00 0.00 0.00 175.10 176.16 3g1u n ALA 259 N 4.54 -0.18 -2.53 5.51 0.00 -0.24 -4.97 120.51 122.65 3g1u n ALA 259 Ca -0.17 -0.83 -0.27 0.00 0.00 0.00 0.00 53.44 52.17 3g1u n ALA 259 Cb 0.51 0.67 -0.02 0.00 0.00 0.00 0.00 19.45 20.61 3g1u n ALA 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g1u s LEU 260 N 0.00 3.99 0.31 0.00 1.43 -1.26 -4.19 118.68 118.96 3g1u s LEU 260 Ca 0.15 0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.93 3g1u s LEU 260 Cb -0.01 -3.51 0.59 0.00 0.03 0.00 0.00 46.19 43.30 3g1u s LEU 260 CO 0.11 -0.28 1.90 0.58 0.23 0.00 0.00 176.35 178.89 3g1u h VAL 261 N 1.01 1.02 0.00 -1.59 2.07 -1.95 -2.10 116.25 114.71 3g1u h VAL 261 Ca -0.48 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3g1u h VAL 261 Cb 1.20 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3g1u h VAL 261 CO 0.64 0.18 0.00 1.05 0.02 0.00 0.00 177.57 179.45 3g1u h GLU 262 N 0.96 0.00 -0.09 1.57 9.09 -1.98 0.71 114.58 124.84 3g1u h GLU 262 Ca 0.40 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.74 3g1u h GLU 262 Cb 0.30 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.39 3g1u h GLU 262 CO -0.16 0.00 -0.30 -0.44 0.05 0.00 0.00 179.01 178.16 3g1u h ASP 263 N 0.00 0.16 0.00 3.06 3.32 -1.77 -3.35 116.42 117.84 3g1u h ASP 263 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3g1u h ASP 263 Cb 0.67 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.17 3g1u h ASP 263 CO 0.00 0.46 0.00 1.33 -1.72 0.00 0.00 179.24 179.31 3g1u n VAL 264 N -4.14 0.07 0.27 -1.35 0.24 -0.94 -4.79 118.33 107.69 3g1u n VAL 264 Ca -0.01 -0.48 0.11 0.00 -2.04 0.00 0.00 64.34 61.91 3g1u n VAL 264 Cb 0.38 1.07 0.75 0.00 -1.47 0.00 0.00 33.84 34.56 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 -1.01 -0.69 114.93 120.56 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 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.70 3g1u h MET 265 CO 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 176.91 176.58 3g1u h ALA 266 N 2.00 0.83 0.00 -3.00 0.00 -1.85 -3.35 119.26 113.88 3g1u h ALA 266 Ca -0.00 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 3g1u h ALA 266 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 3g1u h ALA 266 CO 0.00 0.00 -2.17 -0.25 0.00 0.00 0.00 179.25 176.84 3g1u n ASP 267 N -2.96 0.71 -4.73 0.00 8.00 -0.74 -3.98 116.55 112.85 3g1u n ASP 267 Ca 0.03 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.11 3g1u n ASP 267 Cb 0.54 1.00 -0.03 0.00 -0.02 0.00 0.00 41.12 42.61 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 -2.49 3.57 0.06 2.24 0.00 -0.34 -4.73 121.76 120.06 3g1u s ALA 268 Ca -0.08 1.15 0.09 0.00 0.00 0.00 0.00 51.96 53.11 3g1u s ALA 268 Cb 0.06 -3.51 -0.20 0.00 0.00 0.00 0.00 23.12 19.46 3g1u s ALA 268 CO 0.72 -0.59 1.13 0.45 0.00 0.00 0.00 175.76 177.46 3g1u h HIS 269 N 5.87 0.00 -3.92 0.00 3.86 -1.06 -3.43 115.15 116.47 3g1u h HIS 269 Ca -0.44 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.43 3g1u h HIS 269 Cb 1.21 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 29.40 3g1u h HIS 269 CO 0.63 0.96 -0.76 0.42 0.86 0.00 0.00 177.93 180.04 3g1u s ILE 270 N -2.70 0.48 -0.12 2.45 1.01 -1.09 -0.20 121.20 121.03 3g1u s ILE 270 Ca -0.00 -0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.42 3g1u s ILE 270 Cb 0.09 -0.41 0.00 0.00 0.01 0.00 0.00 42.46 42.15 3g1u s ILE 270 CO 0.82 0.14 -0.22 -0.36 0.00 0.00 0.00 174.94 175.32 3g1u s PHE 271 N -0.11 2.63 -0.13 3.97 0.08 0.86 -1.03 117.98 124.26 3g1u s PHE 271 Ca 0.02 -1.11 0.00 0.00 0.12 0.00 0.00 56.93 55.96 3g1u s PHE 271 Cb -0.03 -1.77 0.02 0.00 -0.57 0.00 0.00 43.02 40.68 3g1u s PHE 271 CO -0.00 -0.47 -0.11 0.08 -0.10 0.00 0.00 175.22 174.62 3g1u s VAL 272 N 0.53 1.26 -0.16 -0.44 1.01 0.44 -1.24 120.40 121.80 3g1u s VAL 272 Ca -0.13 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 3g1u s VAL 272 Cb -0.17 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.94 3g1u s VAL 272 CO 0.04 0.41 0.21 0.42 0.00 0.00 0.00 175.10 176.18 3g1u s THR 273 N 1.56 5.36 0.00 3.92 -4.23 -0.87 -0.66 115.64 120.73 3g1u s THR 273 Ca 0.04 0.37 0.09 0.00 -1.18 0.00 0.00 61.69 61.01 3g1u s THR 273 Cb -0.13 -3.54 0.15 0.00 1.34 0.00 0.00 72.50 70.32 3g1u s THR 273 CO -0.09 0.45 1.04 0.35 -0.54 0.00 0.00 174.62 175.83 3g1u n THR 274 N 3.25 0.00 0.05 3.99 -2.24 -0.48 -1.81 114.28 117.05 3g1u n THR 274 Ca -0.15 -0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 61.28 3g1u n THR 274 Cb 0.52 0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 69.33 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 6.87 0.72 -0.11 4.28 1.35 -1.92 -3.42 112.91 120.68 3g1u h THR 275 Ca -0.09 -2.25 -0.05 0.00 -0.55 0.00 0.00 66.41 63.48 3g1u h THR 275 Cb 1.55 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 70.18 3g1u h THR 275 CO 0.03 0.41 -0.04 0.61 -0.25 0.00 0.00 175.52 176.27 3g1u n GLY 276 N 1.37 0.52 3.41 5.82 0.00 -1.26 -5.03 105.19 110.03 3g1u n GLY 276 Ca -0.07 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.30 3.03 0.34 1.61 2.47 -1.26 -5.00 114.94 113.83 3g1u s ASN 277 Ca 0.00 -1.06 -0.07 0.00 0.42 0.00 0.00 52.86 52.15 3g1u s ASN 277 Cb 0.00 -0.21 -0.06 0.00 -1.45 0.00 0.00 41.25 39.53 3g1u s ASN 277 CO 0.00 -0.13 0.64 -1.81 -3.72 0.00 0.00 177.10 172.09 3g1u s ASP 278 N -3.42 6.48 -0.83 -4.21 1.01 -1.26 -4.03 116.67 110.40 3g1u s ASP 278 Ca 0.27 0.89 -0.02 0.00 0.71 0.00 0.00 52.55 54.40 3g1u s ASP 278 Cb -0.01 -2.22 -0.02 0.00 1.01 0.00 0.00 42.92 41.68 3g1u s ASP 278 CO 0.11 -0.28 0.70 0.47 0.21 0.00 0.00 175.17 176.38 3g1u n ASP 279 N -1.09 -3.41 -0.08 0.27 8.00 -0.70 -4.90 116.55 114.64 3g1u n ASP 279 Ca -0.00 -0.48 -0.22 0.00 0.71 0.00 0.00 54.79 54.80 3g1u n ASP 279 Cb 0.54 -3.89 -0.12 0.00 -0.02 0.00 0.00 41.12 37.63 