#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gii s ILE 2 N 0.00 0.21 -0.09 -0.61 1.01 -1.26 -4.45 121.20 116.01 3gii s ILE 2 Ca 0.00 0.17 -0.02 0.00 0.00 0.00 0.00 60.65 60.80 3gii s ILE 2 Cb 0.00 -0.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.99 3gii s ILE 2 CO 0.00 0.19 0.00 -0.69 0.00 0.00 0.00 174.94 174.44 3gii s VAL 3 N 2.03 4.32 -0.11 2.92 1.01 0.53 -1.65 120.40 129.46 3gii s VAL 3 Ca 0.05 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3gii s VAL 3 Cb -0.13 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 3gii s VAL 3 CO -0.05 0.60 -0.13 -0.22 0.00 0.00 0.00 175.10 175.29 3gii s LEU 4 N -0.77 2.73 -0.06 3.92 0.20 0.14 -1.67 118.68 123.16 3gii s LEU 4 Ca 0.12 -0.28 0.06 0.00 0.69 0.00 0.00 54.13 54.71 3gii s LEU 4 Cb -0.12 -1.60 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 3gii s LEU 4 CO 0.02 0.22 -0.24 0.12 -0.29 0.00 0.00 176.35 176.18 3gii s PHE 5 N 0.03 2.35 -0.07 5.38 5.36 0.83 0.31 117.98 132.18 3gii s PHE 5 Ca -0.04 -0.74 0.06 0.00 -0.96 0.00 0.00 56.93 55.24 3gii s PHE 5 Cb -0.14 -1.55 -0.01 0.00 -0.34 0.00 0.00 43.02 40.97 3gii s PHE 5 CO 0.04 -0.24 -0.25 0.08 -1.46 0.00 0.00 175.22 173.39 3gii s VAL 6 N -0.05 2.08 -0.04 3.12 1.01 -0.80 0.08 120.40 125.80 3gii s VAL 6 Ca -0.06 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 60.86 3gii s VAL 6 Cb -0.14 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.51 3gii s VAL 6 CO 0.04 0.57 0.02 -0.62 0.00 0.00 0.00 175.10 175.11 3gii s ASP 7 N -0.08 0.75 0.34 3.32 2.15 -0.66 -2.12 116.67 120.37 3gii s ASP 7 Ca -0.06 -0.01 -0.26 0.00 0.43 0.00 0.00 52.55 52.65 3gii s ASP 7 Cb -0.14 -0.23 -0.09 0.00 -0.30 0.00 0.00 42.92 42.15 3gii s ASP 7 CO 0.05 -0.15 1.04 -0.36 -0.17 0.00 0.00 175.17 175.57 3gii s PHE 8 N 1.43 3.47 0.13 -5.34 0.08 0.52 -1.56 117.98 116.72 3gii s PHE 8 Ca -0.04 1.70 -0.30 0.00 0.12 0.00 0.00 56.93 58.41 3gii s PHE 8 Cb -0.13 -3.13 -0.06 0.00 -0.57 0.00 0.00 43.02 39.13 3gii s PHE 8 CO -0.03 -0.40 0.99 -0.51 -0.10 0.00 0.00 175.22 175.18 3gii s ASP 9 N -1.36 7.45 -0.07 1.36 1.01 -0.95 -4.15 116.67 119.96 3gii s ASP 9 Ca 0.52 1.87 -0.01 0.00 0.71 0.00 0.00 52.55 55.63 3gii s ASP 9 Cb -0.24 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.09 3gii s ASP 9 CO 0.31 -0.10 0.02 0.00 0.21 0.00 0.00 175.17 175.62 3gii n TYR 10 N 2.66 -0.07 0.04 4.23 0.18 -1.26 -4.52 117.16 118.41 3gii n TYR 10 Ca 0.02 0.01 -0.12 0.00 1.88 0.00 0.00 57.90 59.70 3gii n TYR 10 Cb 0.48 -0.15 -0.08 0.00 -0.38 0.00 0.00 39.34 39.22 3gii n TYR 10 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 3gii h PHE 11 N 2.09 -1.19 -0.93 -3.48 3.57 -1.94 0.18 116.94 115.23 3gii h PHE 11 Ca -0.04 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.53 3gii h PHE 11 Cb 0.08 0.52 -0.05 0.00 2.79 0.00 0.00 35.95 39.29 3gii h PHE 11 CO 0.02 -0.43 0.61 1.88 -2.23 0.00 0.00 