#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 -0.07 -0.16 -0.67 -0.85 -1.26 -4.19 117.35 110.15 3g1u s TYR 4 Ca 0.00 0.01 -0.04 0.00 -0.52 0.00 0.00 57.07 56.52 3g1u s TYR 4 Cb 0.00 0.52 0.08 0.00 0.38 0.00 0.00 41.96 42.94 3g1u s TYR 4 CO 0.00 -0.19 0.23 0.21 -1.52 0.00 0.00 175.55 174.28 3g1u s LYS 5 N -2.33 0.16 0.24 -3.49 2.20 -0.45 -4.99 119.74 111.07 3g1u s LYS 5 Ca 0.12 0.44 0.02 0.00 -0.36 0.00 0.00 55.97 56.18 3g1u s LYS 5 Cb 0.02 -0.67 -0.05 0.00 -1.51 0.00 0.00 37.83 35.62 3g1u s LYS 5 CO -0.04 -0.49 0.06 0.14 -0.36 0.00 0.00 175.35 174.67 3g1u s VAL 6 N 2.36 0.63 0.20 4.02 -7.23 -1.26 -1.62 120.40 117.50 3g1u s VAL 6 Ca 0.05 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.16 3g1u s VAL 6 Cb -0.14 -2.49 0.05 0.00 0.56 0.00 0.00 36.38 34.37 3g1u s VAL 6 CO -0.10 -0.15 1.64 0.50 -0.31 0.00 0.00 175.10 176.68 3g1u h LYS 7 N 2.47 0.90 -0.66 4.82 3.64 -1.89 -3.44 116.57 122.40 3g1u h LYS 7 Ca -0.38 -0.32 0.12 0.00 -1.27 0.00 0.00 60.65 58.79 3g1u h LYS 7 Cb 1.23 -0.06 -0.20 0.00 -0.41 0.00 0.00 32.23 32.79 3g1u h LYS 7 CO 0.62 0.97 -0.20 0.34 -2.27 0.00 0.00 179.45 178.90 3g1u s ASP 8 N -6.68 -1.07 0.53 4.20 3.68 -1.26 -5.02 116.67 111.04 3g1u s ASP 8 Ca -0.10 0.15 0.36 0.00 2.13 0.00 0.00 52.55 55.08 3g1u s ASP 8 Cb 0.13 1.69 1.90 0.00 -1.45 0.00 0.00 42.92 45.19 3g1u s ASP 8 CO 0.84 -0.20 2.09 -0.29 0.13 0.00 0.00 175.17 177.75 3g1u h ILE 9 N 5.34 0.00 0.00 4.11 6.09 -1.93 -2.08 117.51 129.04 3g1u h ILE 9 Ca -0.06 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 3g1u h ILE 9 Cb 1.18 0.84 0.00 0.00 0.47 0.00 0.00 36.82 39.32 3g1u h ILE 9 CO 0.04 0.00 0.00 0.77 -3.07 0.00 0.00 178.15 175.89 3g1u h SER 10 N 0.00 0.00 0.00 2.19 4.64 -1.95 -2.50 113.55 115.93 3g1u h SER 10 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g1u h SER 10 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3g1u h SER 10 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 3g1u n LEU 11 N -2.60 0.00 -0.25 5.97 4.77 -0.78 -4.11 117.00 120.00 3g1u n LEU 11 Ca 0.03 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 3g1u n LEU 11 Cb 0.34 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.48 3g1u n LEU 11 CO 0.26 0.00 1.07 0.00 -1.33 0.00 0.00 177.39 177.40 3g1u h ALA 12 N 3.49 0.90 -0.53 -1.18 0.00 -1.65 -1.15 119.26 119.13 3g1u h ALA 12 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 3g1u h ALA 12 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3g1u h ALA 12 CO 0.00 0.44 -0.14 0.93 0.00 0.00 0.00 179.25 180.48 3g1u h GLU 13 N 0.96 1.03 -0.15 0.00 3.07 -1.84 0.14 114.58 117.79 3g1u h GLU 13 Ca 0.24 -0.40 -0.02 0.00 -0.50 0.00 0.00 59.36 58.68 3g1u h GLU 13 Cb 0.09 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 3g1u h GLU 13 CO -0.03 1.09 0.01 2.35 -1.40 0.00 0.00 179.01 181.02 3g1u h TRP 14 N 0.90 0.29 -0.69 4.33 7.01 -1.82 -2.56 115.95 123.41 3g1u h TRP 14 Ca 0.13 -0.05 0.11 0.00 2.11 0.00 0.00 58.89 61.19 3g1u h TRP 14 Cb 0.72 -0.08 -0.08 0.00 -2.10 0.00 0.00 29.16 27.62 3g1u h TRP 14 CO 0.05 0.47 0.30 0.78 -2.79 0.00 0.00 178.44 177.25 3g1u h GLY 15 N 0.02 1.03 0.63 2.65 0.00 -0.92 -1.82 103.07 104.65 3g1u h GLY 15 Ca 0.04 -0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.26 3g1u h GLY 15 CO 0.01 -0.01 0.17 -0.09 0.00 0.00 0.00 176.54 176.62 3g1u h ARG 16 N 0.49 0.34 -0.81 4.80 9.65 -0.59 -0.64 114.38 127.62 3g1u h ARG 16 Ca 0.36 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.18 3g1u h ARG 16 Cb 0.45 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.92 3g1u h ARG 16 CO -0.32 0.23 0.35 0.87 2.80 0.00 0.00 179.97 183.90 3g1u h LYS 17 N 0.35 1.19 -0.53 0.20 1.57 -0.99 -1.56 116.57 116.80 3g1u h LYS 17 Ca 0.21 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 3g1u h LYS 17 Cb 0.19 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3g1u h LYS 17 CO -0.20 0.94 -0.00 0.00 -0.57 0.00 0.00 179.45 179.62 3g1u h ALA 18 N 1.19 0.71 -0.50 3.86 0.00 -1.00 -2.49 119.26 121.03 3g1u h ALA 18 Ca 0.27 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3g1u h ALA 18 Cb 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 18 CO -0.03 0.53 0.27 0.82 0.00 0.00 0.00 179.25 180.84 3g1u h ILE 19 N 0.80 1.00 -0.83 0.00 2.04 -0.90 -0.72 117.51 118.90 3g1u h ILE 19 Ca 0.15 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3g1u h ILE 19 Cb 0.53 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 3g1u h ILE 19 CO 0.03 0.10 0.55 -0.33 0.00 0.00 0.00 178.15 178.49 3g1u h GLU 20 N 0.53 0.98 -0.46 2.37 5.08 -1.15 0.12 114.58 122.05 3g1u h GLU 20 Ca 0.21 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 3g1u h GLU 20 Cb 0.08 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3g1u h GLU 20 CO -0.13 0.65 -0.20 -0.07 -1.00 0.00 0.00 179.01 178.26 3g1u h LEU 21 N 1.01 0.94 -0.67 1.33 3.38 -0.96 -3.15 115.31 117.19 3g1u h LEU 21 Ca 0.34 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3g1u h LEU 21 Cb 0.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3g1u h LEU 21 CO -0.10 1.11 0.29 0.00 0.09 0.00 0.00 178.44 179.83 3g1u h ALA 22 N 0.96 0.87 -0.59 1.53 0.00 -0.36 -2.86 119.26 118.81 3g1u h ALA 22 Ca 0.11 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.96 3g1u h ALA 22 Cb 0.76 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.20 3g1u h ALA 22 CO 0.06 0.47 0.14 0.93 0.00 0.00 0.00 179.25 180.85 3g1u h GLU 23 N 0.95 0.27 0.00 0.00 5.08 -0.76 0.73 114.58 120.84 3g1u h GLU 23 Ca 0.23 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3g1u h GLU 23 Cb 0.18 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3g1u h GLU 23 CO -0.02 0.18 0.00 -0.91 -1.00 0.00 0.00 179.01 177.26 3g1u h ASN 24 N 0.28 0.00 -0.45 1.42 4.21 -1.47 -1.59 115.58 117.99 3g1u h ASN 24 Ca 0.31 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.82 3g1u h ASN 24 Cb 0.45 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.65 3g1u h ASN 24 CO -0.38 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.14 3g1u n GLU 25 N -3.03 2.52 -2.96 0.81 -0.58 0.17 -4.61 120.64 112.97 3g1u n GLU 25 Ca -0.02 -2.34 -0.22 0.00 -0.42 0.00 0.00 57.16 54.17 3g1u n GLU 25 Cb 0.12 -1.51 -0.02 0.00 -0.57 0.00 0.00 31.44 29.46 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 1.48 2.17 0.27 3.49 2.81 -0.60 -3.37 117.12 123.38 3g1u n MET 26 Ca 0.20 -4.09 0.12 0.00 -1.81 0.00 0.00 57.70 52.12 3g1u n MET 26 Cb 0.60 -1.93 0.76 0.00 -0.71 0.00 0.00 33.22 31.94 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 2.95 0.00 0.52 0.03 0.13 -1.82 -2.01 132.00 131.80 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 0.80 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 3g1u h PRO 27 CO 0.67 0.04 -0.31 0.78 -0.23 0.00 0.00 178.00 178.95 3g1u h GLY 28 N 0.20 -0.84 1.01 1.56 0.00 -1.87 -0.84 103.07 102.29 3g1u h GLY 28 Ca -0.00 0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.67 3g1u h GLY 28 CO 0.01 -0.31 0.43 1.41 0.00 0.00 0.00 176.54 178.08 3g1u h LEU 29 N -0.79 0.89 -1.24 3.11 3.38 -1.67 -2.19 115.31 116.80 3g1u h LEU 29 Ca -0.06 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 3g1u h LEU 29 Cb 0.64 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3g1u h LEU 29 CO 0.06 0.71 -0.37 0.24 0.09 0.00 0.00 178.44 179.17 3g1u h MET 30 N 1.01 0.02 0.00 1.13 2.86 -1.35 -2.66 114.93 115.93 3g1u h MET 30 Ca 0.26 -0.01 -0.19 0.00 -2.06 0.00 0.00 59.70 57.70 3g1u h MET 30 Cb -0.01 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 3g1u h MET 30 CO -0.05 0.38 -0.86 1.49 1.06 0.00 0.00 176.91 178.93 3g1u h GLU 31 N 0.01 0.18 -0.43 1.72 4.57 -0.93 -2.88 114.58 116.82 3g1u h GLU 31 Ca -0.00 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 57.95 3g1u h GLU 31 Cb 0.66 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 3g1u h GLU 31 CO 0.05 0.93 0.10 -0.07 -1.18 0.00 0.00 179.01 178.84 3g1u h LEU 32 N 0.10 0.59 -0.61 1.64 3.38 -1.07 -0.64 115.31 118.70 3g1u h LEU 32 Ca -0.04 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3g1u h LEU 32 Cb 1.49 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 3g1u h LEU 32 CO 0.13 0.60 0.14 0.03 0.09 0.00 0.00 178.44 179.43 3g1u h ARG 33 N 0.63 0.98 0.41 1.13 3.08 -1.41 -1.15 114.38 118.05 3g1u h ARG 33 Ca 0.14 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3g1u h ARG 33 Cb 0.25 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3g1u h ARG 33 CO -0.00 0.90 -0.20 -0.09 -1.07 0.00 0.00 179.97 179.51 3g1u h ARG 34 N 0.89 -0.53 -0.29 0.04 2.43 -1.25 -1.50 114.38 114.18 3g1u h ARG 34 Ca 0.19 0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 3g1u h ARG 34 Cb 0.37 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3g1u h ARG 34 CO 0.00 -0.23 -0.08 1.49 -1.51 0.00 0.00 179.97 179.64 3g1u h GLU 35 N -0.82 0.46 -0.00 0.20 4.81 -1.16 -3.34 114.58 114.73 3g1u h GLU 35 Ca -0.06 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 3g1u h GLU 35 Cb 0.54 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3g1u h GLU 35 CO 0.09 0.55 -0.08 0.66 -0.73 0.00 0.00 179.01 179.50 3g1u n TYR 36 N -4.24 0.00 0.02 0.92 4.01 -0.43 -4.68 117.16 112.75 3g1u n TYR 36 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3g1u n TYR 36 Cb 0.28 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 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 0.58 -0.34 -0.29 2.72 0.00 -1.38 -2.75 103.07 101.60 3g1u h GLY 37 Ca 0.00 0.32 0.13 0.00 0.00 0.00 0.00 47.33 47.79 3g1u h GLY 37 CO 0.00 -0.21 -0.13 -2.55 0.00 0.00 0.00 176.54 173.65 3g1u h PRO 38 N -0.35 0.02 -0.01 4.80 0.11 -1.82 -2.48 132.00 132.26 3g1u h PRO 38 Ca 0.09 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3g1u h PRO 38 Cb 0.49 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.59 3g1u h PRO 38 CO -0.29 0.01 -0.05 -1.13 -0.21 0.00 0.00 178.00 176.33 3g1u n SER 39 N -5.42 0.59 -3.99 -2.05 3.41 -1.08 -4.95 113.62 100.12 3g1u n SER 39 Ca 0.09 -0.95 -0.35 0.00 -0.26 0.00 0.00 58.87 57.40 3g1u n SER 39 Cb 0.35 -0.03 0.01 0.00 -0.26 0.00 0.00 64.21 64.28 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 -0.68 -0.45 0.30 4.33 1.13 -0.94 -4.80 117.38 116.28 3g1u n GLN 40 Ca 0.19 -0.09 0.20 0.00 -1.94 0.00 0.00 57.00 55.36 3g1u n GLN 40 Cb 0.24 -1.65 1.00 0.00 0.11 0.00 0.00 30.24 29.95 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 -1.20 0.00 -0.62 -1.09 0.13 -1.71 -2.13 132.00 125.39 3g1u h PRO 41 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 3g1u h PRO 41 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 3g1u h PRO 41 CO 0.40 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.45 3g1u n LEU 42 N -2.99 4.15 -4.66 1.56 4.77 -0.39 -4.83 117.00 114.62 3g1u n LEU 42 Ca -0.02 -2.24 -0.46 0.00 -0.03 0.00 0.00 56.01 53.26 3g1u n LEU 42 Cb 0.14 -0.49 -0.04 0.00 -2.33 0.00 0.00 43.42 40.69 3g1u n LEU 42 CO 0.21 0.86 1.56 1.17 -1.33 0.00 0.00 177.39 179.87 3g1u n LYS 43 N 1.16 2.31 0.00 3.23 4.81 -0.80 -0.50 118.16 128.36 3g1u n LYS 43 Ca 0.23 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.50 3g1u n LYS 43 Cb 0.72 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.99 3g1u n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3g1u n GLY 44 N 4.63 2.94 3.72 3.14 0.00 -1.26 -5.01 105.19 113.36 3g1u n GLY 44 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 3g1u n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1u s ALA 45 N -2.72 3.40 -0.40 4.61 0.00 0.34 -4.96 121.76 122.02 3g1u s ALA 45 Ca 0.00 0.86 0.02 0.00 0.00 0.00 0.00 51.96 52.85 3g1u s ALA 45 Cb 0.00 -3.43 0.11 0.00 0.00 0.00 0.00 23.12 19.80 3g1u s ALA 45 CO 0.00 -0.39 0.14 0.15 0.00 0.00 0.00 175.76 175.66 3g1u s LYS 46 N 0.63 1.73 -0.24 0.00 1.02 -1.26 -0.57 119.74 121.05 3g1u s LYS 46 Ca 0.56 -2.05 -0.14 0.00 0.02 0.00 0.00 55.97 54.36 3g1u s LYS 46 Cb -0.30 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.64 3g1u s LYS 46 CO 0.31 -1.01 0.34 0.42 -0.92 0.00 0.00 175.35 174.49 3g1u s ILE 47 N 0.66 5.22 -0.25 2.17 1.01 0.12 -1.19 121.20 128.95 3g1u s ILE 47 Ca 0.12 0.54 -0.21 0.00 0.00 0.00 0.00 60.65 61.10 3g1u s ILE 47 Cb -0.21 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 3g1u s ILE 47 CO -0.06 0.23 0.67 0.00 0.00 0.00 0.00 174.94 175.78 3g1u s ALA 48 N 1.59 3.61 -0.13 9.38 0.00 -0.60 -1.63 121.76 134.00 3g1u s ALA 48 Ca 0.15 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.74 3g1u s ALA 48 Cb -0.15 -3.07 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 3g1u s ALA 48 CO 0.08 -0.81 -0.12 0.20 0.00 0.00 0.00 175.76 175.12 3g1u s GLY 49 N 1.42 1.57 -0.39 0.00 0.00 0.05 -1.50 107.32 108.47 3g1u s GLY 49 Ca 0.28 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 44.13 3g1u s GLY 49 CO 0.08 -0.23 0.19 0.00 0.00 0.00 0.00 173.10 173.15 3g1u s LEU 51 N 0.78 -0.35 -0.31 0.00 0.20 -0.68 -1.98 118.68 116.34 3g1u s LEU 51 Ca 0.15 1.22 -0.29 0.00 0.69 0.00 0.00 54.13 55.91 3g1u s LEU 51 Cb -0.22 2.05 -0.12 0.00 -0.43 0.00 0.00 46.19 47.46 3g1u s LEU 51 CO -0.06 -0.21 1.03 1.41 -0.29 0.00 0.00 176.35 178.22 3g1u n HIS 52 N 3.02 1.05 -2.44 5.38 8.25 -1.26 -4.16 115.22 125.06 3g1u n HIS 52 Ca -0.15 0.68 -0.43 0.00 -0.26 0.00 0.00 57.72 57.57 3g1u n HIS 52 Cb 0.56 -1.38 0.00 0.00 1.12 0.00 0.00 29.99 30.29 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 2.72 3.25 -3.76 -0.41 1.56 -1.26 -4.58 117.12 114.63 3g1u n MET 53 Ca 0.21 -3.33 -0.24 0.00 -0.27 0.00 0.00 57.70 54.07 3g1u n MET 53 Cb -0.04 -3.22 -0.02 0.00 2.15 0.00 0.00 33.22 32.10 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 2.56 2.05 0.32 1.12 -4.23 -1.26 -0.84 115.64 115.35 3g1u s THR 54 Ca 0.47 -1.43 0.04 0.00 -1.18 0.00 0.00 61.69 59.58 3g1u s THR 54 Cb 0.06 -2.48 0.30 0.00 1.34 0.00 0.00 72.50 71.71 3g1u s THR 54 CO 0.01 0.00 1.88 0.58 -0.54 0.00 0.00 174.62 176.55 3g1u h VAL 55 N 0.86 0.94 -0.43 2.29 2.07 -1.91 -1.45 116.25 118.62 3g1u h VAL 55 Ca -0.38 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 3g1u h VAL 55 Cb 1.29 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3g1u h VAL 55 CO 0.57 0.16 -0.03 1.56 0.02 0.00 0.00 177.57 