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 -3.06 1.59 -3.86 0.53 2.08 0.16 -4.82 119.36 111.98 3g1u n ILE 280 Ca -0.14 -0.19 -0.36 0.00 0.56 0.00 0.00 62.75 62.62 3g1u n ILE 280 Cb 0.61 -1.96 -0.14 0.00 -0.75 0.00 0.00 39.64 37.41 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 -2.42 3.49 0.36 1.39 -1.09 -0.83 -5.03 121.20 117.08 3g1u s ILE 281 Ca -0.28 -0.67 0.04 0.00 -2.23 0.00 0.00 60.65 57.50 3g1u s ILE 281 Cb 0.07 -2.71 -0.03 0.00 -1.58 0.00 0.00 42.46 38.20 3g1u s ILE 281 CO 0.62 0.25 0.14 0.42 -1.23 0.00 0.00 174.94 175.14 3g1u s THR 282 N 1.45 0.54 0.62 2.92 -4.23 -1.26 -0.71 115.64 114.97 3g1u s THR 282 Ca 0.03 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.81 3g1u s THR 282 Cb -0.16 -2.46 0.34 0.00 1.34 0.00 0.00 72.50 71.56 3g1u s THR 282 CO -0.01 0.00 1.75 0.77 -0.54 0.00 0.00 174.62 176.58 3g1u h SER 283 N 1.99 0.00 0.90 3.99 4.64 -1.99 0.51 113.55 123.59 3g1u h SER 283 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3g1u h SER 283 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3g1u h SER 283 CO 0.55 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.98 3g1u n ASP 284 N -3.36 0.38 -0.05 4.97 9.92 -1.26 -4.22 116.55 122.93 3g1u n ASP 284 Ca 0.08 0.57 -0.07 0.00 -0.53 0.00 0.00 54.79 54.83 3g1u n ASP 284 Cb 0.76 -0.66 -0.04 0.00 -0.64 0.00 0.00 41.12 40.54 3g1u n ASP 284 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 3g1u n HIS 285 N -1.89 0.00 -0.27 1.24 8.25 0.18 -4.76 115.22 117.96 3g1u n HIS 285 Ca 0.04 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.57 3g1u n HIS 285 Cb 0.28 -0.37 0.21 0.00 1.12 0.00 0.00 29.99 31.24 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 -0.06 0.58 0.00 4.41 0.04 -1.62 -1.46 116.94 118.83 3g1u h PHE 286 Ca -0.22 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.58 3g1u h PHE 286 Cb 1.31 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 39.33 3g1u h PHE 286 CO 0.00 0.07 0.00 -1.35 -0.60 0.00 0.00 178.31 176.43 3g1u h PRO 287 N 0.47 0.00 -0.02 1.51 0.11 -1.86 -2.70 132.00 129.51 3g1u h PRO 287 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 3g1u h PRO 287 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3g1u h PRO 287 CO -0.42 0.00 -0.09 0.72 -0.21 0.00 0.00 178.00 178.00 3g1u n HIS 288 N -2.33 0.00 -2.25 0.65 8.25 -0.56 -4.99 115.22 113.98 3g1u n HIS 288 Ca 0.01 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.07 3g1u n HIS 288 Cb 0.19 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.28 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 -1.87 4.29 0.94 -0.41 -1.94 -1.02 -3.93 119.30 115.36 3g1u s MET 289 Ca 0.23 1.99 -0.12 0.00 -1.71 0.00 0.00 55.69 56.08 3g1u s MET 289 Cb 0.17 -2.94 0.15 0.00 2.01 0.00 0.00 34.83 34.23 3g1u s MET 289 CO 0.32 -0.16 1.09 -0.98 -0.01 0.00 0.00 175.02 175.27 3g1u s ARG 290 N -1.92 0.91 0.22 2.03 1.70 -1.26 -4.93 118.95 115.71 3g1u s ARG 290 Ca 0.51 0.79 -0.31 0.00 -0.47 0.00 0.00 55.73 56.25 3g1u s ARG 290 Cb -0.35 -1.77 -0.11 0.00 -0.57 0.00 0.00 34.95 32.15 3g1u s ARG 290 CO 0.45 -2.47 1.62 0.34 -1.08 0.00 0.00 175.30 174.16 3g1u s ASP 291 N -3.33 6.47 -1.72 -2.89 2.15 -1.26 -2.58 116.67 113.50 3g1u s ASP 291 Ca 0.64 2.79 0.00 0.00 0.43 0.00 0.00 52.55 56.41 3g1u s ASP 291 Cb -0.19 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.82 3g1u s ASP 291 CO 0.58 -0.89 0.00 0.47 -0.17 0.00 0.00 175.17 175.16 3g1u n ASP 292 N 3.40 -5.60 -4.78 -0.34 8.00 -0.08 -4.90 116.55 112.24 3g1u n ASP 292 Ca 0.13 0.03 -0.41 0.00 0.71 0.00 0.00 54.79 55.25 3g1u n ASP 292 Cb 0.37 -4.66 -0.00 0.00 -0.02 0.00 0.00 41.12 36.81 3g1u n ASP 292 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1u s ALA 293 N -2.95 3.57 -0.21 2.24 0.00 -1.06 -4.61 121.76 118.73 3g1u s ALA 293 Ca 0.00 1.56 -0.08 0.00 0.00 0.00 0.00 51.96 53.44 3g1u s ALA 293 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 3g1u s ALA 293 CO 0.00 -1.04 0.08 0.42 0.00 0.00 0.00 175.76 175.22 3g1u s ILE 294 N -1.12 4.70 -0.16 0.00 1.01 0.72 -0.32 121.20 126.03 3g1u s ILE 294 Ca 0.53 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.12 3g1u s ILE 294 Cb -0.46 -3.15 -0.00 0.00 0.01 0.00 0.00 42.46 38.86 3g1u s ILE 294 CO 0.63 0.41 -0.15 -0.69 0.00 0.00 0.00 174.94 175.14 3g1u s VAL 295 N 0.84 2.69 0.17 2.92 1.01 0.87 -0.10 120.40 128.80 3g1u s VAL 295 Ca 0.04 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 3g1u s VAL 295 Cb -0.14 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 3g1u s VAL 295 CO 0.02 0.51 0.26 0.00 0.00 0.00 0.00 175.10 175.90 3g1u s ASN 297 N -3.00 1.15 0.00 0.00 2.47 -1.26 -2.04 114.94 112.26 3g1u s ASN 297 Ca 0.20 -0.18 0.00 0.00 0.42 0.00 0.00 52.86 53.30 3g1u s ASN 297 Cb 0.04 -0.19 0.00 0.00 -1.45 0.00 0.00 41.25 39.65 3g1u s ASN 297 CO 0.02 0.10 0.33 0.00 -3.72 0.00 0.00 177.10 173.83 3g1u n ILE 298 N 3.00 0.00 -1.52 -5.21 3.06 -0.75 -0.16 119.36 117.79 3g1u n ILE 298 Ca -0.15 -0.46 -0.30 0.00 -2.50 0.00 0.00 62.75 59.34 3g1u n ILE 298 Cb 0.56 1.06 0.08 0.00 0.54 0.00 0.00 39.64 41.88 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 -0.25 1.64 0.19 4.50 0.00 -1.21 -4.82 107.32 107.37 3g1u s GLY 299 Ca 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 44.72 44.53 3g1u s GLY 299 CO 0.00 0.31 1.79 0.84 0.00 0.00 0.00 173.10 176.04 3g1u h HIS 300 N -1.02 0.99 -3.25 1.90 2.76 -1.95 -3.38 115.15 111.21 3g1u h HIS 300 Ca -0.46 -0.04 -0.67 0.00 -2.20 0.00 0.00 60.37 57.00 3g1u h HIS 300 Cb 1.25 -0.31 -0.15 0.00 1.55 0.00 0.00 27.41 29.75 3g1u h HIS 300 CO 0.51 0.73 -0.61 -0.06 -1.30 0.00 0.00 177.93 177.21 3g1u s PHE 301 N -5.74 3.20 -0.31 5.26 0.08 -1.26 -4.71 117.98 114.51 3g1u s PHE 301 Ca -0.13 0.18 0.22 0.00 0.12 0.00 0.00 56.93 57.33 3g1u s PHE 301 Cb 0.14 -1.84 1.09 0.00 -0.57 0.00 0.00 43.02 41.84 