178.31 178.16 3gii h TYR 12 N -0.50 1.14 -0.48 0.41 0.05 -1.96 0.10 116.97 115.73 3gii h TYR 12 Ca 0.01 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.73 3gii h TYR 12 Cb 0.54 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 3gii h TYR 12 CO -0.49 0.68 -0.08 0.00 -1.05 0.00 0.00 178.16 177.23 3gii h ALA 13 N 1.37 0.97 -0.48 3.88 0.00 -1.68 -2.79 119.26 120.52 3gii h ALA 13 Ca 0.36 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3gii h ALA 13 Cb -0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3gii h ALA 13 CO -0.10 0.61 -0.22 0.37 0.00 0.00 0.00 179.25 179.91 3gii h GLN 14 N 0.77 0.98 -0.70 0.00 4.15 0.67 -2.32 115.11 118.66 3gii h GLN 14 Ca 0.13 -0.42 0.02 0.00 0.77 0.00 0.00 58.65 59.15 3gii h GLN 14 Cb 0.57 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.19 3gii h GLN 14 CO 0.03 1.10 0.47 0.28 -1.93 0.00 0.00 178.83 178.78 3gii h VAL 15 N 0.85 1.14 -0.20 2.39 2.07 -0.89 -1.06 116.25 120.55 3gii h VAL 15 Ca 0.11 -0.31 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 3gii h VAL 15 Cb 0.80 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3gii h VAL 15 CO 0.07 0.16 -0.44 -0.33 0.02 0.00 0.00 177.57 177.06 3gii h GLU 16 N 0.90 0.49 -0.15 1.57 4.39 -1.22 -1.37 114.58 119.18 3gii h GLU 16 Ca 0.27 -0.26 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 3gii h GLU 16 Cb -0.02 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 3gii h GLU 16 CO -0.07 0.84 -0.29 0.93 -1.16 0.00 0.00 179.01 179.25 3gii h GLU 17 N 0.40 0.30 -0.53 2.33 5.08 -0.79 0.00 114.58 121.37 3gii h GLU 17 Ca 0.03 -0.11 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 3gii h GLU 17 Cb 0.93 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 3gii h GLU 17 CO 0.08 0.57 -0.14 0.28 -1.00 0.00 0.00 179.01 178.80 3gii h VAL 18 N 0.26 1.27 0.00 3.13 2.07 -0.74 -1.94 116.25 120.30 3gii h VAL 18 Ca 0.04 -1.30 -0.13 0.00 0.82 0.00 0.00 66.70 66.13 3gii h VAL 18 Cb 0.66 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3gii h VAL 18 CO 0.05 0.46 -0.62 -0.07 0.02 0.00 0.00 177.57 177.40 3gii h LEU 19 N 0.89 0.00 -6.53 2.57 4.07 -1.10 -3.39 115.31 111.82 3gii h LEU 19 Ca 0.13 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.54 3gii h LEU 19 Cb 0.71 0.00 -0.38 0.00 1.08 0.00 0.00 40.66 42.07 3gii h LEU 19 CO 0.05 0.62 -0.83 0.21 -1.08 0.00 0.00 178.44 177.41 3gii s ASN 20 N -6.64 2.58 0.00 -0.43 2.47 -0.03 -5.01 114.94 107.89 3gii s ASN 20 Ca 0.00 -2.15 0.24 0.00 0.42 0.00 0.00 52.86 51.37 3gii s ASN 20 Cb 0.11 -0.24 1.26 0.00 -1.45 0.00 0.00 41.25 40.93 3gii s ASN 20 CO 0.75 -0.29 1.79 -2.65 -3.72 0.00 0.00 177.10 172.97 3gii n PRO 21 N 4.00 0.46 0.23 0.43 -0.02 -0.74 -2.07 135.00 137.28 3gii n PRO 21 Ca 0.13 0.05 0.16 0.00 -2.02 0.00 0.00 63.50 61.82 3gii n PRO 21 Cb 0.39 -1.50 0.70 0.00 -0.02 0.00 0.00 33.50 33.07 3gii n PRO 21 