179.86 3g1u h GLN 56 N 0.89 0.78 -0.03 1.57 7.50 -1.94 -2.89 115.11 120.99 3g1u h GLN 56 Ca 0.43 -0.26 -0.04 0.00 0.50 0.00 0.00 58.65 59.28 3g1u h GLN 56 Cb 0.46 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.92 3g1u h GLN 56 CO -0.20 0.87 -0.18 1.15 -1.50 0.00 0.00 178.83 178.97 3g1u h THR 57 N 0.62 1.15 -0.18 -0.54 2.02 -1.67 -2.33 112.91 111.98 3g1u h THR 57 Ca 0.12 -0.68 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 3g1u h THR 57 Cb 0.53 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 3g1u h THR 57 CO 0.03 0.20 -0.20 0.00 0.37 0.00 0.00 175.52 175.91 3g1u h ALA 58 N 1.78 1.32 -0.25 6.16 0.00 -1.08 0.26 119.26 127.45 3g1u h ALA 58 Ca 0.01 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 3g1u h ALA 58 Cb 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3g1u h ALA 58 CO 0.02 0.46 -0.46 0.28 0.00 0.00 0.00 179.25 179.55 3g1u h VAL 59 N 0.29 1.30 0.27 0.00 2.07 -1.30 -1.39 116.25 117.50 3g1u h VAL 59 Ca 0.05 -1.66 -0.01 0.00 0.82 0.00 0.00 66.70 65.90 3g1u h VAL 59 Cb 0.53 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3g1u h VAL 59 CO 0.04 0.53 -0.13 0.25 0.02 0.00 0.00 177.57 178.27 3g1u h LEU 60 N 0.51 -0.31 -0.72 2.57 5.85 -1.09 -1.42 115.31 120.70 3g1u h LEU 60 Ca 0.03 -0.09 0.12 0.00 0.84 0.00 0.00 57.88 58.78 3g1u h LEU 60 Cb 1.00 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 42.02 3g1u h LEU 60 CO 0.09 -0.10 0.31 0.40 -0.34 0.00 0.00 178.44 178.80 3g1u h ILE 61 N -0.52 0.72 0.00 4.05 2.04 -0.42 -1.39 117.51 122.00 3g1u h ILE 61 Ca -0.04 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 3g1u h ILE 61 Cb 0.38 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 3g1u h ILE 61 CO 0.06 0.09 -0.01 -0.33 0.00 0.00 0.00 178.15 177.96 3g1u h GLU 62 N 0.48 0.00 -0.09 2.37 5.08 -1.19 -0.40 114.58 120.84 3g1u h GLU 62 Ca 0.38 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.67 3g1u h GLU 62 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3g1u h GLU 62 CO -0.35 0.01 -0.21 1.15 -1.00 0.00 0.00 179.01 178.60 3g1u h THR 63 N 0.00 1.40 -0.58 1.13 2.02 -0.67 -1.76 112.91 114.45 3g1u h THR 63 Ca -0.00 -1.52 -0.05 0.00 0.77 0.00 0.00 66.41 65.61 3g1u h THR 63 Cb 0.91 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 69.46 3g1u h THR 63 CO 0.00 0.44 0.16 -0.07 0.37 0.00 0.00 175.52 176.41 3g1u h LEU 64 N -0.15 0.83 -0.35 2.58 3.38 -1.02 -2.62 115.31 117.97 3g1u h LEU 64 Ca -0.00 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 3g1u h LEU 64 Cb 0.81 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3g1u h LEU 64 CO 0.05 0.80 0.01 0.50 0.09 0.00 0.00 178.44 179.89 3g1u h LYS 65 N 0.86 0.60 0.00 1.13 3.11 -1.11 -2.06 116.57 119.11 3g1u h LYS 65 Ca 0.19 -0.18 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 3g1u h LYS 65 Cb 0.29 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 3g1u h LYS 65 CO -0.00 0.71 0.00 0.00 -2.81 0.00 0.00 179.45 177.35 3g1u n ALA 66 N -2.37 1.30 0.70 5.00 0.00 -0.66 -1.51 120.51 122.96 3g1u n ALA 66 Ca -0.02 0.14 0.11 0.00 0.00 0.00 0.00 53.44 53.67 3g1u n ALA 66 Cb 0.26 -1.33 0.12 0.00 0.00 0.00 0.00 19.45 18.50 3g1u n ALA 66 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3g1u n LEU 67 N -2.21 2.90 0.00 0.00 4.77 -1.01 -4.62 117.00 116.83 3g1u n LEU 67 Ca 0.00 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 3g1u n LEU 67 Cb 0.11 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3g1u n LEU 67 CO 0.13 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 3g1u n GLY 68 N 1.22 0.79 3.78 -0.72 0.00 -0.57 -1.27 105.19 108.42 3g1u n GLY 68 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 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 2.60 -0.12 4.61 0.00 -0.80 -3.99 121.76 122.06 3g1u s ALA 69 Ca 0.00 0.61 -0.04 0.00 0.00 0.00 0.00 51.96 52.53 3g1u s ALA 69 Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 3g1u s ALA 69 CO 0.00 -1.00 0.03 -2.00 0.00 0.00 0.00 175.76 172.79 3g1u s GLU 70 N -3.79 3.38 0.03 0.00 2.12 0.26 -4.46 118.70 116.24 3g1u s GLU 70 Ca 0.68 -0.37 0.04 0.00 0.36 0.00 0.00 54.97 55.69 3g1u s GLU 70 Cb -0.21 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.20 3g1u s GLU 70 CO 0.35 0.55 -0.13 -0.51 -0.54 0.00 0.00 175.26 174.98 3g1u s LEU 71 N -0.43 2.14 -0.03 2.70 1.43 -1.26 0.16 118.68 123.39 3g1u s LEU 71 Ca 0.09 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3g1u s LEU 71 Cb -0.12 -0.56 0.00 0.00 0.03 0.00 0.00 46.19 45.54 3g1u s LEU 71 CO 0.02 0.04 -0.10 -0.13 0.23 0.00 0.00 176.35 176.42 3g1u s ARG 72 N -0.93 1.07 0.01 1.70 0.52 -0.64 -4.14 118.95 116.53 3g1u s ARG 72 Ca 0.01 -0.33 0.05 0.00 -0.52 0.00 0.00 55.73 54.94 3g1u s ARG 72 Cb -0.07 -0.98 -0.02 0.00 0.52 0.00 0.00 34.95 34.40 3g1u s ARG 72 CO 0.01 0.12 -0.14 -0.46 0.02 0.00 0.00 175.30 174.84 3g1u s TRP 73 N 0.22 1.28 0.20 -0.53 -0.11 -0.31 -0.77 118.94 118.92 3g1u s TRP 73 Ca -0.04 -0.29 0.01 0.00 1.22 0.00 0.00 56.10 57.00 3g1u s TRP 73 Cb -0.09 -0.79 -0.05 0.00 -1.50 0.00 0.00 33.47 31.04 3g1u s TRP 73 CO 0.01 0.01 0.07 -1.54 -4.62 0.00 0.00 176.95 170.87 3g1u s SER 74 N -0.68 0.82 0.25 5.86 1.04 0.10 -0.64 113.70 120.46 3g1u s SER 74 Ca 0.04 -1.30 -0.08 0.00 0.48 0.00 0.00 55.95 55.10 3g1u s SER 74 Cb -0.06 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 66.21 3g1u s SER 74 CO 0.00 -0.71 0.55 -0.55 0.98 0.00 0.00 173.24 173.51 3g1u s SER 75 N -3.20 6.55 -0.07 7.02 0.15 -1.26 -1.69 113.70 121.21 3g1u s SER 75 Ca 0.32 0.83 0.16 0.00 0.70 0.00 0.00 55.95 57.97 3g1u s SER 75 Cb 0.07 -2.19 0.59 0.00 -1.71 0.00 0.00 66.02 62.78 3g1u s SER 75 CO 0.09 -0.12 1.48 0.00 1.20 0.00 0.00 173.24 175.89 3g1u s ASN 77 N -0.88 -0.27 0.48 0.00 3.84 -1.26 -4.94 114.94 111.92 3g1u s ASN 77 Ca 0.43 0.41 0.26 0.00 0.21 0.00 0.00 52.86 54.17 3g1u s ASN 77 Cb 0.26 0.52 1.20 0.00 -0.55 0.00 0.00 41.25 42.68 3g1u s ASN 77 CO 0.23 -0.25 1.96 0.16 -2.79 0.00 0.00 177.10 176.40 3g1u h ILE 78 N 4.32 0.56 -0.11 -5.21 3.07 -1.89 -3.26 117.51 114.99 3g1u h ILE 78 Ca -0.28 -0.82 0.00 0.00 1.55 0.00 0.00 64.86 65.31 3g1u h ILE 78 Cb 1.18 1.55 0.00 0.00 -0.27 0.00 0.00 36.82 39.28 3g1u h ILE 78 CO 0.34 0.17 0.00 0.49 -1.05 0.00 0.00 178.15 178.10 3g1u n PHE 79 N -3.52 0.14 0.15 0.16 3.72 -1.26 -0.21 117.46 116.65 3g1u n PHE 79 Ca -0.01 -0.29 0.12 0.00 -0.05 0.00 0.00 57.45 57.22 3g1u n PHE 79 Cb 0.33 -0.02 0.03 0.00 -0.94 0.00 0.00 39.48 38.88 3g1u n PHE 79 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3g1u h SER 80 N 1.14 0.00 -3.43 4.37 4.64 -1.77 -3.37 113.55 115.13 3g1u h SER 80 Ca 0.00 -0.02 -0.53 0.00 -0.47 0.00 0.00 61.79 60.77 3g1u h SER 80 Cb 0.47 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.64 3g1u h SER 80 CO 0.00 0.01 0.84 -0.89 -0.87 0.00 0.00 176.83 175.92 3g1u s THR 81 N -3.34 2.21 -0.38 2.95 2.01 -1.26 -4.51 115.64 113.33 3g1u s THR 81 Ca 0.01 0.19 -0.16 0.00 0.31 0.00 0.00 61.69 62.03 3g1u s THR 81 Cb 0.09 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.49 3g1u s THR 81 CO 0.77 0.03 0.39 -1.10 -0.69 0.00 0.00 174.62 174.03 3g1u s GLN 82 N -0.71 3.34 0.45 4.92 -0.21 -0.02 -4.23 119.66 123.20 3g1u s GLN 82 Ca 0.61 -0.58 0.11 0.00 0.02 0.00 0.00 55.36 55.52 3g1u s GLN 82 Cb -0.46 -3.88 1.02 0.00 1.00 0.00 0.00 33.01 30.69 3g1u s GLN 82 CO 0.49 -0.67 2.08 -0.44 -2.12 0.00 0.00 175.29 174.63 3g1u h ASP 83 N 8.58 0.26 -0.40 5.90 3.32 -1.93 -1.39 116.42 130.75 3g1u h ASP 83 Ca -0.28 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.65 3g1u h ASP 83 Cb 1.13 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 3g1u h ASP 83 CO 0.74 0.21 -0.19 -0.55 -1.72 0.00 0.00 179.24 177.73 3g1u h ASN 84 N 0.30 0.86 -0.35 6.45 -1.07 -1.91 -0.92 115.58 118.93 3g1u h ASN 84 Ca 0.08 -0.40 -0.14 0.00 0.07 0.00 0.00 56.30 55.91 3g1u h ASN 84 Cb 0.01 -0.24 -0.01 0.00 -2.07 0.00 0.00 38.32 36.01 3g1u h ASN 84 CO -0.01 1.07 -0.29 0.00 0.07 0.00 0.00 177.43 178.26 3g1u h ALA 85 N 0.82 0.72 -0.43 4.14 0.00 -1.73 -0.43 119.26 122.35 3g1u h ALA 85 Ca 0.09 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3g1u h ALA 85 Cb 0.74 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3g1u h ALA 85 CO 0.06 0.66 0.15 0.00 0.00 0.00 0.00 179.25 180.12 3g1u h ALA 86 N 0.92 0.56 -0.65 0.00 0.00 -1.23 -2.17 119.26 116.69 3g1u h ALA 86 Ca 0.08 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3g1u h ALA 86 Cb 0.85 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 3g1u h ALA 86 CO 0.08 0.19 0.21 0.00 0.00 0.00 0.00 179.25 179.72 3g1u h ALA 87 N 0.99 0.85 -0.90 0.00 0.00 -1.06 -1.27 119.26 117.87 3g1u h ALA 87 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3g1u h ALA 87 Cb 0.24 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 87 CO -0.01 0.51 0.57 0.00 0.00 0.00 0.00 179.25 180.32 3g1u h ALA 88 N 1.08 1.14 -0.29 0.00 0.00 -0.97 -0.54 119.26 119.69 3g1u h ALA 88 Ca 0.21 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3g1u h ALA 88 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3g1u h ALA 88 CO -0.01 0.57 0.00 0.82 0.00 0.00 0.00 179.25 180.63 3g1u h ILE 89 N 1.23 1.26 -0.81 0.00 1.08 -1.25 -3.12 117.51 115.90 3g1u h ILE 89 Ca 0.33 -0.93 0.05 0.00 -0.39 0.00 0.00 64.86 63.91 3g1u h ILE 89 Cb -0.09 1.29 -0.06 0.00 -3.07 0.00 0.00 36.82 34.89 3g1u h ILE 89 CO -0.07 0.30 0.50 0.00 -0.69 0.00 0.00 178.15 178.20 3g1u h ALA 90 N 0.83 1.09 -0.01 1.87 0.00 -0.86 -1.94 119.26 120.24 3g1u h ALA 90 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3g1u h ALA 90 Cb 0.43 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3g1u h ALA 90 CO 0.02 0.27 0.01 -0.22 0.00 0.00 0.00 179.25 179.32 3g1u h LYS 91 N 0.94 0.00 0.00 0.00 3.64 -1.06 -1.91 116.57 118.18 3g1u h LYS 91 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 3g1u h LYS 91 Cb 0.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3g1u h LYS 91 CO -0.15 0.00 -0.10 1.79 -2.27 0.00 0.00 179.45 178.72 3g1u h THR 92 N 0.00 0.00 0.00 1.00 1.35 -1.29 -3.47 112.91 110.50 3g1u h THR 92 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 3g1u h THR 92 Cb 0.02 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 3g1u h THR 92 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3g1u n GLY 93 N 1.23 0.84 3.68 5.82 0.00 -0.72 -5.08 105.19 110.96 3g1u n GLY 93 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 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 4.48 -0.13 1.61 1.01 -1.20 -4.98 120.40 119.19 3g1u s VAL 94 Ca 0.00 1.78 -0.29 0.00 0.00 0.00 0.00 61.98 63.47 3g1u s VAL 94 Cb 0.00 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3g1u s VAL 94 CO 0.00 -0.06 1.88 -2.84 0.00 0.00 0.00 175.10 174.08 3g1u s PRO 95 N 2.58 3.77 -0.03 2.72 0.02 -1.26 -4.26 135.00 138.54 3g1u s PRO 95 Ca 0.51 2.09 0.03 0.00 0.02 0.00 0.00 61.00 63.66 3g1u s PRO 95 Cb -0.21 -4.15 0.00 0.00 0.02 0.00 0.00 34.50 30.16 3g1u s PRO 95 CO 0.17 -1.35 -0.12 0.54 -0.33 0.00 0.00 177.00 175.90 3g1u s VAL 96 N 5.64 1.03 -0.46 3.83 0.11 -1.26 -1.17 120.40 128.12 3g1u s VAL 96 Ca 0.84 -0.49 0.03 0.00 -2.93 0.00 0.00 61.98 59.42 3g1u s VAL 96 Cb -0.33 -0.90 0.13 0.00 -1.53 0.00 0.00 36.38 33.75 3g1u s VAL 96 CO 0.34 0.31 0.24 -0.36 -3.33 0.00 0.00 175.10 172.31 3g1u s PHE 97 N 0.15 2.27 -0.28 1.54 0.08 0.19 -1.35 117.98 120.58 3g1u s PHE 97 Ca -0.04 -2.60 -0.18 0.00 0.12 0.00 0.00 56.93 54.24 3g1u s PHE 97 Cb -0.10 -2.11 0.11 0.00 -0.57 0.00 0.00 43.02 40.35 3g1u s PHE 97 CO 0.01 -0.77 0.84 0.00 -0.10 0.00 0.00 175.22 175.19 3g1u s ALA 98 N 0.22 -2.03 -0.03 5.36 0.00 -0.64 -4.06 121.76 120.58 3g1u s ALA 98 Ca 0.17 2.25 -0.15 0.00 0.00 0.00 0.00 51.96 54.23 3g1u s ALA 98 Cb -0.25 -1.51 0.03 0.00 0.00 0.00 0.00 23.12 21.39 3g1u s ALA 98 CO 0.00 -0.35 0.33 1.67 0.00 0.00 0.00 175.76 177.41 3g1u s TRP 99 N 1.25 -0.22 0.08 0.00 -2.14 -1.26 -4.27 118.94 112.39 3g1u s TRP 99 Ca -0.07 0.36 -0.31 0.00 2.66 0.00 0.00 56.10 58.74 3g1u s TRP 99 Cb -0.04 0.11 -0.08 0.00 -3.10 0.00 0.00 33.47 30.36 3g1u s TRP 99 CO -0.15 -0.38 1.57 0.21 -2.66 0.00 0.00 176.95 175.54 3g1u s LYS 100 N -1.18 4.23 0.00 3.25 2.20 -1.26 -3.71 119.74 123.26 3g1u s LYS 100 Ca -0.12 2.25 0.00 0.00 -0.36 0.00 0.00 55.97 57.74 3g1u s LYS 100 Cb -0.05 -3.48 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 3g1u s LYS 100 CO 0.04 -0.66 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 3g1u n GLY 101 N 3.85 0.95 3.78 5.54 0.00 0.71 -5.01 105.19 115.01 3g1u n GLY 101 Ca 0.15 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 3g1u n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g1u s GLU 102 N -1.97 3.56 0.66 1.61 2.02 -0.89 -5.04 118.70 118.66 3g1u s GLU 102 Ca 0.00 1.55 -0.11 0.00 0.02 0.00 0.00 54.97 56.44 3g1u s GLU 102 Cb 0.00 -2.10 -0.01 0.00 0.10 0.00 0.00 34.13 32.12 3g1u s GLU 102 CO 0.00 -0.67 1.05 0.95 0.02 0.00 0.00 175.26 176.61 3g1u s THR 103 N -1.80 4.07 0.34 3.63 -4.23 -1.26 -4.87 115.64 111.51 3g1u s THR 103 Ca 0.70 0.62 0.09 0.00 -1.18 0.00 0.00 61.69 61.92 3g1u s THR 103 Cb -0.22 -3.66 0.32 0.00 1.34 0.00 0.00 72.50 70.29 3g1u s THR 103 CO 0.26 -0.85 1.80 0.44 -0.54 0.00 0.00 174.62 175.73 3g1u h ASP 104 N -0.46 0.69 -0.03 3.99 3.32 -1.99 -0.43 116.42 121.50 3g1u h ASP 104 Ca -0.45 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 3g1u h ASP 104 Cb 1.22 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 3g1u h ASP 104 CO 0.63 0.26 -0.04 -0.33 -1.72 0.00 0.00 179.24 178.04 3g1u h GLU 105 N 0.68 0.08 -0.84 3.56 5.08 -2.00 -2.49 114.58 118.66 3g1u h GLU 105 Ca 0.54 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.92 3g1u h GLU 105 Cb 0.95 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.15 3g1u h GLU 105 CO -0.31 0.56 0.55 0.93 -1.00 0.00 0.00 179.01 179.74 3g1u h GLU 106 N -0.39 0.89 0.56 2.33 5.08 -1.82 -0.37 114.58 120.86 3g1u h GLU 106 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3g1u h GLU 106 Cb 0.55 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3g1u h GLU 106 CO 0.01 0.59 -0.37 -0.92 -1.00 0.00 0.00 179.01 177.32 3g1u h TYR 107 N 0.91 -0.99 -0.68 4.33 3.20 -1.04 -0.64 116.97 122.07 3g1u h TYR 107 Ca 0.37 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.26 3g1u h TYR 107 Cb 0.25 0.36 -0.05 0.00 1.54 0.00 0.00 36.73 38.83 3g1u h TYR 107 CO -0.00 -0.56 0.42 0.93 -1.64 0.00 0.00 178.16 177.31 3g1u h GLU 108 N -0.89 0.78 -0.66 1.82 5.08 -1.14 -2.06 114.58 117.50 3g1u h GLU 108 Ca -0.07 -0.05 0.11 0.00 -1.00 0.00 0.00 59.36 58.36 3g1u h GLU 108 Cb 0.74 -0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.73 3g1u h GLU 108 CO 0.05 0.52 0.24 2.35 -1.00 0.00 0.00 179.01 181.17 3g1u h TRP 109 N 0.81 0.41 -0.05 4.33 7.01 -0.90 -1.87 115.95 125.68 3g1u h TRP 109 Ca 0.28 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.31 3g1u h TRP 109 Cb 0.05 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 27.03 3g1u h TRP 109 CO -0.05 0.07 0.03 0.00 -2.79 0.00 0.00 178.44 175.70 3g1u h ILE 111 N 0.01 1.18 0.00 0.00 2.04 -1.30 -2.04 117.51 117.40 3g1u h ILE 111 Ca 0.02 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3g1u h ILE 111 Cb 0.05 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.39 3g1u h ILE 111 CO -0.00 0.18 -0.09 0.00 0.00 0.00 0.00 178.15 178.24 3g1u h ALA 112 N 1.55 1.67 0.00 1.87 0.00 -0.84 -2.54 119.26 120.98 3g1u h ALA 112 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3g1u h ALA 112 Cb -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3g1u h ALA 112 CO -0.05 0.11 0.00 1.96 0.00 0.00 0.00 179.25 181.28 3g1u h GLN 113 N 0.00 0.00 -0.01 0.00 1.08 -0.83 -3.11 115.11 112.25 3g1u h GLN 113 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3g1u h GLN 113 Cb 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 3g1u h GLN 113 CO 0.01 0.00 -0.41 0.25 -0.95 0.00 0.00 178.83 177.73 3g1u n THR 114 N -2.43 0.00 -0.12 -0.54 -2.24 -0.96 -3.94 114.28 104.06 3g1u n THR 114 Ca 0.03 -0.10 0.09 0.00 -2.27 0.00 0.00 64.05 61.79 3g1u n THR 114 Cb 0.30 0.53 0.22 0.00 -2.10 0.00 0.00 70.33 69.28 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 -0.84 0.84 -3.99 2.28 0.31 -1.17 -4.63 118.33 111.12 3g1u n VAL 115 Ca 0.09 -0.92 -0.09 0.00 -0.01 0.00 0.00 64.34 63.41 3g1u n VAL 115 Cb 0.36 0.64 -0.06 0.00 -0.91 0.00 0.00 33.84 33.87 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 -1.08 1.44 0.00 5.55 -2.85 -1.25 -4.50 119.74 117.05 3g1u s LYS 116 Ca 0.34 -1.24 0.00 0.00 -1.00 0.00 0.00 55.97 54.08 3g1u s LYS 116 Cb 0.19 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.40 3g1u s LYS 116 CO 0.25 -0.58 0.00 0.41 0.10 0.00 0.00 175.35 175.52 3g1u n GLY 117 N -0.34 0.76 1.69 0.59 0.00 -0.75 -4.96 105.19 102.18 3g1u n GLY 117 Ca -0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 3g1u n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3g1u n PHE 118 N -2.29 -3.55 -2.05 1.61 3.01 -1.00 -4.96 117.46 108.24 3g1u n PHE 118 Ca 0.00 -0.49 -0.31 0.00 1.01 0.00 0.00 57.45 57.66 3g1u n PHE 118 Cb 0.00 -0.53 -0.00 0.00 -0.01 0.00 0.00 39.48 38.94 3g1u n PHE 118 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3g1u s SER 119 N -2.99 6.36 1.19 4.37 1.04 -1.26 -3.77 113.70 118.63 3g1u s SER 119 Ca 0.34 1.47 0.00 0.00 0.48 0.00 0.00 55.95 58.24 3g1u s SER 119 Cb -0.03 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.61 3g1u s SER 119 CO 0.26 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.31 3g1u n GLY 120 N -2.34 0.93 0.00 7.32 0.00 -1.26 -2.60 105.19 107.24 3g1u n GLY 120 Ca 0.06 -0.58 0.05 0.00 0.00 0.00 0.00 46.02 45.55 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 6.62 0.00 -0.01 1.61 3.85 -1.26 -4.86 116.55 122.51 3g1u n ASP 121 Ca 0.00 0.13 -0.00 0.00 -0.71 0.00 0.00 54.79 54.21 3g1u n ASP 121 Cb 0.00 -0.29 -0.00 0.00 -1.35 0.00 0.00 41.12 39.48 3g1u n ASP 121 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3g1u n GLY 122 N -0.37 0.47 3.78 6.12 0.00 -1.07 -4.89 105.19 109.23 3g1u n GLY 122 Ca 0.05 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.02 3.92 0.69 0.99 1.43 -1.26 -1.81 118.68 122.62 3g1u s LEU 123 Ca 0.00 0.20 -0.14 0.00 -1.03 0.00 0.00 54.13 53.16 3g1u s LEU 123 Cb 0.00 -2.18 0.02 0.00 0.03 0.00 0.00 46.19 44.06 3g1u s LEU 123 CO 0.00 0.31 1.11 -2.16 0.23 0.00 0.00 176.35 175.84 3g1u s PRO 124 N -1.50 2.65 0.00 1.29 0.04 -1.26 -4.87 135.00 131.35 3g1u s PRO 124 Ca 0.20 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.58 3g1u s PRO 124 Cb -0.12 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.49 3g1u s PRO 124 CO 0.11 -1.36 0.37 0.27 0.04 0.00 0.00 177.00 176.43 3g1u n ASN 125 N -2.72 0.74 -3.95 6.66 0.23 -0.34 -4.63 115.26 111.26 3g1u n ASN 125 Ca 0.10 -0.92 -0.10 0.00 -0.53 0.00 0.00 54.58 53.14 3g1u n ASN 125 Cb 0.52 0.13 -0.12 0.00 -2.08 0.00 0.00 39.78 38.24 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 -0.13 0.25 -0.10 -3.83 -1.94 -0.87 -0.09 119.30 112.59 3g1u s MET 126 Ca 0.00 -0.46 0.03 0.00 -1.71 0.00 0.00 55.69 53.55 3g1u s MET 126 Cb 0.00 0.09 0.01 0.00 2.01 0.00 0.00 34.83 36.94 3g1u s MET 126 CO 0.00 -0.04 -0.19 0.42 -0.01 0.00 0.00 175.02 175.20 3g1u s ILE 127 N -1.14 1.72 -0.25 2.53 1.01 -0.35 -1.55 121.20 123.18 3g1u s ILE 127 Ca -0.12 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.70 3g1u s ILE 127 Cb -0.08 -1.52 0.03 0.00 0.01 0.00 0.00 42.46 40.89 3g1u s ILE 127 CO -0.01 0.49 -0.06 -0.22 0.00 0.00 0.00 174.94 175.14 3g1u s LEU 128 N 0.61 3.20 0.10 2.97 0.20 -0.56 -1.45 118.68 123.76 3g1u s LEU 128 Ca -0.14 -0.87 0.04 0.00 0.69 0.00 0.00 54.13 53.85 3g1u s LEU 128 Cb -0.17 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.89 3g1u s LEU 128 CO 0.04 -0.13 -0.10 -0.62 -0.29 0.00 0.00 176.35 175.25 3g1u s ASP 129 N 1.33 1.54 -0.29 3.68 2.15 -0.14 -1.28 116.67 123.65 3g1u s ASP 129 Ca 0.00 -0.83 -0.03 0.00 0.43 0.00 0.00 52.55 52.11 3g1u s ASP 129 Cb -0.17 -0.00 0.10 0.00 -0.30 0.00 0.00 42.92 42.55 3g1u s ASP 129 CO -0.04 -0.26 0.12 -0.62 -0.17 0.00 0.00 175.17 174.20 3g1u s ASP 130 N -2.52 3.62 0.00 -0.34 -1.08 -0.84 -1.74 116.67 113.76 3g1u s ASP 130 Ca 0.07 -1.34 0.00 0.00 -0.52 0.00 0.00 52.55 50.76 3g1u s ASP 130 Cb -0.02 -0.44 0.00 0.00 -1.46 0.00 0.00 42.92 41.00 3g1u s ASP 130 CO 0.00 -0.44 0.00 0.61 0.52 0.00 0.00 175.17 175.87 3g1u n GLY 131 N 5.18 3.14 0.16 2.66 0.00 -1.26 -4.62 105.19 110.45 3g1u n GLY 131 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.29 0.41 0.28 -0.02 0.00 -1.26 -4.10 105.19 99.20 3g1u n GLY 132 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 0.31 0.18 1.61 5.19 -1.96 -0.13 116.42 121.63 3g1u h ASP 133 Ca 0.00 0.11 -0.26 0.00 -0.62 0.00 0.00 57.03 56.26 3g1u h ASP 133 Cb 0.00 0.08 0.02 0.00 0.18 0.00 0.00 39.33 39.61 3g1u h ASP 133 CO 0.00 0.11 -1.06 0.25 -3.12 0.00 0.00 179.24 175.43 3g1u h LEU 134 N 0.46 0.74 -0.18 1.55 5.85 -1.93 -0.93 115.31 120.88 3g1u h LEU 134 Ca 0.43 -0.62 0.04 0.00 0.84 0.00 0.00 57.88 58.57 3g1u h LEU 134 Cb 0.66 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3g1u h LEU 134 CO -0.41 1.43 -0.06 0.74 -0.34 0.00 0.00 178.44 179.80 3g1u h THR 135 N 0.30 0.79 -0.41 1.05 2.02 -1.91 -1.10 112.91 113.65 3g1u h THR 135 Ca -0.12 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 3g1u h THR 135 Cb 1.71 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 3g1u h THR 135 CO 0.20 0.00 0.16 0.78 0.37 0.00 0.00 175.52 177.03 3g1u h ASN 136 N -0.02 0.56 -0.45 4.18 2.35 -1.00 -2.10 115.58 119.11 3g1u h ASN 136 Ca 0.09 -0.17 0.07 0.00 -0.55 0.00 0.00 56.30 55.74 3g1u h ASN 136 Cb 0.16 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 3g1u h ASN 136 CO -0.20 0.58 0.09 0.25 -1.65 0.00 0.00 177.43 176.50 3g1u h LEU 137 N 0.51 0.02 -0.03 1.61 5.85 -0.95 0.18 115.31 122.49 3g1u h LEU 137 Ca 0.14 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3g1u h LEU 137 Cb 0.19 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 3g1u h LEU 137 CO -0.01 0.04 -0.00 0.58 -0.34 0.00 0.00 178.44 178.71 3g1u h VAL 138 N 0.23 1.28 0.05 1.05 2.07 -1.13 0.07 116.25 119.87 3g1u h VAL 138 Ca 0.22 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 3g1u h VAL 138 Cb 0.28 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3g1u h VAL 138 CO -0.28 0.23 -0.02 0.40 0.02 0.00 0.00 177.57 177.91 3g1u h ILE 139 N -0.28 1.05 0.03 4.57 2.04 -1.22 -2.09 117.51 121.60 3g1u h ILE 139 Ca 0.01 -0.30 -0.22 0.00 1.00 0.00 0.00 64.86 65.34 3g1u h ILE 139 Cb 0.37 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 3g1u h ILE 139 CO 0.00 0.08 -1.04 0.44 0.00 0.00 0.00 178.15 177.63 3g1u h ASP 140 N -0.20 0.11 0.00 1.72 3.32 -0.70 -3.38 116.42 117.29 3g1u h ASP 140 Ca -0.01 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.93 3g1u h ASP 140 Cb 0.18 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3g1u h ASP 140 CO 0.01 1.07 -0.74 0.54 -1.72 0.00 0.00 179.24 178.40 3g1u n ARG 141 N -3.42 2.80 -3.17 3.56 5.12 0.00 -4.74 116.66 116.82 3g1u n ARG 141 Ca -0.02 -0.03 -0.24 0.00 -1.93 0.00 0.00 57.85 55.63 3g1u n ARG 141 Cb 0.94 -0.95 -0.05 0.00 -1.16 0.00 0.00 32.46 31.24 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 -1.40 2.28 0.24 -1.55 4.01 -0.79 -4.94 117.16 115.02 3g1u n TYR 142 Ca 0.00 -3.92 0.08 0.00 -0.16 0.00 0.00 57.90 53.90 3g1u n TYR 142 Cb 0.12 -0.47 0.59 0.00 -0.31 0.00 0.00 39.34 39.27 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 3.48 0.00 0.00 -0.72 0.13 -1.74 -1.58 132.00 131.57 3g1u h PRO 143 Ca 0.13 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 3g1u h PRO 143 Cb 0.72 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 3g1u h PRO 143 CO 0.69 0.15 -0.14 1.05 -0.23 0.00 0.00 178.00 179.52 3g1u h GLU 144 N 0.00 0.00 0.01 0.86 9.09 -1.92 -3.16 114.58 119.46 3g1u h GLU 144 Ca -0.00 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.14 3g1u h GLU 144 Cb 0.28 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.34 3g1u h GLU 144 CO 0.02 0.14 -1.51 1.25 0.05 0.00 0.00 179.01 178.96 3g1u h LEU 145 N 0.00 0.03 -0.98 3.06 5.85 -1.62 -3.39 115.31 118.26 3g1u h LEU 145 Ca -0.00 -0.05 0.23 0.00 0.84 0.00 0.00 57.88 58.90 3g1u h LEU 145 Cb 0.46 -0.01 -0.18 0.00 0.37 0.00 0.00 40.66 41.30 3g1u h LEU 145 CO 0.02 1.04 -0.11 0.58 -0.34 0.00 0.00 178.44 179.63 3g1u h VAL 146 N 0.01 0.03 0.00 1.05 2.07 -1.49 0.45 116.25 118.36 3g1u h VAL 146 Ca -0.21 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3g1u h VAL 146 Cb 1.95 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3g1u h VAL 146 CO 0.10 0.00 0.00 -2.65 0.02 0.00 0.00 177.57 175.04 3g1u n PRO 147 N -5.55 0.36 0.00 1.57 -0.02 -1.26 -2.25 135.00 127.85 3g1u n PRO 147 Ca 0.19 0.08 0.10 0.00 -2.02 0.00 0.00 63.50 61.85 3g1u n PRO 147 Cb 0.61 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.54 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 -1.21 0.08 -3.15 -0.52 5.02 0.14 -4.88 118.16 113.65 3g1u n LYS 148 Ca 0.10 -0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 3g1u n LYS 148 Cb 0.13 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.57 3g1u n LYS 148 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3g1u s ILE 149 N -2.96 4.91 -0.24 -0.18 -1.09 -0.95 -4.42 121.20 116.27 3g1u s ILE 149 Ca 0.09 0.42 0.24 0.00 -2.23 0.00 0.00 60.65 59.17 3g1u s ILE 149 Cb 0.16 -4.07 0.30 0.00 -1.58 0.00 0.00 42.46 37.27 3g1u s ILE 149 CO 0.82 -0.34 1.68 -0.26 -1.23 0.00 0.00 174.94 175.61 3g1u h PHE 150 N 8.54 0.00 -1.11 3.97 0.04 -0.81 -3.46 116.94 124.11 3g1u h PHE 150 Ca -0.27 0.00 0.26 0.00 2.80 0.00 0.00 57.97 60.76 3g1u h PHE 150 Cb 1.11 0.00 -0.25 0.00 2.20 0.00 0.00 35.95 39.01 3g1u h PHE 150 CO 0.74 0.10 0.93 0.20 -0.60 0.00 0.00 178.31 179.68 3g1u s GLY 151 N -4.25 -0.02 -0.10 -1.45 0.00 -1.26 -4.66 107.32 95.59 3g1u s GLY 151 Ca 0.05 2.49 0.02 0.00 0.00 0.00 0.00 44.72 47.28 3g1u s GLY 151 CO 0.65 0.95 -0.16 -0.42 0.00 0.00 0.00 173.10 174.13 3g1u s ILE 152 N -1.37 2.86 -0.13 0.90 1.01 -0.12 -1.21 121.20 123.15 3g1u s ILE 152 Ca 0.09 -0.75 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 3g1u s ILE 152 Cb -0.01 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 3g1u s ILE 152 CO -0.06 0.55 -0.10 -0.94 0.00 0.00 0.00 174.94 174.39 3g1u s SER 153 N -0.02 4.26 -0.12 3.58 1.04 -0.53 0.37 113.70 122.29 3g1u s SER 153 Ca -0.04 -0.25 0.01 0.00 0.48 0.00 0.00 55.95 56.15 3g1u s SER 153 Cb -0.14 -1.58 -0.01 0.00 0.10 0.00 0.00 66.02 64.38 3g1u s SER 153 CO 0.04 0.19 -0.16 -0.70 0.98 0.00 0.00 173.24 173.60 3g1u s GLU 154 N 0.21 3.23 -0.01 4.02 2.56 -0.86 -0.97 118.70 126.88 3g1u s GLU 154 Ca -0.06 -0.73 -0.08 0.00 0.00 0.00 0.00 54.97 54.10 3g1u s GLU 154 Cb -0.15 -2.54 -0.30 0.00 2.00 0.00 0.00 34.13 33.15 3g1u s GLU 154 CO 0.04 0.25 0.82 1.49 -0.56 0.00 0.00 175.26 177.30 3g1u h GLU 155 N 6.57 0.35 -5.79 4.30 4.57 -1.67 -1.96 114.58 120.94 3g1u h GLU 155 Ca -0.26 -0.59 -0.52 0.00 -1.18 0.00 0.00 59.36 56.81 3g1u h GLU 155 Cb 1.21 0.22 -0.14 0.00 -0.16 0.00 0.00 28.75 29.88 3g1u h GLU 155 CO 0.53 1.24 -0.73 -0.08 -1.18 0.00 0.00 179.01 178.79 3g1u s THR 156 N -2.60 1.99 0.13 0.32 -1.32 -1.26 -3.29 115.64 109.61 3g1u s THR 156 Ca -0.11 -2.27 -0.23 0.00 -1.21 0.00 0.00 61.69 57.87 3g1u s THR 156 Cb 0.06 -2.21 -0.03 0.00 -1.51 0.00 0.00 72.50 68.81 3g1u s THR 156 CO 0.87 -0.47 1.66 0.74 -2.21 0.00 0.00 174.62 175.20 3g1u h THR 157 N 2.40 0.53 -0.39 5.08 2.02 -1.94 -1.13 112.91 119.48 3g1u h THR 157 Ca -0.39 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 3g1u h THR 157 Cb 1.24 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 3g1u h THR 157 CO 0.62 0.00 0.02 0.71 0.37 0.00 0.00 175.52 177.25 3g1u h THR 158 N -0.27 1.21 -0.63 3.16 1.35 -1.94 -0.14 112.91 115.65 3g1u h THR 158 Ca 0.08 -0.81 0.03 0.00 -0.55 0.00 0.00 66.41 65.17 3g1u h THR 158 Cb 0.38 0.89 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 3g1u h THR 158 CO -0.23 0.28 0.38 1.23 -0.25 0.00 0.00 175.52 176.93 3g1u h GLY 159 N 0.87 0.90 0.97 5.82 0.00 -1.64 -0.43 103.07 109.57 3g1u h GLY 159 Ca 0.12 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 47.10 3g1u h GLY 159 CO 0.01 0.24 -0.00 -2.08 0.00 0.00 0.00 176.54 174.70 3g1u h VAL 160 N 0.75 1.26 -0.82 4.60 2.07 -0.15 -1.83 116.25 122.14 3g1u h VAL 160 Ca 0.26 -1.04 0.08 0.00 0.82 0.00 0.00 66.70 66.82 3g1u h VAL 160 Cb 0.04 1.