3g1u s PHE 301 CO 0.80 0.44 1.67 -0.40 -0.10 0.00 0.00 175.22 177.62 3g1u n ASP 302 N 2.34 0.59 0.00 1.36 5.68 -1.26 -3.46 116.55 121.80 3g1u n ASP 302 Ca -0.18 0.73 0.07 0.00 -0.50 0.00 0.00 54.79 54.90 3g1u n ASP 302 Cb 0.54 -0.82 0.40 0.00 -1.14 0.00 0.00 41.12 40.09 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 -2.24 0.00 0.27 2.12 -2.24 -1.26 -2.40 114.28 108.52 3g1u n THR 303 Ca -0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 3g1u n THR 303 Cb 0.10 -0.47 0.74 0.00 -2.10 0.00 0.00 70.33 68.59 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 -5.99 -0.78 5.08 -1.69 -1.86 114.58 109.33 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 -0.26 0.00 0.50 0.00 0.00 28.75 28.99 3g1u h GLU 304 CO 0.00 0.08 -0.80 0.42 -1.00 0.00 0.00 179.01 177.71 3g1u s ILE 305 N -4.52 2.82 -1.38 3.13 1.01 -1.01 0.36 121.20 121.60 3g1u s ILE 305 Ca -0.04 -0.79 -0.13 0.00 0.00 0.00 0.00 60.65 59.69 3g1u s ILE 305 Cb 0.15 -2.11 0.09 0.00 0.01 0.00 0.00 42.46 40.59 3g1u s ILE 305 CO 0.60 0.57 2.04 0.00 0.00 0.00 0.00 174.94 178.15 3g1u n GLN 306 N 2.78 3.13 -0.19 2.79 6.02 0.11 -4.71 117.38 127.30 3g1u n GLN 306 Ca -0.17 -2.99 -0.08 0.00 -0.01 0.00 0.00 57.00 53.74 3g1u n GLN 306 Cb 0.52 -3.19 0.02 0.00 1.02 0.00 0.00 30.24 28.60 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 4.11 1.24 -0.74 5.09 2.07 -1.87 -2.10 116.25 124.05 3g1u h VAL 307 Ca 0.50 -0.86 0.16 0.00 0.82 0.00 0.00 66.70 67.31 3g1u h VAL 307 Cb 0.67 0.76 -0.13 0.00 -1.52 0.00 0.00 31.29 31.06 3g1u h VAL 307 CO 1.74 0.32 -0.09 1.23 0.02 0.00 0.00 177.57 180.79 3g1u h GLY 308 N 0.77 0.68 0.71 2.17 0.00 -1.98 0.00 103.07 105.43 3g1u h GLY 308 Ca 0.17 0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 3g1u h GLY 308 CO 0.00 -0.28 0.00 -0.25 0.00 0.00 0.00 176.54 176.01 3g1u h TRP 309 N 0.05 0.04 -0.38 5.60 7.01 -1.87 -2.38 115.95 124.02 3g1u h TRP 309 Ca 0.38 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.45 3g1u h TRP 309 Cb 0.63 -0.01 -0.08 0.00 -2.10 0.00 0.00 29.16 27.60 3g1u h TRP 309 CO -0.50 0.32 -0.19 1.25 -2.79 0.00 0.00 178.44 176.53 3g1u h LEU 310 N -0.26 -0.65 -1.09 0.65 5.85 -0.69 -0.42 115.31 118.70 3g1u h LEU 310 Ca 0.01 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 3g1u h LEU 310 Cb 0.31 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 3g1u h LEU 310 CO 0.00 -0.22 0.12 -0.33 -0.34 0.00 0.00 178.44 177.67 3g1u h GLU 311 N -0.13 0.76 0.00 1.25 5.08 -1.01 -0.71 114.58 119.83 3g1u h GLU 311 Ca 0.19 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 3g1u h GLU 311 Cb 0.41 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3g1u h GLU 311 CO -0.46 0.69 -0.26 0.00 -1.00 0.00 0.00 179.01 177.98 3g1u h ALA 312 N 1.39 0.85 0.00 3.43 0.00 -0.84 -3.34 119.26 120.76 3g1u h ALA 312 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3g1u h ALA 312 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3g1u h ALA 312 CO -0.00 0.33 -0.85 0.09 0.00 0.00 0.00 179.25 178.81 3g1u n ASN 313 N -3.20 0.84 -4.74 0.00 3.02 -0.23 -4.96 115.26 105.98 3g1u n ASN 313 Ca 0.02 -0.70 -0.41 0.00 -0.03 0.00 0.00 54.58 53.46 3g1u n ASN 313 Cb 0.60 1.12 -0.03 0.00 -0.61 0.00 0.00 39.78 40.86 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 -2.48 3.55 0.16 5.41 0.00 -0.31 -4.63 121.76 123.47 3g1u s ALA 314 Ca 0.04 1.17 0.15 0.00 0.00 0.00 0.00 51.96 53.32 3g1u s ALA 314 Cb 0.11 -3.50 0.47 0.00 0.00 0.00 0.00 23.12 20.20 3g1u s ALA 314 CO 0.60 -0.59 1.64 0.87 0.00 0.00 0.00 175.76 178.28 3g1u h LYS 315 N 5.11 0.00 -3.97 0.00 1.79 -1.01 -3.46 116.57 115.03 3g1u h LYS 315 Ca -0.45 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 57.80 3g1u h LYS 315 Cb 1.22 0.00 -0.24 0.00 -1.58 0.00 0.00 32.23 31.62 3g1u h LYS 315 CO 0.76 0.50 -0.72 -1.21 -1.08 0.00 0.00 179.45 177.70 3g1u s GLU 316 N -3.49 0.22 -0.03 3.15 2.02 -1.04 -4.98 118.70 114.55 3g1u s GLU 316 Ca 0.00 -0.35 0.03 0.00 0.02 0.00 0.00 54.97 54.67 3g1u s GLU 316 Cb 0.11 -0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.32 3g1u s GLU 316 CO 0.72 -0.01 -0.12 -1.58 0.02 0.00 0.00 175.26 174.30 3g1u s HIS 317 N -0.76 1.24 -0.10 1.61 5.65 -1.26 -0.53 115.29 121.14 3g1u s HIS 317 Ca -0.07 -0.34 -0.00 0.00 0.25 0.00 0.00 55.06 54.89 3g1u s HIS 317 Cb -0.05 -0.87 0.02 0.00 -1.18 0.00 0.00 32.58 30.50 3g1u s HIS 317 CO -0.00 -0.13 -0.07 0.08 -0.65 0.00 0.00 174.74 173.96 3g1u s VAL 318 N 0.18 0.94 -0.43 0.89 1.01 0.21 -5.00 120.40 118.19 3g1u s VAL 318 Ca -0.04 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 3g1u s VAL 318 Cb -0.10 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.33 3g1u s VAL 318 CO 0.01 0.35 1.41 -0.70 0.00 0.00 0.00 175.10 176.17 3g1u s GLU 319 N 1.62 3.54 0.12 2.72 2.12 -1.26 -1.33 118.70 126.23 3g1u s GLU 319 Ca 0.03 0.86 -0.16 0.00 0.36 0.00 0.00 54.97 56.06 3g1u s GLU 319 Cb -0.13 -4.04 -0.02 0.00 0.26 0.00 0.00 34.13 30.20 3g1u s GLU 319 CO -0.07 -1.62 1.64 0.82 -0.54 0.00 0.00 175.26 175.49 3g1u h ILE 320 N 6.46 1.21 -2.27 -3.70 1.08 -1.32 -3.47 117.51 115.51 3g1u h ILE 320 Ca -0.27 -0.70 0.20 0.00 -0.39 0.00 0.00 64.86 63.69 3g1u h ILE 320 Cb 1.10 0.99 -0.07 0.00 -3.07 0.00 0.00 36.82 35.77 3g1u h ILE 320 CO 1.10 0.24 0.56 -1.59 -0.69 0.00 0.00 178.15 177.78 3g1u s LYS 321 N -5.38 1.11 0.05 2.37 -2.85 -1.23 -5.05 119.74 108.77 3g1u s LYS 321 Ca -0.13 -0.65 -0.36 0.00 -1.00 0.00 0.00 55.97 53.83 3g1u s LYS 321 Cb 0.09 0.36 -0.15 0.00 -2.06 0.00 0.00 37.83 36.07 3g1u s LYS 321 CO 0.75 -0.51 1.55 -2.30 0.10 0.00 0.00 175.35 174.94 3g1u n PRO 322 N -0.54 1.66 -1.08 1.78 -0.02 -1.26 -1.73 135.00 133.80 3g1u n PRO 322 Ca -0.05 0.60 -0.03 0.00 -2.02 0.00 0.00 63.50 62.00 3g1u n PRO 322 Cb 0.61 -2.32 -0.01 0.00 -0.02 0.00 0.00 33.50 31.75 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 