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3gii h SER 22 N 0.00 0.00 0.77 2.55 4.64 -1.95 -2.15 113.55 117.40 3gii h SER 22 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3gii h SER 22 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 3gii h SER 22 CO 0.00 0.00 -0.29 -0.07 -0.87 0.00 0.00 176.83 175.60 3gii h LEU 23 N 0.00 0.00 -9.51 5.97 4.07 -1.74 -3.46 115.31 110.64 3gii h LEU 23 Ca 0.00 0.00 -0.57 0.00 0.08 0.00 0.00 57.88 57.39 3gii h LEU 23 Cb 0.33 0.00 0.05 0.00 1.08 0.00 0.00 40.66 42.13 3gii h LEU 23 CO 0.00 0.29 0.87 0.29 -1.08 0.00 0.00 178.44 178.81 3gii n LYS 24 N -3.54 2.28 -0.48 1.13 5.02 -0.81 -1.96 118.16 119.79 3gii n LYS 24 Ca -0.00 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 57.11 3gii n LYS 24 Cb 0.44 -2.62 0.00 0.00 -0.02 0.00 0.00 35.03 32.83 3gii n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gii n GLY 25 N 3.63 0.74 3.30 0.72 0.00 -1.26 -5.06 105.19 107.26 3gii n GLY 25 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 3gii n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gii s LYS 26 N -0.52 1.19 0.14 1.61 -2.85 -0.83 -5.09 119.74 113.39 3gii s LYS 26 Ca 0.00 -1.39 -0.31 0.00 -1.00 0.00 0.00 55.97 53.27 3gii s LYS 26 Cb 0.00 -1.09 -0.08 0.00 -2.06 0.00 0.00 37.83 34.60 3gii s LYS 26 CO 0.00 0.20 1.36 -1.25 0.10 0.00 0.00 175.35 175.76 3gii s PRO 27 N -3.01 4.35 -0.03 1.78 0.04 -1.26 -4.84 135.00 132.02 3gii s PRO 27 Ca 0.15 2.06 0.07 0.00 0.04 0.00 0.00 61.00 63.31 3gii s PRO 27 Cb -0.04 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.25 3gii s PRO 27 CO 0.05 -0.37 -0.23 0.08 0.04 0.00 0.00 177.00 176.56 3gii s VAL 28 N 0.78 1.88 -0.07 -0.36 1.01 -1.26 -1.56 120.40 120.82 3gii s VAL 28 Ca 0.62 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 3gii s VAL 28 Cb -0.36 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.46 3gii s VAL 28 CO 0.33 0.53 -0.02 -0.69 0.00 0.00 0.00 175.10 175.25 3gii s VAL 29 N -0.37 0.50 -0.20 2.92 1.01 0.25 -1.49 120.40 123.01 3gii s VAL 29 Ca 0.04 0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 3gii s VAL 29 Cb -0.11 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 3gii s VAL 29 CO 0.01 0.26 0.07 -0.69 0.00 0.00 0.00 175.10 174.75 3gii s VAL 30 N 1.64 4.72 0.01 2.92 1.01 0.04 -1.76 120.40 128.97 3gii s VAL 30 Ca 0.00 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.01 3gii s VAL 30 Cb -0.13 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 3gii s VAL 30 CO -0.04 0.43 -0.23 0.00 0.00 0.00 0.00 175.10 175.26 3gii s VAL 32 N -0.65 5.15 0.34 0.00 1.01 0.35 -1.26 120.40 125.35 3gii s VAL 32 Ca 0.09 -1.43 -0.26 0.00 0.00 0.00 0.00 61.98 60.38 3gii s VAL 32 Cb -0.09 -4.36 -0.09 0.00 0.00 0.00 0.00 36.38 31.83 3gii s VAL 32 CO 0.00 -0.91 1.04 -0.36 0.00 0.00 0.00 175.10 174.87 3gii s PHE 33 N 1.76 3.48 0.00 5.22 0.08 -1.26 -2.32 117.98 124.93 3gii s