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 3g1u h VAL 160 CO -0.11 0.36 0.48 0.11 0.02 0.00 0.00 177.57 178.42 3g1u h LYS 161 N 0.61 0.80 -0.40 1.57 1.57 -0.80 -1.51 116.57 118.40 3g1u h LYS 161 Ca 0.12 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 3g1u h LYS 161 Cb 0.49 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 3g1u h LYS 161 CO 0.02 0.53 -0.01 -0.97 -0.57 0.00 0.00 179.45 178.45 3g1u h ASN 162 N 0.82 0.61 -0.42 0.86 -1.24 -0.90 -1.74 115.58 113.57 3g1u h ASN 162 Ca 0.38 -0.14 -0.02 0.00 0.71 0.00 0.00 56.30 57.24 3g1u h ASN 162 Cb 0.30 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 3g1u h ASN 162 CO -0.22 0.69 0.19 -0.07 -1.29 0.00 0.00 177.43 176.73 3g1u h LEU 163 N 0.61 0.56 -0.20 0.34 3.38 -0.42 -1.92 115.31 117.66 3g1u h LEU 163 Ca 0.12 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3g1u h LEU 163 Cb 0.40 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3g1u h LEU 163 CO 0.02 0.54 -0.13 1.88 0.09 0.00 0.00 178.44 180.84 3g1u h TYR 164 N 0.53 0.51 -0.43 1.13 0.05 -1.31 -0.99 116.97 116.46 3g1u h TYR 164 Ca 0.14 -0.13 0.08 0.00 0.05 0.00 0.00 58.73 58.87 3g1u h TYR 164 Cb 0.15 -0.11 -0.08 0.00 1.01 0.00 0.00 36.73 37.70 3g1u h TYR 164 CO -0.01 0.75 -0.05 -0.22 -1.05 0.00 0.00 178.16 177.58 3g1u h LYS 165 N 0.12 0.05 0.04 4.88 3.64 -1.33 0.91 116.57 124.88 3g1u h LYS 165 Ca 0.04 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 3g1u h LYS 165 Cb 0.63 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 3g1u h LYS 165 CO 0.03 0.03 -0.23 0.00 -2.27 0.00 0.00 179.45 177.02 3g1u h ARG 166 N 0.05 -0.37 -0.87 1.90 3.08 -1.28 -2.69 114.38 114.21 3g1u h ARG 166 Ca 0.21 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.38 3g1u h ARG 166 Cb 0.31 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.37 3g1u h ARG 166 CO -0.40 -0.25 0.51 1.25 -1.07 0.00 0.00 179.97 180.02 3g1u h LEU 167 N -0.39 0.74 -0.53 3.04 5.85 -0.71 0.47 115.31 123.78 3g1u h LEU 167 Ca 0.05 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3g1u h LEU 167 Cb 0.45 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.38 3g1u h LEU 167 CO -0.18 0.42 0.00 -1.54 -0.34 0.00 0.00 178.44 176.80 3g1u n SER 168 N -4.71 0.46 -0.74 1.25 3.41 0.27 -2.14 113.62 111.42 3g1u n SER 168 Ca 0.15 0.62 0.07 0.00 -0.26 0.00 0.00 58.87 59.45 3g1u n SER 168 Cb 0.29 -0.72 0.16 0.00 -0.26 0.00 0.00 64.21 63.68 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 -2.02 2.38 -1.37 4.33 5.02 -0.47 -4.96 118.16 121.07 3g1u n LYS 169 Ca 0.02 -1.98 -0.10 0.00 -2.02 0.00 0.00 58.31 54.24 3g1u n LYS 169 Cb 0.19 -1.32 -0.04 0.00 -0.02 0.00 0.00 35.03 33.85 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 0.77 1.00 1.36 0.72 0.00 -0.91 -4.94 105.19 103.19 3g1u n GLY 170 Ca 0.13 -0.58 0.09 0.00 0.00 0.00 0.00 46.02 45.66 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 0.42 4.32 -4.11 1.61 3.02 0.03 -4.85 115.26 115.70 3g1u n ASN 171 Ca -0.10 -2.37 -0.36 0.00 -0.03 0.00 0.00 54.58 51.72 3g1u n ASN 171 Cb 0.34 -0.51 -0.12 0.00 -0.61 0.00 0.00 39.78 38.88 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 -1.69 5.24 0.00 3.41 2.96 -1.24 -4.79 118.68 122.56 3g1u s LEU 172 Ca 0.46 -2.08 0.25 0.00 -0.22 0.00 0.00 54.13 52.54 3g1u s LEU 172 Cb 0.29 -1.82 0.52 0.00 0.50 0.00 0.00 46.19 45.68 3g1u s LEU 172 CO 0.23 -0.53 1.42 -0.81 -1.32 0.00 0.00 176.35 175.34 3g1u n PRO 173 N 4.52 1.03 -5.01 0.98 -0.04 -1.26 -4.63 135.00 130.59 3g1u n PRO 173 Ca -0.01 -0.70 -0.31 0.00 -0.04 0.00 0.00 63.50 62.43 3g1u n PRO 173 Cb 0.41 -1.49 -0.15 0.00 -0.04 0.00 0.00 33.50 32.24 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 -2.46 2.32 0.39 0.52 1.01 -1.26 -0.75 121.20 120.97 3g1u s ILE 174 Ca 0.23 -1.18 -0.24 0.00 0.00 0.00 0.00 60.65 59.46 3g1u s ILE 174 Cb 0.19 -1.88 -0.10 0.00 0.01 0.00 0.00 42.46 40.68 3g1u s ILE 174 CO 0.52 0.46 1.00 -0.44 0.00 0.00 0.00 174.94 176.49 3g1u s SER 175 N -0.99 6.94 0.04 3.58 0.01 -1.23 -4.61 113.70 117.44 3g1u s SER 175 Ca 0.12 1.91 0.05 0.00 1.31 0.00 0.00 55.95 59.34 3g1u s SER 175 Cb -0.10 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.53 3g1u s SER 175 CO 0.01 -0.36 -0.15 0.00 0.41 0.00 0.00 173.24 173.15 3g1u s ALA 176 N -1.75 1.28 -0.23 1.44 0.00 -0.41 -0.94 121.76 121.15 3g1u s ALA 176 Ca 0.57 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 51.58 3g1u s ALA 176 Cb -0.18 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 3g1u s ALA 176 CO 0.23 0.26 0.13 0.42 0.00 0.00 0.00 175.76 176.80 3g1u s ILE 177 N -0.80 5.13 -0.67 0.00 1.01 0.16 -0.61 121.20 125.43 3g1u s ILE 177 Ca 0.03 0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.51 3g1u s ILE 177 Cb -0.08 -3.38 0.02 0.00 0.01 0.00 0.00 42.46 39.04 3g1u s ILE 177 CO 0.01 0.37 1.33 0.21 0.00 0.00 0.00 174.94 176.86 3g1u s ASN 178 N 0.98 6.14 0.08 3.58 3.84 0.20 -2.03 114.94 127.73 3g1u s ASN 178 Ca 0.06 -0.17 0.18 0.00 0.21 0.00 0.00 52.86 53.15 3g1u s ASN 178 Cb -0.13 -2.55 -0.12 0.00 -0.55 0.00 0.00 41.25 37.89 3g1u s ASN 178 CO 0.04 -1.80 0.83 0.52 -2.79 0.00 0.00 177.10 173.90 3g1u n VAL 179 N 6.57 1.04 -0.28 -5.21 0.31 -0.75 -3.67 118.33 116.35 3g1u n VAL 179 Ca 0.07 -0.66 -0.00 0.00 -0.01 0.00 0.00 64.34 63.74 3g1u n VAL 179 Cb 0.49 -0.63 0.13 0.00 -0.91 0.00 0.00 33.84 32.92 3g1u n VAL 179 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 3g1u h ASN 180 N 0.00 0.71 -0.30 4.52 -1.24 -1.53 -2.81 115.58 114.93 3g1u h ASN 180 Ca -0.14 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.90 3g1u h ASN 180 Cb 1.47 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 40.40 3g1u h ASN 180 CO 0.03 0.45 0.00 0.47 -1.29 0.00 0.00 177.43 177.09 3g1u n ASP 181 N -4.70 2.94 0.17 1.15 8.00 -1.26 -0.93 116.55 121.93 3g1u n ASP 181 Ca 0.11 -1.92 0.14 0.00 0.71 0.00 0.00 54.79 53.83 3g1u n ASP 181 Cb 0.18 -0.19 0.48 0.00 -0.02 0.00 0.00 41.12 41.57 3g1u n ASP 181 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3g1u h SER 182 N 3.88 0.00 0.00 -2.24 4.64 -1.57 -3.50 113.55 114.76 3g1u h SER 182 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g1u h SER 182 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3g1u h SER 182 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 3g1u n SER 186 N -2.58 0.00 0.12 4.97 3.41 -0.10 -5.02 113.62 114.42 3g1u n SER 186 Ca 0.03 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.81 3g1u n SER 186 Cb 0.33 0.00 0.75 0.00 -0.26 0.00 0.00 64.21 65.03 3g1u n SER 186 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3g1u h LYS 187 N 0.18 0.00 0.00 4.33 1.57 -1.97 -2.62 116.57 118.06 3g1u h LYS 187 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g1u h LYS 187 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3g1u h LYS 187 CO 0.00 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.07 3g1u n PHE 188 N -4.07 0.00 -0.04 -1.35 3.72 -1.26 -4.38 117.46 110.08 3g1u n PHE 188 Ca 0.05 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.44 3g1u n PHE 188 Cb 0.44 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.97 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 -2.08 -0.09 -0.11 4.37 4.64 -1.26 -1.94 116.55 120.07 3g1u n ASP 189 Ca 0.00 0.90 -0.10 0.00 -1.38 0.00 0.00 54.79 54.21 3g1u n ASP 189 Cb 0.00 -0.39 -0.02 0.00 -1.04 0.00 0.00 41.12 39.66 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 0.53 0.00 1.67 4.21 -1.77 0.53 115.58 120.75 3g1u h ASN 190 Ca 0.01 -0.26 -0.01 0.00 1.21 0.00 0.00 56.30 57.26 3g1u h ASN 190 Cb 0.04 -0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 37.09 3g1u h ASN 190 CO -0.08 0.66 -0.10 0.25 -1.29 0.00 0.00 177.43 176.86 3g1u h LEU 191 N 0.39 0.00 -1.13 1.61 6.46 -1.43 -2.87 115.31 118.33 3g1u h LEU 191 Ca 0.10 -0.19 -0.04 0.00 -0.12 0.00 0.00 57.88 57.63 3g1u h LEU 191 Cb 0.35 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.26 3g1u h LEU 191 CO 0.01 0.65 0.17 1.88 -0.62 0.00 0.00 178.44 180.52 3g1u h TYR 192 N -1.00 0.79 0.47 1.25 0.05 -1.50 -1.29 116.97 115.75 3g1u h TYR 192 Ca -0.01 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.69 3g1u h TYR 192 Cb 0.28 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.78 3g1u h TYR 192 CO 0.03 0.64 -0.23 0.78 -1.05 0.00 0.00 178.16 178.33 3g1u h GLY 193 N 0.92 -0.66 1.65 3.88 0.00 -0.82 -3.14 103.07 104.91 3g1u h GLY 193 Ca 0.18 0.25 -0.10 0.00 0.00 0.00 0.00 47.33 47.65 3g1u h GLY 193 CO -0.01 -0.24 -0.31 0.00 0.00 0.00 0.00 176.54 175.97 3g1u h ARG 195 N 0.34 0.00 0.00 0.00 2.43 -1.19 -2.01 114.38 113.96 3g1u h ARG 195 Ca 0.04 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.10 3g1u h ARG 195 Cb 0.73 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 3g1u h ARG 195 CO 0.06 0.00 -1.45 0.39 -1.51 0.00 0.00 179.97 177.46 3g1u n GLU 196 N -2.70 2.87 0.04 0.20 1.02 -1.03 -4.53 120.64 116.51 3g1u n GLU 196 Ca -0.02 -0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.23 3g1u n GLU 196 Cb 0.10 -1.17 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 -2.25 0.58 0.15 1.62 3.41 -0.63 -3.76 113.62 112.74 3g1u n SER 197 Ca -0.11 -0.06 -0.13 0.00 -0.26 0.00 0.00 58.87 58.31 3g1u n SER 197 Cb 0.71 0.86 -0.08 0.00 -0.26 0.00 0.00 64.21 65.44 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 -0.34 -0.99 1.04 5.85 -1.62 -2.17 115.31 117.07 3g1u h LEU 198 Ca 0.00 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.47 3g1u h LEU 198 Cb 0.82 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 3g1u h LEU 198 CO 0.00 0.03 -0.00 0.58 -0.34 0.00 0.00 178.44 178.71 3g1u h VAL 199 N -0.77 1.23 -0.30 1.05 2.07 -1.81 -1.73 116.25 116.00 3g1u h VAL 199 Ca -0.04 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.58 3g1u h VAL 199 Cb 0.50 0.90 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3g1u h VAL 199 CO 0.07 0.34 -0.06 -0.78 0.02 0.00 0.00 177.57 177.15 3g1u h ASP 200 N 0.68 -0.25 0.12 0.57 3.58 -1.65 0.34 116.42 119.81 3g1u h ASP 200 Ca 0.14 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.68 3g1u h ASP 200 Cb 0.43 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 3g1u h ASP 200 CO 0.02 -0.09 -0.11 1.23 -2.88 0.00 0.00 179.24 177.41 3g1u h GLY 201 N 0.02 -0.23 0.80 -0.78 0.00 -1.08 -1.31 103.07 100.49 3g1u h GLY 201 Ca 0.15 0.12 0.05 0.00 0.00 0.00 0.00 47.33 47.65 3g1u h GLY 201 CO -0.30 -0.11 0.62 -2.22 0.00 0.00 0.00 176.54 174.53 3g1u h ILE 202 N -0.25 1.12 -0.13 2.60 2.04 -1.10 -2.24 117.51 119.54 3g1u h ILE 202 Ca 0.00 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.40 3g1u h ILE 202 Cb 0.24 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.16 3g1u h ILE 202 CO -0.03 0.21 -0.17 0.11 0.00 0.00 0.00 178.15 178.28 3g1u h LYS 203 N 1.16 0.35 -0.55 2.37 1.79 -0.23 -1.16 116.57 120.31 3g1u h LYS 203 Ca 0.40 -0.20 -0.02 0.00 -2.18 0.00 0.00 60.65 58.65 3g1u h LYS 203 Cb 0.09 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 3g1u h LYS 203 CO -0.15 0.76 0.24 0.00 -1.08 0.00 0.00 179.45 179.23 3g1u h ARG 204 N -0.04 0.77 -0.15 3.15 3.08 -1.19 0.62 114.38 120.62 3g1u h ARG 204 Ca 0.02 -0.10 -0.22 0.00 0.07 0.00 0.00 59.98 59.74 3g1u h ARG 204 Cb 0.72 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.63 3g1u h ARG 204 CO 0.04 0.62 -0.78 0.00 -1.07 0.00 0.00 179.97 178.78 3g1u h ALA 205 N 1.50 0.32 0.00 0.04 0.00 -1.36 -3.41 119.26 116.35 3g1u h ALA 205 Ca 0.19 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3g1u h ALA 205 Cb 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3g1u h ALA 205 CO -0.02 0.69 -0.19 0.25 0.00 0.00 0.00 179.25 179.97 3g1u n THR 206 N -3.93 0.00 -0.83 0.00 -2.24 -0.45 -4.95 114.28 101.88 3g1u n THR 206 Ca -0.07 -0.12 -0.01 0.00 -2.27 0.00 0.00 64.05 61.58 3g1u n THR 206 Cb 0.75 0.65 -0.00 0.00 -2.10 0.00 0.00 70.33 69.63 3g1u n THR 206 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g1u n ASP 207 N -0.53 -4.80 -4.74 3.42 8.00 0.20 -4.93 116.55 113.16 3g1u n ASP 207 Ca 0.00 0.02 -0.40 0.00 0.71 0.00 0.00 54.79 55.11 3g1u n ASP 207 Cb 0.00 -2.96 0.01 0.00 -0.02 0.00 0.00 41.12 38.16 3g1u n ASP 207 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3g1u n VAL 208 N -1.63 2.62 -2.47 2.53 3.14 -1.26 -4.98 118.33 116.27 3g1u n VAL 208 Ca -0.01 -0.50 -0.41 0.00 -2.96 0.00 0.00 64.34 60.46 3g1u n VAL 208 Cb 0.41 -1.76 -0.04 0.00 -1.06 0.00 0.00 33.84 31.39 3g1u n VAL 208 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 3g1u s MET 209 N -2.32 4.59 -0.06 1.45 1.75 -1.26 -4.88 119.30 118.57 3g1u s MET 209 Ca 0.60 1.78 -0.11 0.00 -1.25 0.00 0.00 55.69 56.71 3g1u s MET 209 Cb -0.47 -3.24 -0.30 0.00 2.84 0.00 0.00 34.83 33.65 3g1u s MET 209 CO 0.58 0.09 0.62 0.82 -0.65 0.00 0.00 175.02 176.48 3g1u h ILE 210 N 3.54 0.89 -3.00 10.11 1.08 -1.94 -3.44 117.51 124.75 3g1u h ILE 210 Ca -0.45 -2.48 -0.56 0.00 -0.39 0.00 0.00 64.86 60.98 3g1u h ILE 210 Cb 1.21 2.72 0.09 0.00 -3.07 0.00 0.00 36.82 37.77 3g1u h ILE 210 CO 0.71 0.86 0.74 0.00 -0.69 0.00 0.00 178.15 179.77 3g1u n ALA 211 N -2.89 1.83 0.00 1.87 0.00 -1.14 -2.25 120.51 117.93 3g1u n ALA 211 Ca -0.26 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.57 3g1u n ALA 211 Cb 1.06 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 18.14 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 2.09 3.23 3.83 0.00 0.00 -0.64 -4.90 105.19 108.78 3g1u n GLY 212 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.53 3.74 -0.23 1.61 -0.14 -0.95 -4.84 119.74 118.40 3g1u s LYS 213 Ca 0.00 1.06 -0.08 0.00 -1.36 0.00 0.00 55.97 55.59 3g1u s LYS 213 Cb 0.00 -2.10 -0.04 0.00 -1.68 0.00 0.00 37.83 34.01 3g1u s LYS 213 CO 0.00 -0.45 0.09 0.99 -0.76 0.00 0.00 175.35 175.22 3g1u s THR 214 N -2.52 4.75 0.02 2.17 2.01 -1.26 -0.34 115.64 120.47 3g1u s THR 214 Ca 0.61 -0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.66 3g1u s THR 214 Cb -0.12 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 3g1u s THR 214 CO 0.32 0.37 -0.24 0.00 -0.69 0.00 0.00 