3.74 -0.32 -3.73 -0.52 3.00 -1.26 -4.97 117.38 113.31 3g1u n GLN 323 Ca 0.19 0.48 -0.29 0.00 -0.01 0.00 0.00 57.00 57.38 3g1u n GLN 323 Cb 0.23 -4.04 -0.16 0.00 0.00 0.00 0.00 30.24 26.27 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 -2.05 0.72 -0.10 5.09 1.01 -0.71 -0.37 120.40 123.99 3g1u s VAL 324 Ca 0.00 -1.02 0.03 0.00 0.00 0.00 0.00 61.98 60.99 3g1u s VAL 324 Cb 0.00 -1.39 0.01 0.00 0.00 0.00 0.00 36.38 35.00 3g1u s VAL 324 CO 0.00 -0.46 -0.21 -1.81 0.00 0.00 0.00 175.10 172.62 3g1u s ASP 325 N 1.73 2.81 -0.19 3.32 1.01 -0.57 -0.75 116.67 124.03 3g1u s ASP 325 Ca 0.04 -0.51 -0.06 0.00 0.71 0.00 0.00 52.55 52.74 3g1u s ASP 325 Cb -0.17 -1.29 -0.03 0.00 1.01 0.00 0.00 42.92 42.44 3g1u s ASP 325 CO -0.18 0.11 0.02 -0.60 0.21 0.00 0.00 175.17 174.73 3g1u s ARG 326 N 0.53 3.73 -0.11 8.23 3.52 -0.44 -0.50 118.95 133.91 3g1u s ARG 326 Ca -0.15 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.00 3g1u s ARG 326 Cb -0.17 -3.13 -0.01 0.00 -1.56 0.00 0.00 34.95 30.08 3g1u s ARG 326 CO 0.05 0.09 -0.16 0.71 -0.81 0.00 0.00 175.30 175.19 3g1u s TYR 327 N 0.81 2.73 -0.23 5.12 2.02 0.19 -0.62 117.35 127.37 3g1u s TYR 327 Ca 0.02 -0.71 -0.15 0.00 -0.37 0.00 0.00 57.07 55.86 3g1u s TYR 327 Cb -0.14 -1.79 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 3g1u s TYR 327 CO 0.02 -0.23 0.37 0.99 -1.57 0.00 0.00 175.55 175.12 3g1u s THR 328 N 0.25 5.21 0.59 -0.71 2.01 0.30 -0.27 115.64 123.03 3g1u s THR 328 Ca -0.11 0.61 -0.04 0.00 0.31 0.00 0.00 61.69 62.45 3g1u s THR 328 Cb -0.16 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.68 3g1u s THR 328 CO 0.06 0.23 0.88 -0.04 -0.69 0.00 0.00 174.62 175.05 3g1u s MET 329 N 1.57 2.72 0.39 4.92 1.00 -0.13 -0.41 119.30 129.35 3g1u s MET 329 Ca 0.16 -0.24 0.12 0.00 0.00 0.00 0.00 55.69 55.73 3g1u s MET 329 Cb -0.15 -2.32 0.92 0.00 0.00 0.00 0.00 34.83 33.28 3g1u s MET 329 CO 0.08 -0.77 1.91 1.49 0.00 0.00 0.00 175.02 177.73 3g1u h GLU 330 N -0.16 0.55 0.00 2.03 4.81 -1.88 0.56 114.58 120.49 3g1u h GLU 330 Ca -0.45 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3g1u h GLU 330 Cb 1.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3g1u h GLU 330 CO 0.59 0.36 0.00 0.27 -0.73 0.00 0.00 179.01 179.50 3g1u n ASN 331 N -4.51 0.00 0.00 1.04 0.23 -1.26 -4.86 115.26 105.90 3g1u n ASN 331 Ca 0.15 -0.05 0.00 0.00 -0.53 0.00 0.00 54.58 54.15 3g1u n ASN 331 Cb 0.46 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.03 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 -0.57 2.41 3.91 4.83 0.00 0.19 -5.05 105.19 110.91 3g1u n GLY 332 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.39 3.15 0.16 1.61 0.52 -1.26 -4.75 118.95 118.00 3g1u s ARG 333 Ca 0.00 0.08 0.07 0.00 -0.52 0.00 0.00 55.73 55.36 3g1u s ARG 333 Cb 0.00 -2.30 -0.04 0.00 0.52 0.00 0.00 34.95 33.13 3g1u s ARG 333 CO 0.00 -0.53 0.01 -1.01 0.02 0.00 0.00 175.30 173.80 3g1u s HIS 334 N -2.91 2.89 -0.07 -0.53 3.76 -1.26 -0.96 115.29 116.21 3g1u s HIS 334 Ca 0.52 -0.11 0.01 0.00 -0.15 0.00 0.00 55.06 55.33 3g1u s HIS 334 Cb -0.10 -1.41 0.02 0.00 1.11 0.00 0.00 32.58 32.19 3g1u s HIS 334 CO 0.45 0.51 -0.09 0.42 -0.85 0.00 0.00 174.74 175.19 3g1u s ILE 335 N -1.68 0.91 -0.33 0.60 1.01 0.63 -0.91 121.20 121.43 3g1u s ILE 335 Ca 0.28 -0.31 -0.13 0.00 0.00 0.00 0.00 60.65 60.48 3g1u s ILE 335 Cb -0.10 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.47 3g1u s ILE 335 CO 0.19 0.32 0.26 -0.63 0.00 0.00 0.00 174.94 175.07 3g1u s ILE 336 N 1.00 5.27 -0.05 2.92 1.01 0.56 -0.63 121.20 131.28 3g1u s ILE 336 Ca -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 3g1u s ILE 336 Cb -0.15 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 3g1u s ILE 336 CO -0.00 0.00 0.02 -0.22 0.00 0.00 0.00 174.94 174.74 3g1u s LEU 337 N 1.77 3.66 -0.08 2.97 2.96 0.35 -0.09 118.68 130.21 3g1u s LEU 337 Ca 0.07 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.13 3g1u s LEU 337 Cb -0.17 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 3g1u s LEU 337 CO 0.11 0.34 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.55 3g1u s LEU 338 N -1.22 2.57 -1.41 -0.68 1.43 -0.99 -1.51 118.68 116.88 3g1u s LEU 338 Ca 0.17 -0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 52.80 3g1u s LEU 338 Cb -0.12 -1.54 0.13 0.00 0.03 0.00 0.00 46.19 44.70 3g1u s LEU 338 CO 0.06 0.25 0.57 0.00 0.23 0.00 0.00 176.35 177.46 3g1u n ALA 339 N 2.95 -1.15 -4.23 4.21 0.00 0.49 -0.63 120.51 122.15 3g1u n ALA 339 Ca -0.18 -0.01 -0.37 0.00 0.00 0.00 0.00 53.44 52.89 3g1u n ALA 339 Cb 0.52 -2.76 -0.03 0.00 0.00 0.00 0.00 19.45 17.18 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 -3.89 -2.79 -0.77 0.00 4.76 -1.26 -0.51 118.16 113.70 3g1u n LYS 340 Ca 0.04 0.34 0.00 0.00 -2.87 0.00 0.00 58.31 55.82 3g1u n LYS 340 Cb 0.50 -5.05 0.00 0.00 -1.84 0.00 0.00 35.03 28.64 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 -1.32 1.14 3.87 0.72 0.00 0.19 -4.97 105.19 104.83 3g1u n GLY 341 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.12 3.26 -0.38 1.61 3.00 0.33 -4.17 118.95 122.47 3g1u s ARG 342 Ca 0.00 0.67 -0.41 0.00 0.00 0.00 0.00 55.73 55.99 3g1u s ARG 342 Cb 0.00 -2.05 -0.16 0.00 0.00 0.00 0.00 34.95 32.74 3g1u s ARG 342 CO 0.00 -0.80 1.93 1.47 0.00 0.00 0.00 175.30 177.90 3g1u n LEU 343 N -2.89 1.76 0.04 2.53 -0.00 -1.25 -4.56 117.00 112.64 3g1u n LEU 343 Ca 0.06 0.83 -0.06 0.00 -0.00 0.00 0.00 56.01 56.85 3g1u n LEU 343 Cb 0.55 -1.07 0.13 0.00 -0.00 0.00 0.00 43.42 43.03 3g1u n LEU 343 CO 0.58 -0.65 0.57 1.62 -0.00 0.00 0.00 177.39 179.51 3g1u h VAL 344 N 6.09 1.32 -0.46 1.47 3.04 -0.87 0.44 116.25 127.29 3g1u h VAL 344 Ca -0.32 -1.67 -0.05 0.00 -1.01 0.00 0.00 66.70 63.65 3g1u h VAL 344 Cb 1.35 1.71 -0.02 0.00 -2.01 0.00 