PHE 33 Ca 0.04 1.70 0.00 0.00 0.12 0.00 0.00 56.93 58.80 3gii s PHE 33 Cb -0.29 -3.12 0.00 0.00 -0.57 0.00 0.00 43.02 39.04 3gii s PHE 33 CO 0.03 -0.37 0.77 -1.13 -0.10 0.00 0.00 175.22 174.42 3gii n SER 34 N 0.49 1.50 -0.63 1.36 3.41 -1.05 -4.93 113.62 113.77 3gii n SER 34 Ca 0.02 -1.56 -0.07 0.00 -0.26 0.00 0.00 58.87 57.01 3gii n SER 34 Cb 0.48 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.40 3gii n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gii n GLY 35 N -0.28 0.66 0.12 5.00 0.00 -1.26 -4.81 105.19 104.62 3gii n GLY 35 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3gii n GLY 35 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gii h ARG 36 N 0.00 0.00 0.00 1.61 2.47 -1.86 -3.45 114.38 113.15 3gii h ARG 36 Ca -0.14 0.00 0.20 0.00 -1.26 0.00 0.00 59.98 58.77 3gii h ARG 36 Cb 0.88 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.17 3gii h ARG 36 CO 0.21 0.68 0.63 1.97 0.56 0.00 0.00 179.97 184.01 3gii n PHE 37 N -3.68 -1.06 -1.58 3.04 1.16 -1.26 -4.98 117.46 109.09 3gii n PHE 37 Ca -0.01 -1.05 -0.46 0.00 -1.87 0.00 0.00 57.45 54.06 3gii n PHE 37 Cb 0.68 0.51 -0.04 0.00 -1.61 0.00 0.00 39.48 39.01 3gii n PHE 37 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 3gii n GLU 38 N -0.73 1.85 -1.91 3.97 2.13 -1.26 -1.73 120.64 122.96 3gii n GLU 38 Ca -0.00 0.57 -0.15 0.00 0.66 0.00 0.00 57.16 58.24 3gii n GLU 38 Cb 0.54 -2.88 -0.03 0.00 0.27 0.00 0.00 31.44 29.35 3gii n GLU 38 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3gii n ASP 39 N 9.70 -4.58 -4.73 4.31 8.00 -1.26 -4.99 116.55 123.01 3gii n ASP 39 Ca 0.30 0.15 -0.34 0.00 0.71 0.00 0.00 54.79 55.61 3gii n ASP 39 Cb 0.35 -3.57 0.09 0.00 -0.02 0.00 0.00 41.12 37.97 3gii n ASP 39 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3gii s SER 40 N -2.56 4.25 0.00 -2.24 1.04 -0.71 -4.02 113.70 109.47 3gii s SER 40 Ca 0.00 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.74 3gii s SER 40 Cb 0.00 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3gii s SER 40 CO 0.00 -2.22 0.00 0.61 0.98 0.00 0.00 173.24 172.61 3gii n GLY 41 N 0.29 0.32 3.50 7.32 0.00 -1.26 -2.53 105.19 112.83 3gii n GLY 41 Ca 0.13 -2.31 -0.24 0.00 0.00 0.00 0.00 46.02 43.61 3gii n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gii s ALA 42 N -1.60 2.63 -0.12 4.61 0.00 -0.98 -1.25 121.76 125.06 3gii s ALA 42 Ca 0.00 -2.08 -0.22 0.00 0.00 0.00 0.00 51.96 49.66 3gii s ALA 42 Cb 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.40 3gii s ALA 42 CO 0.00 -0.15 0.65 0.08 0.00 0.00 0.00 175.76 176.35 3gii s VAL 43 N -2.98 5.05 -0.10 0.00 1.01 -0.57 -0.50 120.40 122.31 3gii s VAL 43 Ca 0.34 1.31 -0.26 0.00 0.00 0.00 0.00 61.98 63.36 3gii s VAL 43 Cb 0.07 -3.98 -0.27 0.00 0.00 0.00 0.00 36.38 32.20 3gii s VAL 43 CO 0.15 0.21 0.86 0.00 0.00 0.00 0.00 175.10 176.32 3gii h ALA 44 N 6.99 -0.02 -2.29 