174.62 174.38 3g1u s VAL 217 N 1.49 4.07 -0.32 0.00 1.01 0.09 -0.52 120.40 126.22 3g1u s VAL 217 Ca 0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.28 3g1u s VAL 217 Cb -0.18 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 3g1u s VAL 217 CO 0.03 0.16 0.55 0.00 0.00 0.00 0.00 175.10 175.84 3g1u n GLY 219 N 4.59 0.10 2.70 0.00 0.00 0.17 -0.96 105.19 111.79 3g1u n GLY 219 Ca -0.03 -1.56 -0.07 0.00 0.00 0.00 0.00 46.02 44.36 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 0.52 0.12 -0.80 1.61 9.36 -1.26 -4.38 117.16 122.33 3g1u n TYR 220 Ca 0.00 -2.41 0.00 0.00 3.32 0.00 0.00 57.90 58.81 3g1u n TYR 220 Cb 0.00 0.23 0.00 0.00 -0.63 0.00 0.00 39.34 38.94 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 -0.38 -0.68 0.38 2.98 0.00 -1.26 -4.67 105.19 101.56 3g1u n GLY 221 Ca 0.04 -1.70 0.15 0.00 0.00 0.00 0.00 46.02 44.51 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 0.49 0.39 1.61 3.32 -1.94 -0.15 116.42 120.14 3g1u h ASP 222 Ca 0.00 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3g1u h ASP 222 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3g1u h ASP 222 CO 0.00 0.24 -0.19 0.58 -1.72 0.00 0.00 179.24 178.15 3g1u h VAL 223 N 0.51 0.53 -0.75 -1.35 2.07 -1.91 -2.61 116.25 112.75 3g1u h VAL 223 Ca 0.42 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.51 3g1u h VAL 223 Cb 0.88 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 3g1u h VAL 223 CO -0.17 0.09 0.49 1.23 0.02 0.00 0.00 177.57 179.24 3g1u h GLY 224 N -0.87 0.89 0.89 2.17 0.00 -1.67 -1.64 103.07 102.84 3g1u h GLY 224 Ca -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 3g1u h GLY 224 CO 0.09 0.13 0.06 0.50 0.00 0.00 0.00 176.54 177.32 3g1u h LYS 225 N 0.60 0.49 -0.08 4.80 1.57 -1.02 -0.89 116.57 122.04 3g1u h LYS 225 Ca 0.35 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3g1u h LYS 225 Cb 0.57 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 3g1u h LYS 225 CO -0.13 0.58 0.05 0.78 -0.57 0.00 0.00 179.45 180.16 3g1u h GLY 226 N 0.32 0.12 0.81 3.86 0.00 -1.17 -0.34 103.07 106.67 3g1u h GLY 226 Ca 0.09 -0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.38 3g1u h GLY 226 CO 0.00 0.05 -0.07 0.00 0.00 0.00 0.00 176.54 176.52 3g1u h ALA 228 N 0.86 0.75 -0.91 0.00 0.00 -1.12 -1.16 119.26 117.68 3g1u h ALA 228 Ca 0.03 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3g1u h ALA 228 Cb 0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 3g1u h ALA 228 CO -0.08 0.17 0.58 0.00 0.00 0.00 0.00 179.25 179.93 3g1u h ALA 229 N 1.22 1.24 0.11 0.00 0.00 -0.74 -0.97 119.26 120.13 3g1u h ALA 229 Ca 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3g1u h ALA 229 Cb -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.43 3g1u h ALA 229 CO -0.05 0.39 -0.05 0.00 0.00 0.00 0.00 179.25 179.53 3g1u h ALA 230 N 1.40 -0.15 -0.43 0.00 0.00 -0.38 -1.06 119.26 118.65 3g1u h ALA 230 Ca 0.38 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3g1u h ALA 230 Cb 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3g1u h ALA 230 CO -0.15 -0.45 0.26 -0.07 0.00 0.00 0.00 179.25 178.84 3g1u h LEU 231 N -0.43 0.51 -0.49 0.00 3.38 -1.15 -2.93 115.31 114.20 3g1u h LEU 231 Ca -0.02 -0.05 0.09 0.00 0.09 0.00 0.00 57.88 57.99 3g1u h LEU 231 Cb 0.35 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 3g1u h LEU 231 CO 0.03 0.41 0.08 -0.09 0.09 0.00 0.00 178.44 178.96 3g1u h ARG 232 N 0.57 0.20 -0.34 1.13 2.43 -1.16 -1.82 114.38 115.39 3g1u h ARG 232 Ca 0.15 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.37 3g1u h ARG 232 Cb -0.01 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 3g1u h ARG 232 CO -0.03 0.14 0.24 0.00 -1.51 0.00 0.00 179.97 178.80 3g1u h ALA 233 N 1.39 2.06 -0.10 2.80 0.00 -1.00 0.13 119.26 124.54 3g1u h ALA 233 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3g1u h ALA 233 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3g1u h ALA 233 CO -0.34 -0.13 0.00 1.19 0.00 0.00 0.00 179.25 179.97 3g1u n PHE 234 N -4.48 0.12 -0.13 0.00 3.72 -1.03 -4.92 117.46 110.75 3g1u n PHE 234 Ca 0.04 -0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3g1u n PHE 234 Cb 0.27 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 3g1u n PHE 234 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g1u n GLY 235 N 1.14 0.97 3.87 1.37 0.00 0.46 -2.89 105.19 110.10 3g1u n GLY 235 Ca 0.17 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 3.35 -0.28 4.61 0.00 -0.71 -1.63 121.76 125.10 3g1u s ALA 236 Ca 0.00 -0.12 -0.15 0.00 0.00 0.00 0.00 51.96 51.70 3g1u s ALA 236 Cb 0.00 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.38 3g1u s ALA 236 CO 0.00 0.16 0.36 0.50 0.00 0.00 0.00 175.76 176.78 3g1u s ARG 237 N -3.45 3.96 -0.19 0.00 3.52 0.54 -4.25 118.95 119.09 3g1u s ARG 237 Ca 0.52 -0.03 -0.08 0.00 -0.13 0.00 0.00 55.73 56.01 3g1u s ARG 237 Cb -0.10 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 3g1u s ARG 237 CO 0.25 -0.30 0.08 0.08 -0.81 0.00 0.00 175.30 174.60 3g1u s VAL 238 N 2.05 4.97 -0.13 7.11 1.01 -1.26 -0.06 120.40 134.10 3g1u s VAL 238 Ca 0.14 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.13 3g1u s VAL 238 Cb -0.16 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 3g1u s VAL 238 CO 0.10 0.46 -0.04 -0.69 0.00 0.00 0.00 175.10 174.93 3g1u s VAL 239 N 0.33 3.91 -0.02 2.92 1.01 0.11 -4.08 120.40 124.59 3g1u s VAL 239 Ca 0.05 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.67 3g1u s VAL 239 Cb -0.12 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 3g1u s VAL 239 CO -0.00 0.53 -0.02 -0.69 0.00 0.00 0.00 175.10 174.92 3g1u s VAL 240 N -0.06 4.06 0.05 2.92 1.01 0.11 -0.73 120.40 127.76 3g1u s VAL 240 Ca 0.02 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.50 3g1u s VAL 240 Cb -0.13 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 3g1u s VAL 240 CO 0.03 0.43 -0.23 0.42 0.00 0.00 0.00 175.10 175.74 3g1u s THR 241 N -1.02 2.43 -0.00 3.92 -4.23 -0.66 -0.63 115.64 115.44 3g1u s THR 241 Ca 0.18 -1.32 -0.23 0.00 -1.18 0.00 0.00 61.69 59.14 3g1u s THR 241 Cb -0.11 -1.99 0.05 0.00 1.34 0.00 0.00 72.50 71.78 3g1u s THR 241 CO 0.08 0.34 0.50 -1.61 -0.54 0.00 0.00 174.62 173.39 3g1u s GLU 242 N -1.37 0.94 -0.01 3.99 0.41 -1.26 0.41 118.70 121.80 3g1u s GLU 242 Ca 0.13 -0.08 0.14 0.00 -0.41 0.00 0.00 54.97 54.75 3g1u s GLU 242 Cb -0.10 0.43 -0.18 0.00 -1.78 0.00 0.00 34.13 32.50 3g1u s GLU 242 CO 0.04 -0.30 0.44 1.33 -0.49 0.00 0.00 175.26 176.27 3g1u n VAL 243 N 0.80 0.00 -3.83 2.63 0.24 -1.26 -4.95 118.33 111.96 3g1u n VAL 243 Ca -0.19 -0.25 -0.36 0.00 -2.04 0.00 0.00 64.34 61.50 3g1u n VAL 243 Cb 0.58 0.59 -0.12 0.00 -1.47 0.00 0.00 33.84 33.42 3g1u n VAL 243 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3g1u s ASP 244 N -2.94 5.35 0.39 -1.34 -1.08 -1.26 -5.00 116.67 110.79 3g1u s ASP 244 Ca -0.00 -0.11 0.08 0.00 -0.52 0.00 0.00 52.55 52.00 3g1u s ASP 244 Cb 0.10 -1.95 0.80 0.00 -1.46 0.00 0.00 42.92 40.41 3g1u s ASP 244 CO 0.57 0.02 1.97 1.55 0.52 0.00 0.00 175.17 179.80 3g1u h PRO 245 N 7.80 0.38 0.38 4.34 0.13 -1.99 -2.00 132.00 141.04 3g1u h PRO 245 Ca -0.37 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.68 3g1u h PRO 245 Cb 1.18 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3g1u h PRO 245 CO 0.61 0.38 -0.18 0.82 -0.23 0.00 0.00 178.00 179.40 3g1u h ILE 246 N 0.37 0.63 -0.30 -3.56 2.04 -2.00 -1.69 117.51 113.01 3g1u h ILE 246 Ca 0.09 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 3g1u h ILE 246 Cb 0.20 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3g1u h ILE 246 CO 0.00 0.04 0.06 0.78 0.00 0.00 0.00 178.15 179.03 3g1u h ASN 247 N -0.63 0.40 -0.37 1.72 4.21 -1.86 -1.91 115.58 117.15 3g1u h ASN 247 Ca -0.05 -0.05 -0.16 0.00 1.21 0.00 0.00 56.30 57.25 3g1u h ASN 247 Cb 0.46 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 3g1u h ASN 247 CO 0.09 0.42 -0.38 0.00 -1.29 0.00 0.00 177.43 176.27 3g1u h ALA 248 N 1.64 0.54 -0.69 -0.83 0.00 -1.28 -1.74 119.26 116.89 3g1u h ALA 248 Ca 0.10 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 3g1u h ALA 248 Cb 0.20 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3g1u h ALA 248 CO -0.00 0.64 0.25 1.25 0.00 0.00 0.00 179.25 181.40 3g1u h LEU 249 N 0.72 0.98 0.25 0.00 5.85 -0.98 -1.44 115.31 120.68 3g1u h LEU 249 Ca 0.06 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.60 3g1u h LEU 249 Cb 0.98 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 3g1u h LEU 249 CO 0.09 0.90 -0.32 1.56 -0.34 0.00 0.00 178.44 180.34 3g1u h GLN 250 N 1.00 -0.60 -0.74 1.25 4.20 -1.22 0.65 115.11 119.65 3g1u h GLN 250 Ca 0.23 0.04 0.14 0.00 0.06 0.00 0.00 58.65 59.12 3g1u h GLN 250 Cb 0.25 0.14 -0.09 0.00 0.30 0.00 0.00 27.48 28.07 3g1u h GLN 250 CO -0.01 -0.40 0.28 0.00 -0.67 0.00 0.00 178.83 178.03 3g1u h ALA 251 N -0.06 1.02 -0.18 3.87 0.00 -1.22 -0.26 119.26 122.45 3g1u h ALA 251 Ca -0.00 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3g1u h ALA 251 Cb 0.60 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3g1u h ALA 251 CO -0.11 -0.21 -0.36 0.66 0.00 0.00 0.00 179.25 179.23 3g1u h SER 252 N 0.43 0.39 0.76 0.00 4.64 -0.97 -1.50 113.55 117.30 3g1u h SER 252 Ca 0.40 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.55 3g1u h SER 252 Cb 0.60 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3g1u h SER 252 CO -0.40 0.73 -0.07 0.24 -0.87 0.00 0.00 176.83 176.46 3g1u h MET 253 N 0.32 0.00 -0.35 4.77 2.07 0.36 -2.24 114.93 119.86 3g1u h MET 253 Ca 0.04 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.67 3g1u h MET 253 Cb 0.79 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.52 3g1u h MET 253 CO 0.06 0.07 0.00 0.39 1.07 0.00 0.00 176.91 178.50 3g1u n GLU 254 N -3.25 1.98 -0.28 1.72 -0.58 -0.23 -4.93 120.64 115.08 3g1u n GLU 254 Ca -0.00 -1.51 0.00 0.00 -0.42 0.00 0.00 57.16 55.23 3g1u n GLU 254 Cb 0.29 -1.38 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 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 1.21 0.86 3.78 0.62 0.00 -0.84 -5.06 105.19 105.77 3g1u n GLY 255 Ca 0.16 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 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 3.43 0.20 1.61 2.02 -0.64 -5.02 117.35 116.96 3g1u s TYR 256 Ca 0.00 0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 56.76 3g1u s TYR 256 Cb 0.00 -1.95 -0.10 0.00 -0.40 0.00 0.00 41.96 39.51 3g1u s TYR 256 CO 0.00 0.54 1.47 -1.14 -1.57 0.00 0.00 175.55 174.85 3g1u s GLN 257 N -0.63 4.26 -0.22 -0.62 0.74 -1.26 -3.91 119.66 118.02 3g1u s GLN 257 Ca 0.12 2.28 -0.05 0.00 0.05 0.00 0.00 55.36 57.76 3g1u s GLN 257 Cb -0.12 -3.14 -0.02 0.00 1.10 0.00 0.00 33.01 30.83 3g1u s GLN 257 CO 0.02 -0.47 -0.00 0.08 -0.55 0.00 0.00 175.29 174.37 3g1u s VAL 258 N 0.49 3.78 0.34 1.34 1.01 -1.26 -0.71 120.40 125.40 3g1u s VAL 258 Ca 0.63 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 3g1u s VAL 258 Cb -0.42 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.23 3g1u s VAL 258 CO 0.38 0.40 0.47 0.00 0.00 0.00 0.00 175.10 176.35 3g1u s ALA 259 N 1.38 0.80 0.41 5.51 0.00 0.19 -4.96 121.76 125.09 3g1u s ALA 259 Ca 0.05 -1.53 -0.09 0.00 0.00 0.00 0.00 51.96 50.38 3g1u s ALA 259 Cb -0.15 1.17 -0.06 0.00 0.00 0.00 0.00 23.12 24.08 3g1u s ALA 259 CO 0.00 -0.79 0.76 -0.51 0.00 0.00 0.00 175.76 175.22 3g1u s LEU 260 N -3.24 3.80 0.37 0.00 1.43 -1.26 -4.05 118.68 115.73 3g1u s LEU 260 Ca 0.31 1.07 0.08 0.00 -1.03 0.00 0.00 54.13 54.56 3g1u s LEU 260 Cb -0.00 -3.96 0.82 0.00 0.03 0.00 0.00 46.19 43.07 3g1u s LEU 260 CO 0.20 -0.42 1.92 0.58 0.23 0.00 0.00 176.35 178.87 3g1u h VAL 261 N 0.94 0.92 -0.29 -1.59 2.07 -1.95 -2.17 116.25 114.19 3g1u h VAL 261 Ca -0.47 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 3g1u h VAL 261 Cb 1.19 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 3g1u h VAL 261 CO 0.64 0.12 0.08 -0.33 0.02 0.00 0.00 177.57 178.10 3g1u h GLU 262 N 0.68 0.40 0.00 1.57 3.07 -1.97 0.13 114.58 118.46 3g1u h GLU 262 Ca 0.37 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.14 3g1u h GLU 262 Cb 0.50 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.33 3g1u h GLU 262 CO -0.14 0.37 -0.13 -0.44 -1.40 0.00 0.00 179.01 177.26 3g1u h ASP 263 N 0.40 0.00 0.00 1.42 3.32 -1.78 -3.31 116.42 116.48 3g1u h ASP 263 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3g1u h ASP 263 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3g1u h ASP 263 CO -0.01 0.13 0.00 1.33 -1.72 0.00 0.00 179.24 178.98 3g1u n VAL 264 N -3.81 0.00 -0.07 -1.35 0.24 -1.04 -4.80 118.33 107.51 3g1u n VAL 264 Ca -0.02 -0.40 0.25 0.00 -2.04 0.00 0.00 64.34 62.12 3g1u n VAL 264 Cb 0.24 1.02 0.72 0.00 -1.47 0.00 0.00 33.84 34.35 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 -1.06 0.41 114.93 121.62 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 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.61 3g1u h MET 265 CO 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 176.91 176.54 3g1u h ALA 266 N 1.56 0.76 0.00 -3.00 0.00 -1.83 -3.35 119.26 113.40 3g1u h ALA 266 Ca 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.12 3g1u h ALA 266 Cb 1.42 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 3g1u h ALA 266 CO -0.00 0.00 -1.62 -0.25 0.00 0.00 0.00 179.25 177.38 3g1u n ASP 267 N -2.33 2.56 -4.70 0.00 8.00 0.13 -4.09 116.55 116.12 3g1u n ASP 267 Ca 0.04 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.12 3g1u n ASP 267 Cb 0.46 0.98 -0.03 0.00 -0.02 0.00 0.00 41.12 42.51 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 -2.40 3.54 0.19 2.24 0.00 -0.35 -4.71 121.76 120.27 3g1u s ALA 268 Ca -0.05 0.89 0.14 0.00 0.00 0.00 0.00 51.96 52.94 3g1u s ALA 268 Cb 0.04 -3.55 0.41 0.00 0.00 0.00 0.00 23.12 20.02 3g1u s ALA 268 CO 0.42 -0.75 1.62 0.45 0.00 0.00 0.00 175.76 177.49 3g1u h HIS 269 N 7.41 0.00 -3.72 0.00 3.86 -1.35 -3.43 115.15 117.92 3g1u h HIS 269 Ca -0.39 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.57 3g1u h HIS 269 Cb 1.19 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 