0.00 31.29 32.32 3g1u h VAL 344 CO 1.01 0.51 0.10 -0.55 -1.01 0.00 0.00 177.57 177.63 3g1u h ASN 345 N 0.33 0.71 0.63 3.17 -1.07 -1.83 0.15 115.58 117.67 3g1u h ASN 345 Ca 0.02 -0.24 -0.25 0.00 0.07 0.00 0.00 56.30 55.90 3g1u h ASN 345 Cb 0.95 -0.19 -0.00 0.00 -2.07 0.00 0.00 38.32 37.01 3g1u h ASN 345 CO 0.08 0.77 -1.14 -0.07 0.07 0.00 0.00 177.43 177.14 3g1u h LEU 346 N 0.62 0.38 -0.03 6.14 3.38 -1.76 -1.33 115.31 122.71 3g1u h LEU 346 Ca 0.14 -0.38 -0.25 0.00 0.09 0.00 0.00 57.88 57.48 3g1u h LEU 346 Cb 0.34 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.98 3g1u h LEU 346 CO 0.00 1.26 -1.09 1.23 0.09 0.00 0.00 178.44 179.94 3g1u h GLY 347 N 1.72 0.43 -0.11 0.83 0.00 0.03 -3.36 103.07 102.62 3g1u h GLY 347 Ca -0.10 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.34 3g1u h GLY 347 CO 0.18 0.78 -0.49 0.00 0.00 0.00 0.00 176.54 177.01 3g1u n ALA 349 N -1.06 0.00 -0.60 0.00 0.00 -0.72 -4.47 120.51 113.66 3g1u n ALA 349 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 3g1u n ALA 349 Cb 0.20 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.90 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 3.88 -0.34 0.00 7.64 -1.12 -4.55 113.62 119.12 3g1u n SER 350 Ca 0.00 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.39 3g1u n SER 350 Cb 0.00 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 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 0.37 -1.29 3.70 0.23 0.00 -0.58 -4.81 105.19 102.80 3g1u n GLY 351 Ca 0.20 -1.20 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 3g1u n GLY 351 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3g1u n HIS 352 N -0.68 1.86 -1.10 1.61 8.25 -1.26 -4.76 115.22 119.13 3g1u n HIS 352 Ca 0.00 0.45 -0.31 0.00 -0.26 0.00 0.00 57.72 57.60 3g1u n HIS 352 Cb 0.00 -2.30 0.11 0.00 1.12 0.00 0.00 29.99 28.92 3g1u n HIS 352 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 3g1u s PRO 353 N -2.67 1.89 0.21 -0.41 0.02 -1.26 -4.87 135.00 127.90 3g1u s PRO 353 Ca 0.70 1.26 -0.11 0.00 0.02 0.00 0.00 61.00 62.88 3g1u s PRO 353 Cb -0.44 -1.85 0.27 0.00 0.02 0.00 0.00 34.50 32.50 3g1u s PRO 353 CO 0.51 -1.93 1.69 0.77 -0.33 0.00 0.00 177.00 177.70 3g1u h SER 354 N -1.35 -0.13 -0.72 2.53 0.02 -1.94 -3.00 113.55 108.96 3g1u h SER 354 Ca -0.44 0.13 0.09 0.00 -0.84 0.00 0.00 61.79 60.73 3g1u h SER 354 Cb 1.24 0.20 -0.07 0.00 0.14 0.00 0.00 62.40 63.91 3g1u h SER 354 CO 0.49 -0.05 0.37 0.15 -1.14 0.00 0.00 176.83 176.65 3g1u h PHE 355 N 0.18 0.67 0.04 3.45 3.57 -1.90 -0.93 116.94 122.02 3g1u h PHE 355 Ca 0.30 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.61 3g1u h PHE 355 Cb 0.47 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 3g1u h PHE 355 CO -0.30 0.25 -1.00 -0.24 -2.23 0.00 0.00 178.31 174.79 3g1u h VAL 356 N 0.63 1.51 0.00 1.41 3.04 -1.84 -2.97 116.25 118.03 3g1u h VAL 356 Ca 0.35 -2.81 -0.03 0.00 -1.01 0.00 0.00 66.70 63.20 3g1u h VAL 356 Cb 0.35 2.64 -0.00 0.00 -2.01 0.00 0.00 31.29 32.26 3g1u h VAL 356 CO -0.26 0.82 -0.16 0.24 -1.01 0.00 0.00 177.57 177.20 3g1u h MET 357 N 0.11 0.00 -0.86 4.17 2.86 -1.31 -2.44 114.93 117.46 3g1u h MET 357 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3g1u h MET 357 Cb 1.68 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.29 3g1u h MET 357 CO 0.16 0.16 0.55 1.03 1.06 0.00 0.00 176.91 179.87 3g1u h SER 358 N 0.00 1.01 -0.06 1.22 0.87 -1.01 0.33 113.55 115.90 3g1u h SER 358 Ca -0.00 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.51 3g1u h SER 358 Cb 0.38 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.08 3g1u h SER 358 CO 0.02 0.75 0.02 0.78 -0.53 0.00 0.00 176.83 177.88 3g1u h ASN 359 N 1.17 0.08 -0.37 6.23 2.35 -1.52 -0.71 115.58 122.82 3g1u h ASN 359 Ca 0.31 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 3g1u h ASN 359 Cb -0.10 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 3g1u h ASN 359 CO -0.06 0.21 0.19 -1.28 -1.65 0.00 0.00 177.43 174.83 3g1u h SER 360 N -0.06 0.47 0.60 5.81 0.87 -1.42 -2.74 113.55 117.08 3g1u h SER 360 Ca 0.02 -0.11 -0.14 0.00 -1.23 0.00 0.00 61.79 60.32 3g1u h SER 360 Cb 0.15 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 3g1u h SER 360 CO -0.00 0.45 -0.66 -0.26 -0.53 0.00 0.00 176.83 175.83 3g1u h PHE 361 N 0.46 0.08 -0.71 2.24 0.04 -0.35 -1.85 116.94 116.85 3g1u h PHE 361 Ca 0.13 -0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.79 3g1u h PHE 361 Cb 0.10 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 3g1u h PHE 361 CO -0.02 0.70 0.16 1.15 -0.60 0.00 0.00 178.31 179.71 3g1u h THR 362 N 0.04 1.26 -0.80 -1.55 2.02 -1.09 -1.56 112.91 111.23 3g1u h THR 362 Ca -0.01 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.16 3g1u h THR 362 Cb 1.17 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 3g1u h THR 362 CO 0.09 0.38 0.42 0.78 0.37 0.00 0.00 175.52 177.56 3g1u h ASN 363 N 1.08 1.02 -0.63 4.18 2.35 -1.31 -2.47 115.58 119.80 3g1u h ASN 363 Ca 0.22 -0.11 0.08 0.00 -0.55 0.00 0.00 56.30 55.94 3g1u h ASN 363 Cb 0.38 -0.26 -0.07 0.00 0.05 0.00 0.00 38.32 38.43 3g1u h ASN 363 CO 0.00 0.84 0.28 -0.61 -1.65 0.00 0.00 177.43 176.29 3g1u h GLN 364 N 1.12 0.48 -0.27 0.81 5.75 -0.60 0.65 115.11 123.06 3g1u h GLN 364 Ca 0.28 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.68 3g1u h GLN 364 Cb 0.06 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 3g1u h GLN 364 CO -0.04 0.32 -0.11 0.28 -2.65 0.00 0.00 178.83 176.63 3g1u h VAL 365 N 0.50 1.29 -0.10 2.39 2.07 -1.14 -1.60 116.25 119.66 3g1u h VAL 365 Ca 0.31 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 3g1u h VAL 365 Cb 0.32 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3g1u h VAL 365 CO -0.26 0.37 -0.13 -0.07 0.02 0.00 0.00 177.57 177.49 3g1u h LEU 366 N 0.28 0.14 -0.51 2.57 3.38 -1.13 