5.51 0.00 -0.95 0.14 119.26 128.64 3gii h ALA 44 Ca -0.37 -0.54 0.16 0.00 0.00 0.00 0.00 54.91 54.16 3gii h ALA 44 Cb 1.17 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.88 3gii h ALA 44 CO 0.77 0.11 0.50 -0.08 0.00 0.00 0.00 179.25 180.54 3gii s THR 45 N -2.48 0.00 0.03 0.00 -1.32 -1.17 -4.37 115.64 106.33 3gii s THR 45 Ca -0.17 -0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 59.87 3gii s THR 45 Cb -0.01 -1.63 -0.02 0.00 -1.51 0.00 0.00 72.50 69.33 3gii s THR 45 CO 0.73 0.00 0.04 0.00 -2.21 0.00 0.00 174.62 173.18 3gii s ALA 46 N -3.20 0.07 1.10 11.08 0.00 -1.26 -0.78 121.76 128.77 3gii s ALA 46 Ca 0.10 -0.64 -0.16 0.00 0.00 0.00 0.00 51.96 51.26 3gii s ALA 46 Cb -0.01 0.21 0.24 0.00 0.00 0.00 0.00 23.12 23.55 3gii s ALA 46 CO -0.02 -0.26 1.13 0.54 0.00 0.00 0.00 175.76 177.15 3gii s ASN 47 N -1.96 1.85 0.43 0.00 2.20 -0.56 -4.78 114.94 112.13 3gii s ASN 47 Ca -0.08 0.75 0.15 0.00 -0.94 0.00 0.00 52.86 52.75 3gii s ASN 47 Cb -0.03 -1.11 0.94 0.00 -2.00 0.00 0.00 41.25 39.05 3gii s ASN 47 CO -0.04 -3.56 1.94 1.88 -2.94 0.00 0.00 177.10 174.38 3gii h TYR 48 N -2.19 0.00 0.29 1.54 -1.99 -1.96 -1.60 116.97 111.05 3gii h TYR 48 Ca -0.48 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.24 3gii h TYR 48 Cb 1.30 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.03 3gii h TYR 48 CO -1.16 0.25 -0.14 0.93 -0.00 0.00 0.00 178.16 178.04 3gii h GLU 49 N 0.00 -0.37 -0.91 4.88 3.07 -1.91 -2.28 114.58 117.05 3gii h GLU 49 Ca -0.00 0.03 0.08 0.00 -0.50 0.00 0.00 59.36 58.96 3gii h GLU 49 Cb 0.45 0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 28.38 3gii h GLU 49 CO 0.03 -0.14 0.56 0.00 -1.40 0.00 0.00 179.01 178.06 3gii h ALA 50 N 0.12 1.29 -0.41 3.43 0.00 -1.78 -3.15 119.26 118.75 3gii h ALA 50 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3gii h ALA 50 Cb 0.40 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3gii h ALA 50 CO 0.06 0.27 -0.00 0.00 0.00 0.00 0.00 179.25 179.58 3gii h ARG 51 N 0.98 0.66 -0.49 0.00 3.08 -1.01 -2.08 114.38 115.53 3gii h ARG 51 Ca 0.41 -0.16 0.14 0.00 0.07 0.00 0.00 59.98 60.44 3gii h ARG 51 Cb 0.27 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3gii h ARG 51 CO -0.21 0.68 0.39 0.87 -1.07 0.00 0.00 179.97 180.64 3gii h LYS 52 N 0.63 0.00 -0.64 0.04 1.57 -1.37 -0.18 116.57 116.62 3gii h LYS 52 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3gii h LYS 52 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 3gii h LYS 52 CO 0.02 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.09 3gii n PHE 53 N -4.15 1.60 -0.13 -1.35 3.72 -0.79 -4.92 117.46 111.44 3gii n PHE 53 Ca 0.09 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.89 3gii n PHE 53 Cb 0.60 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 3gii n PHE 53 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gii n GLY 54 N 