29.37 3g1u h HIS 269 CO 0.72 0.55 -0.72 0.42 0.86 0.00 0.00 177.93 179.75 3g1u s ILE 270 N -3.48 0.04 -0.11 2.45 1.01 -1.17 -0.12 121.20 119.81 3g1u s ILE 270 Ca -0.00 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.68 3g1u s ILE 270 Cb 0.11 -0.06 0.01 0.00 0.01 0.00 0.00 42.46 42.54 3g1u s ILE 270 CO 0.74 0.02 -0.20 -0.36 0.00 0.00 0.00 174.94 175.14 3g1u s PHE 271 N 0.13 2.35 -0.14 3.97 0.08 0.11 -0.82 117.98 123.67 3g1u s PHE 271 Ca -0.01 -1.09 0.00 0.00 0.12 0.00 0.00 56.93 55.96 3g1u s PHE 271 Cb -0.02 -1.62 0.02 0.00 -0.57 0.00 0.00 43.02 40.83 3g1u s PHE 271 CO -0.00 -0.50 -0.13 0.08 -0.10 0.00 0.00 175.22 174.58 3g1u s VAL 272 N 0.71 1.42 -0.13 -0.44 1.01 0.33 -1.66 120.40 121.64 3g1u s VAL 272 Ca -0.11 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 3g1u s VAL 272 Cb -0.16 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3g1u s VAL 272 CO 0.02 0.43 0.24 0.42 0.00 0.00 0.00 175.10 176.21 3g1u s THR 273 N 1.50 5.34 -0.01 3.92 -4.23 -0.94 -0.46 115.64 120.76 3g1u s THR 273 Ca 0.04 0.43 0.03 0.00 -1.18 0.00 0.00 61.69 61.01 3g1u s THR 273 Cb -0.13 -3.55 0.05 0.00 1.34 0.00 0.00 72.50 70.21 3g1u s THR 273 CO -0.09 0.50 1.02 0.35 -0.54 0.00 0.00 174.62 175.86 3g1u n THR 274 N 2.77 0.10 0.05 3.99 -2.24 -0.13 -1.21 114.28 117.61 3g1u n THR 274 Ca -0.15 -0.20 -0.11 0.00 -2.27 0.00 0.00 64.05 61.32 3g1u n THR 274 Cb 0.53 0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 69.13 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 6.63 1.37 -0.19 4.28 1.35 -1.91 -3.42 112.91 121.02 3g1u h THR 275 Ca -0.02 -3.08 -0.08 0.00 -0.55 0.00 0.00 66.41 62.68 3g1u h THR 275 Cb 1.42 2.75 -0.03 0.00 -1.73 0.00 0.00 68.15 70.55 3g1u h THR 275 CO 0.01 0.83 -0.07 0.61 -0.25 0.00 0.00 175.52 176.64 3g1u n GLY 276 N 1.49 0.67 3.27 5.82 0.00 -1.26 -5.04 105.19 110.14 3g1u n GLY 276 Ca -0.08 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 3g1u n GLY 276 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3g1u s ASN 277 N -2.96 2.00 0.54 1.61 0.01 -1.26 -5.00 114.94 109.88 3g1u s ASN 277 Ca 0.00 -1.00 -0.09 0.00 -0.71 0.00 0.00 52.86 51.06 3g1u s ASN 277 Cb 0.00 -0.05 -0.04 0.00 0.41 0.00 0.00 41.25 41.57 3g1u s ASN 277 CO 0.00 -0.28 0.90 -1.81 -1.51 0.00 0.00 177.10 174.41 3g1u s ASP 278 N -3.15 6.28 -1.24 -1.22 1.01 -1.26 -3.98 116.67 113.10 3g1u s ASP 278 Ca 0.18 1.20 -0.01 0.00 0.71 0.00 0.00 52.55 54.63 3g1u s ASP 278 Cb 0.01 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.58 3g1u s ASP 278 CO 0.02 -0.70 0.91 0.47 0.21 0.00 0.00 175.17 176.08 3g1u n ASP 279 N -2.38 -1.93 -0.06 0.27 8.00 -0.52 -4.88 116.55 115.05 3g1u n ASP 279 Ca 0.03 -0.68 -0.19 0.00 0.71 0.00 0.00 54.79 54.65 3g1u n ASP 279 Cb 0.54 -4.76 -0.13 0.00 -0.02 0.00 0.00 41.12 36.76 3g1u n ASP 279 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3g1u h ILE 280 N -1.92 1.22 -3.51 0.53 1.08 -0.58 -3.44 117.51 110.88 3g1u h ILE 280 Ca -0.60 -2.31 -0.66 0.00 -0.39 0.00 0.00 64.86 60.91 3g1u h ILE 280 Cb 1.35 2.74 -0.26 0.00 -3.07 0.00 0.00 36.82 37.57 3g1u h ILE 280 CO 0.53 0.53 -0.68 -0.63 -0.69 0.00 0.00 178.15 177.21 3g1u s ILE 281 N -2.36 3.70 0.39 -0.67 -1.09 -0.88 -5.03 121.20 115.26 3g1u s ILE 281 Ca -0.23 -0.51 0.03 0.00 -2.23 0.00 0.00 60.65 57.72 3g1u s ILE 281 Cb 0.03 -2.77 -0.04 0.00 -1.58 0.00 0.00 42.46 38.11 3g1u s ILE 281 CO 0.68 0.30 0.09 0.42 -1.23 0.00 0.00 174.94 175.20 3g1u s THR 282 N 1.50 0.86 0.43 2.92 -4.23 -1.26 -1.61 115.64 114.24 3g1u s THR 282 Ca 0.05 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.80 3g1u s THR 282 Cb -0.15 -2.48 0.44 0.00 1.34 0.00 0.00 72.50 71.65 3g1u s THR 282 CO -0.00 0.00 1.71 0.77 -0.54 0.00 0.00 174.62 176.56 3g1u h SER 283 N 1.86 0.33 0.32 3.99 4.64 -1.98 0.40 113.55 123.11 3g1u h SER 283 Ca -0.38 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3g1u h SER 283 Cb 1.27 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3g1u h SER 283 CO 0.63 -0.03 0.00 0.47 -0.87 0.00 0.00 176.83 177.03 3g1u n ASP 284 N -4.61 0.21 -0.06 4.97 9.92 -1.26 -4.10 116.55 121.62 3g1u n ASP 284 Ca 0.30 0.57 -0.13 0.00 -0.53 0.00 0.00 54.79 55.00 3g1u n ASP 284 Cb 1.14 -0.61 -0.05 0.00 -0.64 0.00 0.00 41.12 40.96 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 -1.76 0.00 -0.27 1.24 8.25 0.13 -4.79 115.22 118.02 3g1u n HIS 285 Ca 0.01 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.55 3g1u n HIS 285 Cb 0.11 -0.46 0.20 0.00 1.12 0.00 0.00 29.99 30.96 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 -0.42 0.08 0.00 4.41 0.04 -1.56 -1.38 116.94 118.10 3g1u h PHE 286 Ca -0.32 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.50 3g1u h PHE 286 Cb 1.29 0.09 0.00 0.00 2.20 0.00 0.00 35.95 39.53 3g1u h PHE 286 CO -0.04 -0.23 0.00 -1.35 -0.60 0.00 0.00 178.31 176.10 3g1u h PRO 287 N 0.14 0.00 -0.02 1.51 0.11 -1.87 -2.57 132.00 129.30 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 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3g1u h PRO 287 CO -0.66 0.00 -0.21 0.72 -0.21 0.00 0.00 178.00 177.64 3g1u n HIS 288 N -2.46 0.00 -2.53 0.65 8.25 -0.52 -4.95 115.22 113.66 3g1u n HIS 288 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.08 3g1u n HIS 288 Cb 0.07 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.78 4.11 1.01 -0.41 -1.94 -0.97 -4.13 119.30 115.20 3g1u s MET 289 Ca 0.17 1.51 -0.12 0.00 -1.71 0.00 0.00 55.69 55.54 3g1u s MET 289 Cb 0.14 -2.50 0.20 0.00 2.01 0.00 0.00 34.83 34.68 3g1u s MET 289 CO 0.35 -0.19 1.08 -0.98 -0.01 0.00 0.00 175.02 175.27 3g1u s ARG 290 N -2.57 0.29 0.32 2.03 1.70 -1.26 -4.92 118.95 114.55 3g1u s ARG 290 Ca 0.59 1.04 -0.29 0.00 -0.47 0.00 0.00 55.73 56.60 3g1u s ARG 290 Cb -0.22 -1.68 -0.11 0.00 -0.57 0.00 0.00 34.95 32.37 3g1u s ARG 290 CO 0.27 -2.97 1.55 0.34 -1.08 0.00 0.00 175.30 173.42 3g1u s ASP 291 N -2.83 6.36 -1.93 -2.89 2.15 -1.26 -2.72 116.67 113.55 3g1u s ASP 291 Ca 0.66 2.99 0.00 0.00 0.43 0.00 0.00 52.55 56.63 3g1u s ASP 291 Cb -0.22 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.75 3g1u s ASP 291 CO 0.60 -0.90 0.00 0.47 -0.17 0.00 0.00 175.17 175.17 3g1u n ASP 292 N 1.51 -5.54 -4.56 -0.34 8.00 0.16 -4.90 116.55 110.88 3g1u n ASP 292 Ca 0.05 0.45 -0.45 0.00 0.71 0.00 0.00 54.79 55.55 3g1u n ASP 292 Cb 0.38 -4.64 -0.02 0.00 -0.02 0.00 0.00 41.12 36.82 3g1u n ASP 292 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1u n ALA 293 N 1.34 -0.63 -3.02 2.24 0.00 -1.10 -4.56 120.51 114.77 3g1u n ALA 293 Ca -0.18 0.41 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 3g1u n ALA 293 Cb 0.66 -1.97 -0.12 0.00 0.00 0.00 0.00 19.45 18.02 3g1u n ALA 293 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3g1u s ILE 294 N -0.95 4.19 -0.13 0.00 1.01 0.82 -0.69 121.20 125.45 3g1u s ILE 294 Ca 0.61 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.03 3g1u s ILE 294 Cb -0.75 -2.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 3g1u s ILE 294 CO 0.59 0.41 -0.15 -0.69 0.00 0.00 0.00 174.94 175.10 3g1u s VAL 295 N 1.01 2.88 0.19 2.92 1.01 0.14 0.06 120.40 128.61 3g1u s VAL 295 Ca 0.03 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.14 3g1u s VAL 295 Cb -0.14 -2.20 0.02 0.00 0.00 0.00 0.00 36.38 34.06 3g1u s VAL 295 CO 0.02 0.53 0.45 0.00 0.00 0.00 0.00 175.10 176.10 3g1u s ASN 297 N -2.91 1.50 0.00 0.00 2.47 -1.26 -2.22 114.94 112.53 3g1u s ASN 297 Ca 0.12 -0.42 0.00 0.00 0.42 0.00 0.00 52.86 52.98 3g1u s ASN 297 Cb 0.00 -0.10 0.00 0.00 -1.45 0.00 0.00 41.25 39.71 3g1u s ASN 297 CO -0.02 0.03 0.22 0.00 -3.72 0.00 0.00 177.10 173.61 3g1u n ILE 298 N 2.03 0.00 -1.21 -5.21 3.06 -0.35 -0.70 119.36 116.99 3g1u n ILE 298 Ca -0.18 -0.31 -0.30 0.00 -2.50 0.00 0.00 62.75 59.47 3g1u n ILE 298 Cb 0.55 1.27 0.14 0.00 0.54 0.00 0.00 39.64 42.13 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 -0.18 1.62 0.21 4.50 0.00 -1.20 -4.83 107.32 107.44 3g1u s GLY 299 Ca 0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 44.72 44.56 3g1u s GLY 299 CO 0.00 0.42 1.82 0.84 0.00 0.00 0.00 173.10 176.18 3g1u h HIS 300 N -1.54 1.08 -3.27 1.90 2.76 -1.96 -3.39 115.15 110.73 3g1u h HIS 300 Ca -0.49 -0.03 -0.67 0.00 -2.20 0.00 0.00 60.37 56.98 3g1u h HIS 300 Cb 1.28 -0.34 -0.15 0.00 1.55 0.00 0.00 27.41 29.75 3g1u h HIS 300 CO 0.42 0.76 -0.61 -0.06 -1.30 0.00 0.00 177.93 177.14 3g1u s PHE 301 N -5.83 3.18 -0.23 5.26 0.08 -1.26 -4.73 117.98 114.46 3g1u s PHE 301 Ca -0.13 0.15 0.21 0.00 0.12 0.00 0.00 56.93 57.28 3g1u s PHE 301 Cb 0.15 -1.85 1.14 0.00 -0.57 0.00 0.00 43.02 41.90 3g1u s PHE 301 CO 0.81 0.40 1.65 -0.40 -0.10 0.00 0.00 175.22 177.58 3g1u n ASP 302 N 2.42 0.55 0.00 1.36 5.68 -1.26 -3.21 116.55 122.10 3g1u n ASP 302 Ca -0.18 0.75 0.06 0.00 -0.50 0.00 0.00 54.79 54.92 3g1u n ASP 302 Cb 0.53 -0.83 0.36 0.00 -1.14 0.00 0.00 41.12 40.05 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 0.14 2.12 -2.24 -1.26 -2.24 114.28 108.55 3g1u n THR 303 Ca -0.01 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.81 3g1u n THR 303 Cb 0.04 -0.41 0.49 0.00 -2.10 0.00 0.00 70.33 68.34 3g1u n THR 303 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3g1u h GLU 304 N 0.00 0.24 -6.11 -0.78 5.08 -1.68 -1.39 114.58 109.94 3g1u h GLU 304 Ca 0.00 -0.03 -0.68 0.00 -1.00 0.00 0.00 59.36 57.65 3g1u h GLU 304 Cb 0.00 -0.05 -0.20 0.00 0.50 0.00 0.00 28.75 29.01 3g1u h GLU 304 CO 0.00 0.24 -0.70 0.42 -1.00 0.00 0.00 179.01 177.97 3g1u s ILE 305 N -5.05 3.61 -1.43 3.13 1.01 -0.95 0.11 121.20 121.62 3g1u s ILE 305 Ca -0.06 -0.51 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 3g1u s ILE 305 Cb 0.16 -2.47 0.06 0.00 0.01 0.00 0.00 42.46 40.22 3g1u s ILE 305 CO 0.71 0.59 2.16 0.00 0.00 0.00 0.00 174.94 178.40 3g1u n GLN 306 N 2.32 2.97 -0.06 2.79 6.02 -0.63 -4.72 117.38 126.06 3g1u n GLN 306 Ca -0.18 -2.76 -0.09 0.00 -0.01 0.00 0.00 57.00 53.97 3g1u n GLN 306 Cb 0.53 -3.25 -0.02 0.00 1.02 0.00 0.00 30.24 28.52 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 4.05 0.98 -0.33 5.09 2.07 -1.89 -2.11 116.25 124.11 3g1u h VAL 307 Ca 0.54 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 68.05 3g1u h VAL 307 Cb 0.65 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.05 3g1u h VAL 307 CO 1.83 0.05 -0.20 1.23 0.02 0.00 0.00 177.57 180.50 3g1u h GLY 308 N 0.25 0.01 1.00 2.17 0.00 -1.98 0.16 103.07 104.68 3g1u h GLY 308 Ca 0.11 0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.70 3g1u h GLY 308 CO -0.08 -0.19 0.48 -0.25 0.00 0.00 0.00 176.54 176.50 3g1u h TRP 309 N -0.16 0.91 0.26 5.60 7.01 -1.92 -1.61 115.95 126.04 3g1u h TRP 309 Ca 0.17 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 3g1u h TRP 309 Cb 0.42 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.17 3g1u h TRP 309 CO -0.41 0.57 -0.13 1.25 -2.79 0.00 0.00 178.44 176.94 3g1u h LEU 310 N 0.98 -0.30 -0.89 0.65 5.85 -0.65 -1.64 115.31 119.32 3g1u h LEU 310 Ca 0.27 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.04 3g1u h LEU 310 Cb -0.11 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.93 3g1u h LEU 310 CO -0.06 -0.18 0.55 -0.33 -0.34 0.00 0.00 178.44 178.08 3g1u h GLU 311 N -0.39 0.97 0.00 1.25 5.08 -0.82 -1.98 114.58 118.69 3g1u h GLU 311 Ca -0.04 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 3g1u h GLU 311 Cb 0.30 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3g1u h GLU 311 CO 0.06 0.64 -0.44 0.00 -1.00 0.00 0.00 179.01 178.27 3g1u h ALA 312 N 1.42 1.09 -0.01 3.43 0.00 -1.17 -3.32 119.26 120.70 3g1u h ALA 312 Ca 0.39 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3g1u h ALA 312 Cb 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3g1u h ALA 312 CO -0.18 0.55 -0.28 0.09 0.00 0.00 0.00 179.25 179.43 3g1u n ASN 313 N -3.76 1.36 -4.77 0.00 3.02 -0.63 -4.97 115.26 105.50 3g1u n ASN 313 Ca -0.01 -1.18 -0.38 0.00 -0.03 0.00 0.00 54.58 52.98 3g1u n ASN 313 Cb 0.51 0.50 -0.04 0.00 -0.61 0.00 0.00 39.78 40.14 3g1u n ASN 313 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g1u s ALA 314 N -1.64 3.17 0.12 5.41 0.00 -0.78 -4.65 121.76 123.39 3g1u s ALA 314 Ca 0.10 0.79 -0.05 0.00 0.00 0.00 0.00 51.96 52.80 3g1u s ALA 314 Cb 0.10 -3.30 -0.11 0.00 0.00 0.00 0.00 23.12 19.81 3g1u s ALA 314 CO 0.33 -0.25 1.29 0.87 0.00 0.00 0.00 175.76 178.00 3g1u h LYS 315 N 2.84 0.42 -4.59 0.00 1.57 -1.03 -3.46 116.57 112.32 3g1u h LYS 315 Ca -0.48 -0.47 -0.24 0.00 -1.87 0.00 0.00 60.65 57.59 3g1u h LYS 315 Cb 1.22 0.13 -0.18 0.00 0.08 0.00 0.00 32.23 33.48 3g1u h LYS 315 CO 0.63 1.13 -0.71 -1.21 -0.57 0.00 0.00 179.45 178.72 3g1u s GLU 316 N -3.23 0.68 -0.04 3.15 2.02 -1.09 -4.99 118.70 115.19 3g1u s GLU 316 Ca -0.06 -1.05 0.01 0.00 0.02 0.00 0.00 54.97 53.89 3g1u s GLU 316 Cb 0.09 -0.23 0.02 0.00 0.10 0.00 0.00 34.13 34.11 3g1u s GLU 316 CO 0.87 0.01 -0.03 -1.58 0.02 0.00 0.00 175.26 174.56 3g1u s HIS 317 N -2.54 0.60 -0.06 1.61 5.65 -1.26 -1.38 115.29 117.91 3g1u s HIS 317 Ca 0.01 -0.14 0.04 0.00 0.25 0.00 0.00 55.06 55.22 3g1u s HIS 317 Cb -0.02 -0.59 0.00 0.00 -1.18 0.00 0.00 32.58 30.79 3g1u s HIS 317 CO -0.02 -0.18 -0.17 0.08 -0.65 0.00 0.00 174.74 173.80 3g1u s VAL 318 N 1.00 1.49 -0.42 0.89 1.01 0.80 -5.00 120.40 120.17 3g1u s VAL 318 Ca -0.10 -0.72 -0.21 0.00 0.00 0.00 0.00 61.98 60.95 3g1u s VAL 318 Cb -0.14 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 34.96 3g1u s VAL 318 CO -0.01 0.43 0.68 -0.70 0.00 0.00 0.00 175.10 175.50 3g1u s GLU 319 N 0.29 3.40 0.13 2.72 2.12 -1.26 -0.01 118.70 126.09 3g1u s GLU 319 Ca -0.10 -0.20 -0.13 0.00 0.36 0.00 0.00 54.97 54.89 3g1u s GLU 319 Cb -0.14 -3.92 -0.03 0.00 0.26 0.00 0.00 34.13 30.30 3g1u s GLU 319 CO 0.04 -0.98 1.52 0.82 -0.54 0.00 0.00 175.26 176.13 3g1u h ILE 320 N 5.86 1.28 -1.69 -3.70 2.04 -1.57 -3.48 117.51 116.25 3g1u h ILE 320 Ca -0.25 -1.25 0.25 0.00 1.00 0.00 0.00 64.86 64.60 3g1u h ILE 320 Cb 1.10 1.25 -0.15 0.00 -0.74 0.00 0.00 36.82 38.27 3g1u h ILE 320 CO 0.90 0.42 0.73 -1.59 0.00 0.00 0.00 178.15 178.61 3g1u s LYS 321 N -4.72 0.52 0.16 2.37 -2.85 -1.20 -5.05 119.74 108.97 3g1u s LYS 321 