0.12 115.31 120.16 3g1u h LEU 366 Ca 0.06 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 3g1u h LEU 366 Cb 0.61 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3g1u h LEU 366 CO 0.04 0.29 -0.44 0.00 0.09 0.00 0.00 178.44 178.42 3g1u h ALA 367 N 1.72 0.69 -0.17 1.53 0.00 -0.50 -0.99 119.26 121.54 3g1u h ALA 367 Ca 0.03 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.37 3g1u h ALA 367 Cb 0.33 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3g1u h ALA 367 CO 0.02 0.67 -0.30 1.96 0.00 0.00 0.00 179.25 181.60 3g1u h GLN 368 N 0.57 0.50 -0.65 0.00 1.08 -0.65 -1.74 115.11 114.23 3g1u h GLN 368 Ca 0.04 -0.31 0.06 0.00 -1.45 0.00 0.00 58.65 56.98 3g1u h GLN 368 Cb 0.99 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 28.41 3g1u h GLN 368 CO 0.09 0.92 0.36 0.82 -0.95 0.00 0.00 178.83 180.07 3g1u h ILE 369 N 0.14 0.97 -0.55 2.54 2.04 -1.01 -0.33 117.51 121.31 3g1u h ILE 369 Ca 0.01 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 3g1u h ILE 369 Cb 0.89 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 3g1u h ILE 369 CO 0.07 0.12 0.14 -0.08 0.00 0.00 0.00 178.15 178.40 3g1u h GLU 370 N 0.67 0.88 -0.13 2.37 4.57 -1.10 0.10 114.58 121.94 3g1u h GLU 370 Ca 0.29 -0.21 -0.23 0.00 -1.18 0.00 0.00 59.36 58.03 3g1u h GLU 370 Cb 0.17 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 28.65 3g1u h GLU 370 CO -0.17 0.82 -0.83 -0.07 -1.18 0.00 0.00 179.01 177.58 3g1u h LEU 371 N 0.78 0.95 0.03 1.64 3.38 -1.11 -3.01 115.31 117.97 3g1u h LEU 371 Ca 0.17 -0.65 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 3g1u h LEU 371 Cb 0.33 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3g1u h LEU 371 CO 0.00 1.45 -0.01 -0.25 0.09 0.00 0.00 178.44 179.71 3g1u h TRP 372 N 0.52 -0.04 0.00 1.13 2.91 -1.00 -3.07 115.95 116.40 3g1u h TRP 372 Ca -0.07 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.95 3g1u h TRP 372 Cb 1.46 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 30.12 3g1u h TRP 372 CO 0.09 0.41 0.00 0.66 -1.03 0.00 0.00 178.44 178.57 3g1u h SER 373 N -0.49 0.00 -0.49 2.65 4.64 -1.06 -2.01 113.55 116.79 3g1u h SER 373 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g1u h SER 373 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3g1u h SER 373 CO 0.01 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.56 3g1u n ASN 374 N -2.57 4.72 0.09 4.97 3.02 -1.14 -4.77 115.26 119.59 3g1u n ASN 374 Ca 0.02 -2.75 0.02 0.00 -0.03 0.00 0.00 54.58 51.83 3g1u n ASN 374 Cb 0.28 -0.58 0.37 0.00 -0.61 0.00 0.00 39.78 39.24 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 3.23 0.31 -1.82 3.52 0.11 -1.26 -3.12 114.38 115.35 3g1u h ARG 375 Ca 0.00 -0.07 -0.68 0.00 0.10 0.00 0.00 59.98 59.33 3g1u h ARG 375 Cb 1.59 -0.04 -0.35 0.00 1.11 0.00 0.00 29.97 32.27 3g1u h ARG 375 CO 0.30 0.42 0.15 -0.25 0.10 0.00 0.00 179.97 180.70 3g1u n ASP 376 N -4.28 6.07 0.00 0.08 9.92 -1.26 -4.46 116.55 122.62 3g1u n ASP 376 Ca -0.00 -3.77 0.00 0.00 -0.53 0.00 0.00 54.79 50.49 3g1u n ASP 376 Cb 0.26 -0.77 0.00 0.00 -0.64 0.00 0.00 41.12 39.97 3g1u n ASP 376 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 3g1u n ASN 377 N -0.46 0.00 -0.09 -2.24 0.23 -1.18 -5.06 115.26 106.47 3g1u n ASN 377 Ca 0.45 -1.00 -0.01 0.00 -0.53 0.00 0.00 54.58 53.49 3g1u n ASN 377 Cb 0.43 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.13 3g1u n ASN 377 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g1u n GLY 378 N 0.00 0.39 0.32 4.83 0.00 -1.26 -4.89 105.19 104.58 3g1u n GLY 378 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 45.95 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 0.51 0.74 -3.24 1.61 3.64 -1.94 -3.30 116.57 114.58 3g1u h LYS 379 Ca -0.02 -0.07 -0.64 0.00 -1.27 0.00 0.00 60.65 58.64 3g1u h LYS 379 Cb 0.44 -0.15 -0.40 0.00 -0.41 0.00 0.00 32.23 31.70 3g1u h LYS 379 CO 0.03 0.54 -0.51 0.71 -2.27 0.00 0.00 179.45 177.95 3g1u s TYR 380 N -5.52 3.48 0.25 1.91 1.51 -1.26 -5.10 117.35 112.62 3g1u s TYR 380 Ca -0.09 -3.20 -0.30 0.00 -1.01 0.00 0.00 57.07 52.46 3g1u s TYR 380 Cb 0.17 -2.85 -0.11 0.00 -0.11 0.00 0.00 41.96 39.06 3g1u s TYR 380 CO 0.76 -0.65 1.54 -2.14 -1.11 0.00 0.00 175.55 173.96 3g1u s PRO 381 N -0.98 4.19 0.33 -1.71 0.02 -1.25 -4.68 135.00 130.93 3g1u s PRO 381 Ca 0.22 2.44 -0.16 0.00 0.02 0.00 0.00 61.00 63.52 3g1u s PRO 381 Cb -0.13 -3.08 -0.09 0.00 0.02 0.00 0.00 34.50 31.22 3g1u s PRO 381 CO -0.10 -0.56 0.77 1.03 -0.33 0.00 0.00 177.00 177.81 3g1u s ARG 382 N -0.00 4.06 0.12 5.54 0.52 -1.26 -3.46 118.95 124.46 3g1u s ARG 382 Ca 0.64 0.76 0.00 0.00 -0.52 0.00 0.00 55.73 56.61 3g1u s ARG 382 Cb -0.45 -2.43 0.00 0.00 0.52 0.00 0.00 34.95 32.59 3g1u s ARG 382 CO 0.42 0.15 0.00 0.41 0.02 0.00 0.00 175.30 176.29 3g1u n GLY 383 N -0.32 -0.33 0.29 -3.53 0.00 0.10 -4.47 105.19 96.93 3g1u n GLY 383 Ca 0.04 -1.82 0.19 0.00 0.00 0.00 0.00 46.02 44.42 3g1u n GLY 383 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g1u h ASP 384 N 0.28 0.00 0.09 1.61 3.32 -1.87 -2.15 116.42 117.70 3g1u h ASP 384 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3g1u h ASP 384 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3g1u h ASP 384 CO 0.00 0.00 -0.04 2.29 -1.72 0.00 0.00 179.24 179.77 3g1u n LYS 385 N -3.03 1.21 -1.72 3.56 2.85 -1.26 -4.97 118.16 114.80 3g1u n LYS 385 Ca -0.00 -0.51 -0.35 0.00 -1.05 0.00 0.00 58.31 56.40 3g1u n LYS 385 Cb 0.23 -1.49 0.06 0.00 -0.65 0.00 0.00 35.03 33.19 3g1u n LYS 385 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3g1u s ALA 386 N -2.14 2.34 0.17 0.58 0.00 -0.81 -4.76 121.76 117.15 3g1u s ALA 386 Ca 0.38 0.96 -0.06 0.00 0.00 0.00 0.00 51.96 53.24 3g1u s ALA 386 Cb 0.21 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.89 3g1u s ALA 386 CO 0.39 -1.52 0.33 0.41 