0.92 0.57 3.60 1.37 0.00 -0.08 -4.97 105.19 106.59 3gii n GLY 54 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 3gii n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gii s VAL 55 N -2.30 4.33 0.13 1.61 1.01 -1.18 -5.00 120.40 119.01 3gii s VAL 55 Ca 0.00 1.18 -0.00 0.00 0.00 0.00 0.00 61.98 63.16 3gii s VAL 55 Cb 0.00 -4.52 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 3gii s VAL 55 CO 0.00 -0.87 0.03 -1.59 0.00 0.00 0.00 175.10 172.67 3gii s LYS 56 N 4.13 0.92 0.15 2.72 -2.85 -1.26 -3.80 119.74 119.73 3gii s LYS 56 Ca 0.44 -1.42 -0.34 0.00 -1.00 0.00 0.00 55.97 53.65 3gii s LYS 56 Cb -0.09 0.12 -0.16 0.00 -2.06 0.00 0.00 37.83 35.64 3gii s LYS 56 CO 0.27 -0.21 1.17 0.00 0.10 0.00 0.00 175.35 176.69 3gii n ALA 57 N -0.09 -1.09 0.00 0.59 0.00 -1.26 -2.84 120.51 115.81 3gii n ALA 57 Ca -0.07 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3gii n ALA 57 Cb 0.63 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3gii n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gii n GLY 58 N 2.07 2.98 3.84 0.00 0.00 0.04 -4.96 105.19 109.16 3gii n GLY 58 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3gii n GLY 58 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gii s ILE 59 N -2.78 4.52 0.72 -0.61 -4.36 -1.13 -4.71 121.20 112.85 3gii s ILE 59 Ca 0.00 1.24 -0.16 0.00 -0.26 0.00 0.00 60.65 61.47 3gii s ILE 59 Cb 0.00 -3.70 0.03 0.00 1.25 0.00 0.00 42.46 40.04 3gii s ILE 59 CO 0.00 -0.62 1.22 -2.84 0.24 0.00 0.00 174.94 172.94 3gii s PRO 60 N -3.91 2.19 0.17 0.37 0.02 -1.26 -1.51 135.00 131.07 3gii s PRO 60 Ca 0.59 1.82 -0.13 0.00 0.02 0.00 0.00 61.00 63.30 3gii s PRO 60 Cb -0.10 -1.83 0.07 0.00 0.02 0.00 0.00 34.50 32.66 3gii s PRO 60 CO 0.28 -1.81 1.80 0.82 -0.33 0.00 0.00 177.00 177.75 3gii h ILE 61 N -0.16 1.18 0.00 2.83 2.04 -1.39 -2.75 117.51 119.26 3gii h ILE 61 Ca -0.48 -0.43 -0.05 0.00 1.00 0.00 0.00 64.86 64.90 3gii h ILE 61 Cb 1.30 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3gii h ILE 61 CO 0.50 0.19 -0.23 -0.37 0.00 0.00 0.00 178.15 178.24 3gii h VAL 62 N 0.76 1.06 -0.65 1.67 -1.51 -1.83 -0.87 116.25 114.89 3gii h VAL 62 Ca 0.20 -0.83 -0.04 0.00 -1.23 0.00 0.00 66.70 64.80 3gii h VAL 62 Cb 0.02 1.46 -0.03 0.00 -2.13 0.00 0.00 31.29 30.61 3gii h VAL 62 CO -0.03 0.23 0.24 -0.08 -1.23 0.00 0.00 177.57 176.69 3gii h GLU 63 N 0.00 0.97 -0.20 5.19 4.57 -1.86 -2.53 114.58 120.72 3gii h GLU 63 Ca -0.00 -0.17 -0.15 0.00 -1.18 0.00 0.00 59.36 57.85 3gii h GLU 63 Cb 0.44 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 3gii h GLU 63 CO 0.03 0.80 -0.51 0.00 -1.18 0.00 0.00 179.01 178.15 3gii h ALA 64 N 1.32 0.74 -0.23 2.92 0.00 -1.05 -3.00 119.26 119.96 3gii h ALA 64 Ca 0.22 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 3gii h ALA 64 Cb 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3gii h ALA 64 CO -0.02 