Ca -0.12 -0.24 -0.33 0.00 -1.00 0.00 0.00 55.97 54.28 3g1u s LYS 321 Cb 0.10 0.21 -0.16 0.00 -2.06 0.00 0.00 37.83 35.92 3g1u s LYS 321 CO 0.83 -0.23 1.14 -2.30 0.10 0.00 0.00 175.35 174.89 3g1u n PRO 322 N -0.28 1.08 -1.01 1.78 -0.02 -1.26 -0.78 135.00 134.50 3g1u n PRO 322 Ca -0.04 0.38 -0.00 0.00 -2.02 0.00 0.00 63.50 61.81 3g1u n PRO 322 Cb 0.60 -1.87 -0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3g1u n PRO 322 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3g1u n GLN 323 N 1.74 -1.17 -3.88 -0.52 3.00 -1.26 -4.98 117.38 110.31 3g1u n GLN 323 Ca 0.15 0.32 -0.30 0.00 -0.01 0.00 0.00 57.00 57.17 3g1u n GLN 323 Cb 0.24 -4.21 -0.16 0.00 0.00 0.00 0.00 30.24 26.11 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 -1.45 1.29 -0.06 5.09 1.01 0.04 0.07 120.40 126.40 3g1u s VAL 324 Ca 0.00 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 60.88 3g1u s VAL 324 Cb 0.00 -1.66 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 3g1u s VAL 324 CO 0.00 -0.19 -0.19 -1.81 0.00 0.00 0.00 175.10 172.90 3g1u s ASP 325 N 1.49 2.45 -0.18 3.32 1.01 -0.90 -1.29 116.67 122.57 3g1u s ASP 325 Ca -0.03 -0.41 -0.02 0.00 0.71 0.00 0.00 52.55 52.80 3g1u s ASP 325 Cb -0.18 -0.81 -0.01 0.00 1.01 0.00 0.00 42.92 42.93 3g1u s ASP 325 CO -0.08 0.16 -0.09 -0.60 0.21 0.00 0.00 175.17 174.76 3g1u s ARG 326 N 0.13 3.34 -0.15 8.23 3.52 0.99 -0.55 118.95 134.46 3g1u s ARG 326 Ca -0.08 -0.67 -0.02 0.00 -0.13 0.00 0.00 55.73 54.84 3g1u s ARG 326 Cb -0.14 -2.82 -0.02 0.00 -1.56 0.00 0.00 34.95 30.42 3g1u s ARG 326 CO 0.04 -0.04 -0.09 0.71 -0.81 0.00 0.00 175.30 175.11 3g1u s TYR 327 N 1.01 2.91 -0.29 5.12 2.02 -0.26 -0.14 117.35 127.72 3g1u s TYR 327 Ca -0.01 -0.52 -0.12 0.00 -0.37 0.00 0.00 57.07 56.05 3g1u s TYR 327 Cb -0.15 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.47 3g1u s TYR 327 CO -0.01 -0.16 0.24 0.99 -1.57 0.00 0.00 175.55 175.04 3g1u s THR 328 N 0.43 5.28 0.67 -0.71 2.01 -0.48 -1.05 115.64 121.78 3g1u s THR 328 Ca -0.07 0.15 -0.07 0.00 0.31 0.00 0.00 61.69 62.01 3g1u s THR 328 Cb -0.15 -3.61 0.04 0.00 0.01 0.00 0.00 72.50 68.79 3g1u s THR 328 CO 0.04 0.16 1.00 -0.04 -0.69 0.00 0.00 174.62 175.09 3g1u s MET 329 N 1.82 2.51 0.49 4.92 1.00 -0.06 -0.42 119.30 129.56 3g1u s MET 329 Ca 0.08 -0.05 0.27 0.00 0.00 0.00 0.00 55.69 55.99 3g1u s MET 329 Cb -0.16 -2.17 1.35 0.00 0.00 0.00 0.00 34.83 33.84 3g1u s MET 329 CO 0.11 -1.05 1.85 0.93 0.00 0.00 0.00 175.02 176.85 3g1u h GLU 330 N -0.49 0.15 -1.59 2.03 5.08 -1.88 0.96 114.58 118.84 3g1u h GLU 330 Ca -0.45 -0.01 0.46 0.00 -1.00 0.00 0.00 59.36 58.36 3g1u h GLU 330 Cb 1.29 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 3g1u h GLU 330 CO 0.61 0.10 1.22 -0.91 -1.00 0.00 0.00 179.01 179.03 3g1u h ASN 331 N 0.15 0.00 0.00 1.42 2.35 -1.93 -3.45 115.58 114.12 3g1u h ASN 331 Ca 0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.24 3g1u h ASN 331 Cb 1.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.03 3g1u h ASN 331 CO -0.09 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.30 3g1u n GLY 332 N -1.84 1.14 3.95 2.83 0.00 0.33 -5.04 105.19 106.56 3g1u n GLY 332 Ca 0.35 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.06 3.20 0.12 1.61 0.52 -1.26 -4.85 118.95 118.23 3g1u s ARG 333 Ca 0.00 -0.52 0.08 0.00 -0.52 0.00 0.00 55.73 54.77 3g1u s ARG 333 Cb 0.00 -2.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.80 3g1u s ARG 333 CO 0.00 -0.09 -0.11 -1.01 0.02 0.00 0.00 175.30 174.11 3g1u s HIS 334 N -2.42 2.69 -0.06 -0.53 3.76 -1.26 -0.88 115.29 116.59 3g1u s HIS 334 Ca 0.45 -0.18 0.04 0.00 -0.15 0.00 0.00 55.06 55.21 3g1u s HIS 334 Cb -0.10 -1.39 0.00 0.00 1.11 0.00 0.00 32.58 32.20 3g1u s HIS 334 CO 0.36 0.44 -0.17 0.42 -0.85 0.00 0.00 174.74 174.94 3g1u s ILE 335 N -1.29 1.48 -0.26 0.60 1.01 -0.22 -0.66 121.20 121.86 3g1u s ILE 335 Ca 0.22 -0.71 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 3g1u s ILE 335 Cb -0.11 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 3g1u s ILE 335 CO 0.14 0.43 0.15 -0.63 0.00 0.00 0.00 174.94 175.02 3g1u s ILE 336 N 0.32 5.04 -0.12 2.92 1.01 0.13 -1.10 121.20 129.39 3g1u s ILE 336 Ca -0.11 0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.59 3g1u s ILE 336 Cb -0.14 -3.37 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 3g1u s ILE 336 CO 0.04 0.30 -0.04 -0.22 0.00 0.00 0.00 174.94 175.02 3g1u s LEU 337 N 1.52 3.27 -0.17 2.97 2.96 0.29 -0.68 118.68 128.84 3g1u s LEU 337 Ca 0.07 -0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 53.83 3g1u s LEU 337 Cb -0.15 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 3g1u s LEU 337 CO 0.07 0.25 0.10 -0.76 -1.32 0.00 0.00 176.35 174.70 3g1u s LEU 338 N -0.11 4.09 -1.20 -0.68 1.43 -0.63 -2.11 118.68 119.48 3g1u s LEU 338 Ca 0.02 0.23 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 3g1u s LEU 338 Cb -0.13 -2.03 0.05 0.00 0.03 0.00 0.00 46.19 44.11 3g1u s LEU 338 CO 0.03 0.23 0.38 0.00 0.23 0.00 0.00 176.35 177.22 3g1u n ALA 339 N 3.15 -1.01 -3.17 4.21 0.00 0.11 -0.30 120.51 123.50 3g1u n ALA 339 Ca -0.17 0.09 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 3g1u n ALA 339 Cb 0.53 -2.47 -0.01 0.00 0.00 0.00 0.00 19.45 17.50 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 -3.51 -2.98 -1.00 0.00 4.76 -1.26 -0.87 118.16 113.29 3g1u n LYS 340 Ca -0.04 0.42 0.00 0.00 -2.87 0.00 0.00 58.31 55.82 3g1u n LYS 340 Cb 0.55 -5.08 0.00 0.00 -1.84 0.00 0.00 35.03 28.67 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 -1.02 0.54 3.88 0.72 0.00 0.59 -4.95 105.19 104.94 3g1u n GLY 341 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.00 3.64 -0.35 1.61 3.00 -0.05 -3.99 118.95 122.81 3g1u s ARG 342 Ca 0.00 0.51 -0.41 0.00 0.00 0.00 0.00 55.73 55.84 3g1u s ARG 342 Cb 0.00 -2.25 -0.16 0.00 0.00 0.00 0.00 34.95 32.54 3g1u s ARG 342 CO 0.00 -0.32 1.87 1.28 0.00 0.00 0.00 175.30 178.13 3g1u n LEU 343 N -2.22 1.98 0.05 2.53 4.32 -1.25 -4.52 117.00 117.89 3g1u n LEU 343 Ca 0.03 0.91 -0.07 0.00 -0.02 0.00 0.00 56.01 56.86 3g1u n LEU 343 Cb 0.54 -1.10 0.10 0.00 -1.62 0.00 0.00 43.42 41.35 3g1u n LEU 343 CO 0.53 -0.58 0.50 1.62 -1.22 0.00 0.00 177.39 178.25 3g1u h VAL 344 N 5.81 1.34 -0.63 4.08 3.04 -1.23 0.53 116.25 129.20 3g1u h VAL 344 Ca -0.37 -1.82 -0.07 0.00 -1.01 0.00 0.00 66.70 63.42 3g1u h VAL 344 Cb 1.34 1.84 -0.03 0.00 -2.01 0.00 0.00 31.29 32.43 3g1u h VAL 344 CO 0.99 0.55 0.10 -0.55 -1.01 0.00 0.00 177.57 177.66 3g1u h ASN 345 N 0.30 0.98 0.74 3.17 -1.07 -1.84 0.60 115.58 118.46 3g1u h ASN 345 Ca 0.01 -0.22 -0.25 0.00 0.07 0.00 0.00 56.30 55.90 3g1u h ASN 345 Cb 1.06 -0.26 -0.03 0.00 -2.07 0.00 0.00 38.32 37.01 3g1u h ASN 345 CO 0.09 0.97 -1.33 -0.07 0.07 0.00 0.00 177.43 177.17 3g1u h LEU 346 N 0.96 0.06 -0.10 6.14 3.38 -1.79 0.10 115.31 124.07 3g1u h LEU 346 Ca 0.19 -0.08 -0.24 0.00 0.09 0.00 0.00 57.88 57.85 3g1u h LEU 346 Cb 0.41 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3g1u h LEU 346 CO 0.01 1.06 -1.03 1.23 0.09 0.00 0.00 178.44 179.81 3g1u h GLY 347 N 2.99 0.36 0.00 0.83 0.00 -0.74 -3.38 103.07 103.14 3g1u h GLY 347 Ca -0.14 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.47 3g1u h GLY 347 CO 0.12 0.63 -0.44 0.00 0.00 0.00 0.00 176.54 176.85 3g1u n ALA 349 N -1.23 0.00 -1.16 0.00 0.00 -1.00 -4.49 120.51 112.63 3g1u n ALA 349 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3g1u n ALA 349 Cb 0.11 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.68 3g1u n ALA 349 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3g1u n SER 350 N 0.00 2.05 -0.35 0.00 7.64 -1.02 -4.65 113.62 117.30 3g1u n SER 350 Ca 0.00 -2.93 0.00 0.00 1.01 0.00 0.00 58.87 56.95 3g1u n SER 350 Cb 0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 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 -1.24 -0.50 3.66 0.23 0.00 0.32 -4.80 105.19 102.87 3g1u n GLY 351 Ca 0.14 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.70 1.80 -1.08 1.61 8.25 -1.26 -4.78 115.22 119.06 3g1u n HIS 352 Ca 0.00 0.55 -0.31 0.00 -0.26 0.00 0.00 57.72 57.70 3g1u n HIS 352 Cb 0.00 -2.33 0.13 0.00 1.12 0.00 0.00 29.99 28.91 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 -2.01 1.58 0.29 -0.41 0.02 -1.26 -4.86 135.00 128.35 3g1u s PRO 353 Ca 0.60 1.15 0.02 0.00 0.02 0.00 0.00 61.00 62.79 3g1u s PRO 353 Cb -0.56 -1.82 0.57 0.00 0.02 0.00 0.00 34.50 32.71 3g1u s PRO 353 CO 0.59 -2.12 1.86 0.77 -0.33 0.00 0.00 177.00 177.77 3g1u h SER 354 N -1.47 0.91 -0.12 2.53 0.02 -1.93 -3.01 113.55 110.46 3g1u h SER 354 Ca -0.46 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 60.54 3g1u h SER 354 Cb 1.26 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 3g1u h SER 354 CO 0.50 0.51 0.04 0.15 -1.14 0.00 0.00 176.83 176.88 3g1u h PHE 355 N 0.99 0.06 0.00 3.45 3.57 -1.91 -0.26 116.94 122.84 3g1u h PHE 355 Ca 0.47 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.83 3g1u h PHE 355 Cb 0.43 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3g1u h PHE 355 CO -0.00 0.03 -0.68 -0.24 -2.23 0.00 0.00 178.31 175.19 3g1u h VAL 356 N 0.09 1.33 0.00 1.41 3.04 -1.85 -2.78 116.25 117.49 3g1u h VAL 356 Ca 0.05 -2.47 -0.05 0.00 -1.01 0.00 0.00 66.70 63.22 3g1u h VAL 356 Cb 0.03 2.40 -0.01 0.00 -2.01 0.00 0.00 31.29 31.70 3g1u h VAL 356 CO -0.06 0.67 -0.24 0.24 -1.01 0.00 0.00 177.57 177.17 3g1u h MET 357 N 0.00 0.00 -0.76 4.17 2.86 -1.34 -2.11 114.93 117.75 3g1u h MET 357 Ca -0.01 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 3g1u h MET 357 Cb 1.34 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.95 3g1u h MET 357 CO 0.09 0.24 0.50 1.03 1.06 0.00 0.00 176.91 179.83 3g1u h SER 358 N 0.00 0.65 0.27 1.22 0.87 -0.75 0.61 113.55 116.42 3g1u h SER 358 Ca -0.00 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 3g1u h SER 358 Cb 0.43 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 3g1u h SER 358 CO 0.03 0.40 -0.13 0.78 -0.53 0.00 0.00 176.83 177.38 3g1u h ASN 359 N 0.73 -0.30 -0.49 6.23 4.21 -1.46 -0.36 115.58 124.14 3g1u h ASN 359 Ca 0.34 -0.13 -0.03 0.00 1.21 0.00 0.00 56.30 57.69 3g1u h ASN 359 Cb 0.38 0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.64 3g1u h ASN 359 CO -0.12 -0.04 0.20 -1.28 -1.29 0.00 0.00 177.43 174.89 3g1u h SER 360 N -0.57 0.68 0.34 5.81 0.87 -1.49 -2.64 113.55 116.55 3g1u h SER 360 Ca -0.04 -0.17 -0.16 0.00 -1.23 0.00 0.00 61.79 60.20 3g1u h SER 360 Cb 0.41 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 3g1u h SER 360 CO 0.06 0.67 -0.64 -0.26 -0.53 0.00 0.00 176.83 176.12 3g1u h PHE 361 N 0.65 0.38 -0.59 2.24 0.04 -0.93 -0.76 116.94 117.97 3g1u h PHE 361 Ca 0.16 -0.15 0.02 0.00 2.80 0.00 0.00 57.97 60.80 3g1u h PHE 361 Cb 0.20 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 3g1u h PHE 361 CO 0.00 0.85 0.38 1.15 -0.60 0.00 0.00 178.31 180.09 3g1u h THR 362 N 0.21 1.11 -0.71 -1.55 2.02 -0.94 -1.49 112.91 111.56 3g1u h THR 362 Ca -0.01 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 3g1u h THR 362 Cb 1.17 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 3g1u h THR 362 CO 0.10 0.14 0.43 0.78 0.37 0.00 0.00 175.52 177.34 3g1u h ASN 363 N 0.76 0.85 -0.54 4.18 2.35 -1.19 -2.00 115.58 120.00 3g1u h ASN 363 Ca 0.23 -0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.99 3g1u h ASN 363 Cb -0.04 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.06 3g1u h ASN 363 CO -0.07 0.66 0.20 -0.61 -1.65 0.00 0.00 177.43 175.95 3g1u h GLN 364 N 0.96 0.37 -0.48 0.81 5.75 -0.61 -0.19 115.11 121.72 3g1u h GLN 364 Ca 0.25 -0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 58.62 3g1u h GLN 364 Cb -0.04 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.41 3g1u h GLN 364 CO -0.05 0.25 -0.14 0.28 -2.65 0.00 0.00 178.83 176.52 3g1u h VAL 365 N 0.39 1.27 0.00 2.39 2.07 -1.01 -1.96 116.25 119.40 3g1u h VAL 365 Ca 0.26 -1.29 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 3g1u h VAL 365 Cb 0.29 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3g1u h VAL 365 CO -0.26 0.45 -0.22 -0.07 0.02 0.00 0.00 177.57 177.49 3g1u h LEU 366 N 0.80 0.00 0.04 2.57 3.38 -0.71 -1.04 115.31 120.35 3g1u h LEU 366 Ca 0.12 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.88 3g1u h LEU 366 Cb 0.71 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.48 3g1u h LEU 366 CO 0.05 0.22 -0.86 0.00 0.09 0.00 0.00 178.44 177.95 3g1u h ALA 367 N 1.78 0.05 -0.59 1.53 0.00 -0.80 -0.97 119.26 120.25 3g1u h ALA 367 Ca -0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 3g1u h ALA 367 Cb 0.53 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3g1u h ALA 367 CO 0.03 0.49 0.35 1.96 0.00 0.00 0.00 179.25 182.08 3g1u h GLN 368 N 0.05 0.81 -0.51 0.00 1.08 -1.06 -0.25 115.11 115.23 3g1u h GLN 368 Ca -0.12 -0.08 0.01 0.00 -1.45 0.00 0.00 58.65 57.01 3g1u h GLN 368 Cb 1.56 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 28.80 3g1u h GLN 368 CO 0.17 0.59 0.32 0.82 -0.95 0.00 0.00 178.83 179.78 3g1u h ILE 369 N 0.80 1.09 -0.21 2.54 2.04 -1.20 0.54 117.51 123.11 3g1u h ILE 369 Ca 0.21 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3g1u h ILE 369 Cb 0.00 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3g1u h ILE 369 CO -0.04 0.12 0.08 -0.08 0.00 0.00 0.00 178.15 178.23 3g1u h GLU 370 N 0.65 0.32 -0.19 2.37 4.57 -0.80 -0.74 114.58 120.76 3g1u h GLU 370 Ca 0.19 -0.06 -0.19 0.00 -1.18 0.00 0.00 59.36 58.12 3g1u h GLU 370 Cb -0.03 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 3g1u h GLU 370 CO -0.06 0.38 -0.66 -0.07 -1.18 0.00 0.00 179.01 177.42 3g1u h LEU 371 N 0.19 0.83 -0.24 1.64 3.38 -0.97 -2.97 115.31 117.17 3g1u h LEU 371 Ca 0.07 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 3g1u h LEU 371 Cb 0.18 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3g1u h LEU 371 CO -0.01 1.27 -0.05 -0.25 0.09 0.00 0.00 178.44 179.49 3g1u h TRP 372 N 0.52 0.51 0.00 1.13 2.91 -0.79 -3.20 115.95 117.04 3g1u h TRP 372 Ca -0.02 -0.11 -0.04 0.00 1.13 0.00 0.00 58.89 59.85 3g1u h TRP 372 Cb 1.26 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 