0.00 0.00 0.00 175.76 175.36 3g1u n GLY 387 N 0.45 1.70 3.49 0.00 0.00 -1.26 -4.96 105.19 104.61 3g1u n GLY 387 Ca 0.14 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.61 3.92 0.20 1.61 1.01 -1.26 -1.77 120.40 121.49 3g1u s VAL 388 Ca 0.08 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.80 3g1u s VAL 388 Cb -0.02 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 3g1u s VAL 388 CO 0.06 0.48 -0.18 -0.36 0.00 0.00 0.00 175.10 175.10 3g1u s PHE 389 N 0.44 1.92 0.28 5.22 0.08 0.19 -4.97 117.98 121.15 3g1u s PHE 389 Ca -0.03 -0.46 0.02 0.00 0.12 0.00 0.00 56.93 56.58 3g1u s PHE 389 Cb -0.14 -0.92 -0.03 0.00 -0.57 0.00 0.00 43.02 41.36 3g1u s PHE 389 CO 0.03 0.42 0.45 -0.06 -0.10 0.00 0.00 175.22 175.95 3g1u s PHE 390 N -2.30 3.48 0.69 0.36 0.08 -1.26 -0.40 117.98 118.63 3g1u s PHE 390 Ca 0.20 0.19 -0.17 0.00 0.12 0.00 0.00 56.93 57.28 3g1u s PHE 390 Cb -0.05 -1.75 0.01 0.00 -0.57 0.00 0.00 43.02 40.66 3g1u s PHE 390 CO 0.08 0.29 1.17 1.28 -0.10 0.00 0.00 175.22 177.94 3g1u n LEU 391 N -1.47 4.92 -4.53 -0.37 4.77 -1.26 -4.94 117.00 114.13 3g1u n LEU 391 Ca -0.07 0.74 -0.46 0.00 -0.03 0.00 0.00 56.01 56.20 3g1u n LEU 391 Cb 0.56 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.13 3g1u n LEU 391 CO 0.47 -1.46 0.37 -2.65 -1.33 0.00 0.00 177.39 172.79 3g1u n PRO 392 N -2.09 0.89 -0.32 3.23 -0.02 -1.26 -4.85 135.00 130.59 3g1u n PRO 392 Ca 0.15 0.31 0.09 0.00 -2.02 0.00 0.00 63.50 62.03 3g1u n PRO 392 Cb 0.49 -1.56 0.30 0.00 -0.02 0.00 0.00 33.50 32.71 3g1u n PRO 392 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3g1u h LYS 393 N 1.66 0.84 0.00 -0.52 1.57 -2.05 -2.42 116.57 115.65 3g1u h LYS 393 Ca -0.36 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 3g1u h LYS 393 Cb 1.37 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3g1u h LYS 393 CO 0.59 0.56 0.00 0.00 -0.57 0.00 0.00 179.45 180.03 3g1u n ALA 394 N -2.39 2.16 0.16 3.86 0.00 -1.26 -3.10 120.51 119.95 3g1u n ALA 394 Ca 0.18 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.56 3g1u n ALA 394 Cb 0.39 -1.42 0.27 0.00 0.00 0.00 0.00 19.45 18.69 3g1u n ALA 394 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3g1u h LEU 395 N 0.00 0.00 -0.15 0.00 3.38 -1.79 -3.00 115.31 113.75 3g1u h LEU 395 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3g1u h LEU 395 Cb 0.48 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 3g1u h LEU 395 CO 0.00 0.49 -0.17 0.44 0.09 0.00 0.00 178.44 179.29 3g1u h ASP 396 N 0.00 -0.53 -0.52 -0.43 3.32 -1.71 0.11 116.42 116.65 3g1u h ASP 396 Ca -0.00 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 3g1u h ASP 396 Cb 0.91 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 3g1u h ASP 396 CO 0.06 -0.21 0.24 -0.33 -1.72 0.00 0.00 179.24 177.28 3g1u h GLU 397 N -0.20 0.76 -0.53 3.56 5.08 -1.76 -1.94 114.58 119.56 3g1u h GLU 397 Ca 0.10 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3g1u h GLU 397 Cb 0.35 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 3g1u h GLU 397 CO -0.27 0.64 0.17 -0.22 -1.00 0.00 0.00 179.01 178.33 3g1u h LYS 398 N 0.70 0.33 -0.09 2.33 3.64 -1.31 -0.18 116.57 121.99 3g1u h LYS 398 Ca 0.18 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 3g1u h LYS 398 Cb 0.13 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3g1u h LYS 398 CO -0.02 0.22 -0.02 0.28 -2.27 0.00 0.00 179.45 177.63 3g1u h VAL 399 N 0.34 1.29 -0.57 2.00 2.07 -0.84 -2.97 116.25 117.57 3g1u h VAL 399 Ca 0.26 -0.95 0.03 0.00 0.82 0.00 0.00 66.70 66.86 3g1u h VAL 399 Cb 0.30 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 3g1u h VAL 399 CO -0.28 0.27 0.33 0.00 0.02 0.00 0.00 177.57 177.91 3g1u h ALA 400 N 0.68 0.74 0.00 1.67 0.00 -1.16 -2.55 119.26 118.64 3g1u h ALA 400 Ca 0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 400 Cb 0.43 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3g1u h ALA 400 CO 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 179.25 179.27 3g1u h ALA 401 N 1.27 1.87 0.00 0.00 0.00 -0.97 -2.29 119.26 119.14 3g1u h ALA 401 Ca 0.24 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3g1u h ALA 401 Cb 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3g1u h ALA 401 CO -0.12 0.04 -0.06 -0.07 0.00 0.00 0.00 179.25 179.04 3g1u h LEU 402 N 0.00 0.00 -1.17 0.00 3.38 -1.29 -3.08 115.31 113.14 3g1u h LEU 402 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g1u h LEU 402 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3g1u h LEU 402 CO 0.00 0.06 -0.37 1.41 0.09 0.00 0.00 178.44 179.63 3g1u n HIS 403 N -3.26 0.00 0.01 1.13 8.25 -0.86 -4.50 115.22 115.99 3g1u n HIS 403 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.34 3g1u n HIS 403 Cb 0.27 -0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.39 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 2.86 0.64 -0.20 2.41 3.38 -1.60 -3.27 115.31 119.54 3g1u h LEU 404 Ca 0.00 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 3g1u h LEU 404 Cb 0.80 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3g1u h LEU 404 CO 0.00 1.12 0.09 0.00 0.09 0.00 0.00 178.44 179.74 3g1u h ALA 405 N 0.88 0.26 -1.00 1.53 0.00 -1.79 -1.68 119.26 117.46 3g1u h ALA 405 Ca -0.01 -0.10 0.24 0.00 0.00 0.00 0.00 54.91 55.03 3g1u h ALA 405 Cb 1.22 -0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.80 3g1u h ALA 405 CO 0.12 -0.16 0.59 1.25 0.00 0.00 0.00 179.25 181.05 3g1u h HIS 406 N 0.18 1.01 -0.16 0.00 -0.00 -1.86 0.19 115.15 114.51 3g1u h HIS 406 Ca 0.07 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.47 3g1u h HIS 406 Cb 0.16 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.28 3g1u h HIS 406 CO -0.02 0.08 0.00 1.33 -0.00 0.00 0.00 177.93 179.32 3g1u n VAL 407 N -4.88 0.19 -2.18 5.26 0.24 -1.10 -4.97 118.33 110.90 3g1u n VAL 407 Ca 0.26 -0.45 -0.12 0.00 -2.04 0.00 0.00 64.34 61.99 3g1u n VAL 407 Cb 0.72 0.78 -0.01 0.00 -1.47 0.00 0.00 33.84 33.86 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 -0.05 3.67 7.63 0.00 0.05 -5.00 105.19 112.79 3g1u n GLY 408 Ca 0.17 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.59 3.50 -0.25 4.61 0.00 -0.71 -5.03 121.76 121.29 3g1u s ALA 409 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 51.96 51.80 3g1u s ALA 409 Cb 0.00 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.97 3g1u s ALA 409 CO 0.00 -0.53 0.18 0.15 0.00 0.00 0.00 175.76 175.56 3g1u s LYS 410 N 1.85 4.04 0.10 0.00 -0.14 -1.26 -4.63 119.74 119.70 3g1u s LYS 410 Ca 0.35 -0.26 -0.24 0.00 -1.36 0.00 0.00 55.97 54.46 3g1u s LYS 410 Cb -0.16 -3.57 -0.07 0.00 -1.68 0.00 0.00 37.83 32.35 3g1u s LYS 410 CO 0.13 -0.01 0.73 -0.51 -0.76 0.00 0.00 175.35 174.93 3g1u s LEU 411 N 1.26 4.52 0.24 3.17 1.43 -1.26 -5.05 118.68 122.99 3g1u s LEU 411 Ca 0.08 1.49 -0.30 0.00 -1.03 0.00 0.00 54.13 54.37 3g1u s LEU 411 Cb -0.14 -3.19 -0.09 0.00 0.03 0.00 0.00 46.19 42.79 3g1u s LEU 411 CO 0.06 0.14 0.98 -0.89 0.23 0.00 0.00 176.35 176.87 3g1u s THR 412 N -0.67 3.93 -0.27 5.49 2.01 -1.26 -5.04 115.64 119.83 3g1u s THR 412 Ca 0.36 1.93 -0.12 0.00 0.31 0.00 0.00 61.69 64.16 3g1u s THR 412 Cb -0.21 -4.23 -0.05 0.00 0.01 0.00 0.00 72.50 68.02 3g1u s THR 412 CO 0.23 0.45 0.26 -0.75 -0.69 0.00 0.00 174.62 174.12 3g1u s LYS 413 N -1.19 3.98 0.29 4.92 2.47 -1.26 -5.07 119.74 123.88 3g1u s LYS 413 Ca 0.42 -0.19 -0.29 0.00 -1.56 0.00 0.00 55.97 54.35 3g1u s LYS 413 Cb -0.27 -3.65 -0.10 0.00 -1.46 0.00 0.00 37.83 32.34 3g1u s LYS 413 CO 0.34 -0.20 1.40 -0.51 0.16 0.00 0.00 175.35 176.54 3g1u s LEU 414 N 1.84 4.39 0.73 5.43 1.43 -1.26 -5.03 118.68 126.21 3g1u s LEU 414 Ca 0.10 2.71 -0.11 0.00 -1.03 0.00 0.00 54.13 55.79 3g1u s LEU 414 Cb -0.16 -3.64 0.03 0.00 0.03 0.00 0.00 46.19 42.46 3g1u s LEU 414 CO 0.10 -0.66 1.08 0.42 0.23 0.00 0.00 176.35 177.52 3g1u s THR 415 N -0.49 3.58 0.24 5.49 -4.23 -1.26 -4.84 115.64 114.13 3g1u s THR 415 Ca 0.55 0.55 -0.06 0.00 -1.18 0.00 0.00 61.69 61.55 3g1u s THR 415 Cb -0.42 -3.12 0.21 0.00 1.34 0.00 0.00 72.50 70.52 3g1u s THR 415 CO 0.48 -0.64 1.70 -0.65 -0.54 0.00 0.00 174.62 174.98 3g1u h PRO 416 N -0.79 0.30 -0.77 3.99 0.11 -2.00 -1.09 132.00 131.75 3g1u h PRO 416 Ca -0.44 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.70 3g1u h PRO 416 Cb 1.22 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 3g1u h PRO 416 CO 0.54 0.20 0.48 -0.22 -0.21 0.00 0.00 178.00 178.78 3g1u h LYS 417 N 0.31 0.87 -0.42 1.05 3.64 -2.00 -2.13 116.57 117.89 3g1u h LYS 417 Ca 0.39 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.60 3g1u h LYS 417 Cb 0.64 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 3g1u h LYS 417 CO -0.46 0.58 -0.22 1.96 -2.27 0.00 0.00 179.45 179.03 3g1u h GLN 418 N 0.90 0.84 -0.65 1.90 4.20 -1.64 -2.84 115.11 117.81 3g1u h GLN 418 Ca 0.33 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 3g1u h GLN 418 Cb 0.10 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 3g1u h GLN 418 CO -0.15 0.98 0.23 0.00 -0.67 0.00 0.00 178.83 179.22 3g1u h ALA 419 N 1.02 0.85 -0.59 3.87 0.00 -0.99 -2.20 119.26 121.21 3g1u h ALA 419 Ca 0.10 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 419 Cb 0.75 -0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 3g1u h ALA 419 CO 0.06 0.49 0.15 0.93 0.00 0.00 0.00 179.25 180.88 3g1u h GLU 420 N 0.92 0.28 -0.21 0.00 5.08 -1.29 -0.15 114.58 119.21 3g1u h GLU 420 Ca 0.21 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3g1u h GLU 420 Cb 0.25 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3g1u h GLU 420 CO -0.01 0.19 0.05 1.88 -1.00 0.00 0.00 179.01 180.12 3g1u h TYR 421 N 0.29 0.35 0.00 4.33 0.99 -1.22 -1.72 116.97 119.98 3g1u h TYR 421 Ca 0.31 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 61.00 3g1u h TYR 421 Cb 0.43 -0.10 0.00 0.00 1.00 0.00 0.00 36.73 38.06 3g1u h TYR 421 CO -0.23 0.44 0.00 -0.89 -0.00 0.00 0.00 178.16 177.48 3g1u n ILE 422 N -4.77 0.85 -3.53 -2.88 5.41 -0.86 -4.91 119.36 108.68 3g1u n ILE 422 Ca -0.04 0.29 -0.19 0.00 1.00 0.00 0.00 62.75 63.81 3g1u n ILE 422 Cb 0.17 -1.24 0.06 0.00 -0.71 0.00 0.00 39.64 37.92 3g1u n ILE 422 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3g1u n ASN 423 N -2.25 -2.66 -4.19 4.38 5.15 -0.15 -5.03 115.26 110.50 3g1u n ASN 423 Ca 0.02 -0.74 -0.11 0.00 -0.60 0.00 0.00 54.58 53.14 3g1u n ASN 423 Cb 0.20 -4.59 -0.10 0.00 -0.53 0.00 0.00 39.78 34.76 3g1u n ASN 423 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g1u s PRO 425 N -3.96 3.15 0.00 0.00 0.02 -1.26 -4.48 135.00 128.47 3g1u s PRO 425 Ca 0.22 1.57 0.00 0.00 0.02 0.00 0.00 61.00 62.82 3g1u s PRO 425 Cb 0.07 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.61 3g1u s PRO 425 CO 0.02 -1.01 0.07 0.28 -0.33 0.00 0.00 177.00 176.03 3g1u n VAL 426 N -1.66 0.06 -1.55 3.83 0.31 -1.26 -4.87 118.33 113.19 3g1u n VAL 426 Ca 0.11 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.04 3g1u n VAL 426 Cb 0.51 -0.35 0.02 0.00 -0.91 0.00 0.00 33.84 33.11 3g1u n VAL 426 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3g1u n PRO 429 N 0.75 0.96 -0.08 5.55 -0.02 -1.26 -4.77 135.00 136.14 3g1u n PRO 429 Ca 0.00 0.35 -0.07 0.00 -2.02 0.00 0.00 63.50 61.76 3g1u n PRO 429 Cb 0.04 -1.86 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 3g1u n PRO 429 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3g1u n PHE 430 N -0.89 0.58 1.14 6.00 3.72 -1.26 -4.79 117.46 121.96 3g1u n PHE 430 Ca 0.11 0.25 0.13 0.00 -0.05 0.00 0.00 57.45 57.89 3g1u n PHE 430 Cb 0.41 -0.68 0.22 0.00 -0.94 0.00 0.00 39.48 38.49 3g1u n PHE 430 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34