29.78 3g1u h TRP 372 CO 0.07 0.68 -0.20 0.66 -1.03 0.00 0.00 178.44 178.62 3g1u h SER 373 N 0.20 0.00 -0.29 2.65 4.64 -1.20 -2.76 113.55 116.80 3g1u h SER 373 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3g1u h SER 373 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3g1u h SER 373 CO 0.02 0.20 0.00 0.59 -0.87 0.00 0.00 176.83 176.77 3g1u n ASN 374 N -3.24 3.31 -0.22 4.97 3.02 -1.12 -4.67 115.26 117.31 3g1u n ASN 374 Ca 0.01 -2.45 -0.06 0.00 -0.03 0.00 0.00 54.58 52.06 3g1u n ASN 374 Cb 0.50 -0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 39.03 3g1u n ASN 374 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3g1u n ARG 375 N 0.32 -0.23 -0.94 3.52 1.74 -1.04 -2.30 116.66 117.72 3g1u n ARG 375 Ca 0.14 0.92 -0.19 0.00 -0.77 0.00 0.00 57.85 57.95 3g1u n ARG 375 Cb 0.71 -1.36 0.12 0.00 -1.02 0.00 0.00 32.46 30.90 3g1u n ARG 375 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3g1u n ASP 376 N -4.43 4.30 -0.01 0.55 9.92 -1.26 -4.52 116.55 121.11 3g1u n ASP 376 Ca 0.01 -3.22 0.02 0.00 -0.53 0.00 0.00 54.79 51.07 3g1u n ASP 376 Cb 0.14 -0.81 -0.05 0.00 -0.64 0.00 0.00 41.12 39.76 3g1u n ASP 376 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3g1u n ASN 377 N -0.61 3.55 -0.24 -2.24 4.13 -0.97 -4.98 115.26 113.91 3g1u n ASN 377 Ca 0.44 0.00 -0.03 0.00 1.68 0.00 0.00 54.58 56.67 3g1u n ASN 377 Cb 1.20 1.20 -0.01 0.00 -1.54 0.00 0.00 39.78 40.63 3g1u n ASN 377 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3g1u n GLY 378 N 2.21 0.29 0.23 7.41 0.00 -1.26 -4.81 105.19 109.26 3g1u n GLY 378 Ca -0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 0.46 -2.80 1.61 3.64 -1.94 -3.35 116.57 114.19 3g1u h LYS 379 Ca -0.06 -0.18 -0.61 0.00 -1.27 0.00 0.00 60.65 58.52 3g1u h LYS 379 Cb 1.05 -0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.45 3g1u h LYS 379 CO 0.09 0.70 -0.73 0.71 -2.27 0.00 0.00 179.45 177.95 3g1u s TYR 380 N -4.43 2.58 0.33 1.91 1.51 -1.26 -5.06 117.35 112.93 3g1u s TYR 380 Ca -0.07 -2.94 -0.29 0.00 -1.01 0.00 0.00 57.07 52.77 3g1u s TYR 380 Cb 0.14 -1.99 -0.11 0.00 -0.11 0.00 0.00 41.96 39.88 3g1u s TYR 380 CO 0.79 -0.66 1.57 -2.14 -1.11 0.00 0.00 175.55 174.00 3g1u s PRO 381 N -0.85 4.10 0.25 -1.71 0.02 -1.26 -4.63 135.00 130.93 3g1u s PRO 381 Ca 0.28 2.60 -0.13 0.00 0.02 0.00 0.00 61.00 63.77 3g1u s PRO 381 Cb -0.01 -3.00 -0.08 0.00 0.02 0.00 0.00 34.50 31.43 3g1u s PRO 381 CO -0.18 -0.61 0.63 1.03 -0.33 0.00 0.00 177.00 177.54 3g1u s ARG 382 N -1.11 3.94 0.96 5.54 3.00 -1.26 -3.55 118.95 126.47 3g1u s ARG 382 Ca 0.60 0.50 0.00 0.00 0.00 0.00 0.00 55.73 56.83 3g1u s ARG 382 Cb -0.48 -2.63 0.00 0.00 0.00 0.00 0.00 34.95 31.84 3g1u s ARG 382 CO 0.54 0.29 0.00 0.41 0.00 0.00 0.00 175.30 176.54 3g1u n GLY 383 N -0.01 1.02 0.09 -3.53 0.00 0.08 -4.48 105.19 98.35 3g1u n GLY 383 Ca 0.01 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 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 0.00 0.20 -0.20 1.61 5.19 -1.89 -3.29 116.42 118.04 3g1u h ASP 384 Ca 0.00 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.18 3g1u h ASP 384 Cb 0.00 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.45 3g1u h ASP 384 CO 0.00 1.19 0.00 0.29 -3.12 0.00 0.00 179.24 177.60 3g1u n LYS 385 N -3.39 1.66 -1.69 3.56 4.01 -1.26 -4.94 118.16 116.12 3g1u n LYS 385 Ca -0.07 -1.00 -0.44 0.00 -0.51 0.00 0.00 58.31 56.29 3g1u n LYS 385 Cb 1.00 -1.34 -0.03 0.00 -0.51 0.00 0.00 35.03 34.14 3g1u n LYS 385 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3g1u n ALA 386 N 0.25 1.97 -2.50 7.82 0.00 -1.24 -4.60 120.51 122.20 3g1u n ALA 386 Ca 0.14 0.35 -0.25 0.00 0.00 0.00 0.00 53.44 53.68 3g1u n ALA 386 Cb 0.28 -2.52 -0.08 0.00 0.00 0.00 0.00 19.45 17.13 3g1u n ALA 386 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g1u s GLY 387 N 2.29 2.53 -0.19 0.00 0.00 -1.26 -4.90 107.32 105.78 3g1u s GLY 387 Ca 0.82 -1.34 -0.08 0.00 0.00 0.00 0.00 44.72 44.12 3g1u s GLY 387 CO 0.38 -1.82 0.07 0.14 0.00 0.00 0.00 173.10 171.87 3g1u s VAL 388 N -3.23 4.79 0.11 1.40 1.01 -1.26 -1.29 120.40 121.92 3g1u s VAL 388 Ca 0.25 -0.03 0.07 0.00 0.00 0.00 0.00 61.98 62.27 3g1u s VAL 388 Cb 0.03 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 3g1u s VAL 388 CO 0.15 0.44 -0.17 -0.36 0.00 0.00 0.00 175.10 175.16 3g1u s PHE 389 N 0.52 1.55 0.43 5.22 0.08 0.22 -4.97 117.98 121.04 3g1u s PHE 389 Ca 0.04 -0.47 -0.05 0.00 0.12 0.00 0.00 56.93 56.57 3g1u s PHE 389 Cb -0.13 -0.84 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 3g1u s PHE 389 CO 0.01 0.17 0.72 -0.06 -0.10 0.00 0.00 175.22 175.95 3g1u s PHE 390 N -1.52 3.53 0.52 0.36 0.08 -1.26 0.63 117.98 120.32 3g1u s PHE 390 Ca 0.06 0.74 -0.22 0.00 0.12 0.00 0.00 56.93 57.63 3g1u s PHE 390 Cb -0.08 -2.22 -0.06 0.00 -0.57 0.00 0.00 43.02 40.09 3g1u s PHE 390 CO 0.04 -0.14 1.28 -0.51 -0.10 0.00 0.00 175.22 175.79 3g1u s LEU 391 N -4.44 3.89 0.26 -0.37 1.43 -1.26 -4.89 118.68 113.30 3g1u s LEU 391 Ca 0.46 2.58 -0.30 0.00 -1.03 0.00 0.00 54.13 55.85 3g1u s LEU 391 Cb -0.10 -4.29 -0.14 0.00 0.03 0.00 0.00 46.19 41.69 3g1u s LEU 391 CO 0.40 -1.35 1.17 -0.81 0.23 0.00 0.00 176.35 175.99 3g1u n PRO 392 N -0.88 1.56 0.27 1.29 -0.04 -1.26 -4.87 135.00 131.06 3g1u n PRO 392 Ca 0.10 0.55 0.13 0.00 -0.04 0.00 0.00 63.50 64.24 3g1u n PRO 392 Cb 0.46 -2.04 0.73 0.00 -0.04 0.00 0.00 33.50 32.62 3g1u n PRO 392 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3g1u h LYS 393 N 2.84 0.00 0.00 0.54 1.57 -2.04 -2.87 116.57 116.62 3g1u h LYS 393 Ca -0.42 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.34 3g1u h LYS 393 Cb 1.32 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.63 3g1u h LYS 393 CO 0.66 0.11 -0.07 0.00 -0.57 0.00 0.00 179.45 179.59 3g1u h ALA 394 N 1.89 1.20 0.00 3.86 0.00 -2.03 -2.60 119.26 121.58 3g1u h ALA 394 Ca -0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3g1u h ALA 394 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3g1u h ALA 394 CO 0.01 0.08 -0.37 -0.07 0.00 0.00 0.00 179.25 178.91 3g1u h LEU 395 N 0.00 0.00 -0.75 0.00 3.38 -1.87 -2.94 115.31 113.13 3g1u h LEU 395 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3g1u h LEU 395 Cb 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3g1u h LEU 395 CO 0.01 0.37 0.34 0.44 0.09 0.00 0.00 178.44 179.68 3g1u h ASP 396 N 0.00 1.01 -0.47 -0.43 3.32 -1.65 -0.40 116.42 117.80 3g1u h ASP 396 Ca -0.00 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.85 3g1u h ASP 396 Cb 0.98 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 3g1u h ASP 396 CO 0.05 0.88 0.11 -0.33 -1.72 0.00 0.00 179.24 178.23 3g1u h GLU 397 N 1.07 0.75 -0.26 3.56 5.08 -1.69 -2.39 114.58 120.70 3g1u h GLU 397 Ca 0.26 -0.18 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3g1u h GLU 397 Cb 0.15 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 3g1u h GLU 397 CO -0.03 0.74 0.00 -0.22 -1.00 0.00 0.00 179.01 178.50 3g1u h LYS 398 N 0.63 0.08 -0.03 2.33 3.64 -1.23 -0.59 116.57 121.40 3g1u h LYS 398 Ca 0.15 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3g1u h LYS 398 Cb 0.33 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3g1u h LYS 398 CO 0.00 0.05 0.01 0.28 -2.27 0.00 0.00 179.45 177.52 3g1u h VAL 399 N 0.08 1.20 -0.43 2.00 2.07 -1.08 -2.67 116.25 117.41 3g1u h VAL 399 Ca 0.12 -0.58 0.07 0.00 0.82 0.00 0.00 66.70 67.13 3g1u h VAL 399 Cb 0.16 1.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.41 3g1u h VAL 399 CO -0.21 0.16 0.06 0.00 0.02 0.00 0.00 177.57 177.60 3g1u h ALA 400 N 0.77 0.45 -0.87 1.67 0.00 -1.33 -2.64 119.26 117.31 3g1u h ALA 400 Ca 0.01 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.12 3g1u h ALA 400 Cb 0.25 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 3g1u h ALA 400 CO 0.00 -0.34 0.56 0.00 0.00 0.00 0.00 179.25 179.47 3g1u h ALA 401 N 1.35 1.67 0.00 0.00 0.00 -0.86 -1.40 119.26 120.02 3g1u h ALA 401 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3g1u h ALA 401 Cb 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3g1u h ALA 401 CO -0.30 0.15 0.00 -0.07 0.00 0.00 0.00 179.25 179.03 3g1u h LEU 402 N 0.84 0.00 -1.95 0.00 3.38 -1.14 -2.77 115.31 113.68 3g1u h LEU 402 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3g1u h LEU 402 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3g1u h LEU 402 CO -0.17 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.77 3g1u n HIS 403 N -2.95 0.09 0.08 1.13 8.25 -0.53 -4.36 115.22 116.93 3g1u n HIS 403 Ca -0.01 -0.05 -0.21 0.00 -0.26 0.00 0.00 57.72 57.19 3g1u n HIS 403 Cb 0.19 -0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.18 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 4.28 0.83 -1.16 2.41 3.38 -1.51 -3.30 115.31 120.24 3g1u h LEU 404 Ca 0.00 -0.74 0.03 0.00 0.09 0.00 0.00 57.88 57.26 3g1u h LEU 404 Cb 0.92 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 3g1u h LEU 404 CO 0.00 1.55 0.58 0.00 0.09 0.00 0.00 178.44 180.66 3g1u h ALA 405 N 0.37 1.44 -0.70 1.53 0.00 -1.81 -2.22 119.26 117.87 3g1u h ALA 405 Ca -0.16 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.77 3g1u h ALA 405 Cb 1.85 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 3g1u h ALA 405 CO 0.22 0.48 0.46 1.25 0.00 0.00 0.00 179.25 181.66 3g1u h HIS 406 N 1.11 0.70 -0.01 0.00 -0.00 -1.87 -2.16 115.15 112.91 3g1u h HIS 406 Ca 0.34 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.73 3g1u h HIS 406 Cb -0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.18 3g1u h HIS 406 CO -0.00 0.36 -0.45 0.28 -0.00 0.00 0.00 177.93 178.12 3g1u n VAL 407 N -4.48 0.00 -1.66 5.26 0.31 -0.90 -4.94 118.33 111.92 3g1u n VAL 407 Ca 0.11 -0.18 -0.07 0.00 -0.01 0.00 0.00 64.34 64.18 3g1u n VAL 407 Cb 0.26 0.90 -0.02 0.00 -0.91 0.00 0.00 33.84 34.08 3g1u n VAL 407 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g1u n GLY 408 N 1.40 0.50 3.68 2.92 0.00 -0.81 -5.00 105.19 107.88 3g1u n GLY 408 Ca 0.10 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.30 3.46 -0.24 4.61 0.00 -0.88 -5.04 121.76 121.37 3g1u s ALA 409 Ca 0.00 0.14 -0.07 0.00 0.00 0.00 0.00 51.96 52.03 3g1u s ALA 409 Cb 0.00 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.83 3g1u s ALA 409 CO 0.00 -0.57 0.07 0.21 0.00 0.00 0.00 175.76 175.47 3g1u s LYS 410 N 1.95 3.70 0.12 0.00 2.20 -1.26 -4.62 119.74 121.83 3g1u s LYS 410 Ca 0.41 -0.46 -0.22 0.00 -0.36 0.00 0.00 55.97 55.34 3g1u s LYS 410 Cb -0.17 -3.31 -0.07 0.00 -1.51 0.00 0.00 37.83 32.76 3g1u s LYS 410 CO 0.15 -0.13 0.68 -0.51 -0.36 0.00 0.00 175.35 175.18 3g1u s LEU 411 N 1.45 4.56 0.15 5.43 1.43 -1.26 -5.06 118.68 125.38 3g1u s LEU 411 Ca 0.06 1.46 -0.30 0.00 -1.03 0.00 0.00 54.13 54.31 3g1u s LEU 411 Cb -0.15 -3.10 -0.07 0.00 0.03 0.00 0.00 46.19 42.90 3g1u s LEU 411 CO 0.04 0.24 1.00 -0.89 0.23 0.00 0.00 176.35 176.96 3g1u s THR 412 N -1.11 4.24 -0.12 5.49 2.01 -1.26 -5.05 115.64 119.85 3g1u s THR 412 Ca 0.32 1.95 -0.16 0.00 0.31 0.00 0.00 61.69 64.11 3g1u s THR 412 Cb -0.21 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.01 3g1u s THR 412 CO 0.23 0.34 0.40 -0.54 -0.69 0.00 0.00 174.62 174.36 3g1u s LYS 413 N -0.32 4.26 0.39 4.92 3.01 -1.26 -5.06 119.74 125.67 3g1u s LYS 413 Ca 0.46 0.31 -0.25 0.00 -1.01 0.00 0.00 55.97 55.49 3g1u s LYS 413 Cb -0.25 -3.41 -0.09 0.00 -1.01 0.00 0.00 37.83 33.07 3g1u s LYS 413 CO 0.32 0.24 1.11 -0.51 0.51 0.00 0.00 175.35 177.02 3g1u s LEU 414 N 0.39 4.20 0.72 3.17 1.43 -1.26 -5.05 118.68 122.28 3g1u s LEU 414 Ca 0.22 2.20 -0.11 0.00 -1.03 0.00 0.00 54.13 55.42 3g1u s LEU 414 Cb -0.14 -4.06 0.02 0.00 0.03 0.00 0.00 46.19 42.04 3g1u s LEU 414 CO 0.08 -0.56 1.07 0.42 0.23 0.00 0.00 176.35 177.60 3g1u s THR 415 N -1.50 3.74 0.19 5.49 -4.23 -1.26 -4.78 115.64 113.29 3g1u s THR 415 Ca 0.56 0.56 -0.15 0.00 -1.18 0.00 0.00 61.69 61.49 3g1u s THR 415 Cb -0.27 -3.35 0.17 0.00 1.34 0.00 0.00 72.50 70.39 3g1u s THR 415 CO 0.34 -0.74 1.65 -0.65 -0.54 0.00 0.00 174.62 174.68 3g1u h PRO 416 N -0.80 0.02 -0.61 3.99 0.11 -1.99 0.14 132.00 132.86 3g1u h PRO 416 Ca -0.45 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.72 3g1u h PRO 416 Cb 1.23 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 3g1u h PRO 416 CO 0.59 0.01 0.32 0.87 -0.21 0.00 0.00 178.00 179.58 3g1u h LYS 417 N 0.02 0.58 -0.67 1.05 6.56 -2.00 -0.42 116.57 121.69 3g1u h LYS 417 Ca 0.26 -0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.77 3g1u h LYS 417 Cb 0.40 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.90 3g1u h LYS 417 CO -0.53 0.38 0.25 1.96 -2.06 0.00 0.00 179.45 179.46 3g1u h GLN 418 N 0.60 1.01 -0.42 3.15 4.20 -1.69 -2.80 115.11 119.16 3g1u h GLN 418 Ca 0.27 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 3g1u h GLN 418 Cb 0.19 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3g1u h GLN 418 CO -0.19 0.85 0.16 0.00 -0.67 0.00 0.00 178.83 178.98 3g1u h ALA 419 N 1.11 0.54 -0.31 3.87 0.00 -0.14 -2.89 119.26 121.44 3g1u h ALA 419 Ca 0.22 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3g1u h ALA 419 Cb 0.23 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 3g1u h ALA 419 CO -0.02 0.16 -0.17 0.93 0.00 0.00 0.00 179.25 180.16 3g1u h GLU 420 N 0.53 -0.12 -1.16 0.00 5.08 -0.95 -2.19 114.58 115.77 3g1u h GLU 420 Ca 0.14 0.01 -0.56 0.00 -1.00 0.00 0.00 59.36 57.95 3g1u h GLU 420 Cb 0.21 0.03 -0.24 0.00 0.50 0.00 0.00 28.75 29.25 3g1u h GLU 420 CO -0.01 -0.08 0.72 0.66 -1.00 0.00 0.00 179.01 179.30 3g1u n TYR 421 N -5.34 2.69 0.00 4.33 4.01 -1.07 -3.60 117.16 118.18 3g1u n TYR 421 Ca 0.01 -2.63 0.00 0.00 -0.16 0.00 0.00 57.90 55.11 3g1u n TYR 421 Cb 0.25 -1.27 0.00 0.00 -0.31 0.00 0.00 39.34 38.01 3g1u n TYR 421 CO 0.00 0.00 0.00 1.51 -0.46 0.00 0.00 176.86 177.91 3g1u n ILE 422 N -0.54 0.00 -0.33 -0.72 3.06 -1.14 -5.01 119.36 114.68 3g1u n ILE 422 Ca 0.52 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.77 3g1u n ILE 422 Cb 0.69 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.87 3g1u n ILE 422 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64