0.68 -0.16 0.87 0.00 0.00 0.00 179.25 180.62 3gii h LYS 65 N 0.44 0.38 0.00 0.00 1.79 -1.12 0.11 116.57 118.17 3gii h LYS 65 Ca 0.02 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.34 3gii h LYS 65 Cb 1.04 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.65 3gii h LYS 65 CO 0.10 0.54 -0.17 0.87 -1.08 0.00 0.00 179.45 179.71 3gii h LYS 66 N 0.36 0.00 0.05 3.15 1.57 -1.32 -1.65 116.57 118.73 3gii h LYS 66 Ca 0.07 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.49 3gii h LYS 66 Cb 0.49 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.76 3gii h LYS 66 CO 0.03 0.17 -2.01 -0.89 -0.57 0.00 0.00 179.45 176.18 3gii n ILE 67 N -3.40 1.63 -3.36 1.86 5.41 -0.97 -4.72 119.36 115.81 3gii n ILE 67 Ca -0.00 -0.45 -0.26 0.00 1.00 0.00 0.00 62.75 63.03 3gii n ILE 67 Cb 0.36 -1.76 -0.08 0.00 -0.71 0.00 0.00 39.64 37.46 3gii n ILE 67 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3gii n LEU 68 N -3.76 2.68 0.17 1.39 4.77 0.34 -4.93 117.00 117.65 3gii n LEU 68 Ca -0.38 -5.22 0.18 0.00 -0.03 0.00 0.00 56.01 50.56 3gii n LEU 68 Cb 0.93 -0.27 0.80 0.00 -2.33 0.00 0.00 43.42 42.54 3gii n LEU 68 CO 0.28 2.06 1.15 1.55 -1.33 0.00 0.00 177.39 181.11 3gii h PRO 69 N 4.13 0.00 -0.51 3.23 0.13 -1.50 -2.33 132.00 135.15 3gii h PRO 69 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3gii h PRO 69 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3gii h PRO 69 CO 0.72 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.58 3gii n ASN 70 N -3.85 3.49 -4.60 1.44 3.02 -1.26 -4.96 115.26 108.54 3gii n ASN 70 Ca 0.03 -2.07 -0.29 0.00 -0.03 0.00 0.00 54.58 52.22 3gii n ASN 70 Cb 0.39 -0.37 0.20 0.00 -0.61 0.00 0.00 39.78 39.39 3gii n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gii s ALA 71 N -1.14 0.42 -0.27 5.41 0.00 -0.88 -4.95 121.76 120.35 3gii s ALA 71 Ca 0.36 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 52.05 3gii s ALA 71 Cb 0.20 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 3gii s ALA 71 CO 0.23 -3.23 0.24 0.08 0.00 0.00 0.00 175.76 173.08 3gii s VAL 72 N -2.71 5.28 -0.29 0.00 1.01 -0.60 -5.00 120.40 118.08 3gii s VAL 72 Ca 0.67 0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.88 3gii s VAL 72 Cb -0.22 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.60 3gii s VAL 72 CO 0.61 0.25 0.06 -0.31 0.00 0.00 0.00 175.10 175.70 3gii s TYR 73 N 1.68 3.15 0.09 5.22 2.02 -1.26 -0.58 117.35 127.67 3gii s TYR 73 Ca 0.10 -1.13 0.08 0.00 -0.37 0.00 0.00 57.07 55.74 3gii s TYR 73 Cb -0.15 -2.23 -0.04 0.00 -0.40 0.00 0.00 41.96 39.14 3gii s TYR 73 CO 0.09 -0.62 -0.16 -0.51 -1.57 0.00 0.00 175.55 172.79 3gii s LEU 74 N 1.46 2.77 0.38 -1.29 1.43 -0.72 -5.01 118.68 117.69 3gii s LEU 74 Ca 0.02 -0.46 -0.24 0.00 -1.03 0.00 0.00 54.13 52.42 3gii s LEU 74 Cb -0.17 -1.61 -0.10 0.00 0.03 0.00 0.00 46.19 44.33 3gii s LEU 74 CO 0.01 0.21 0.96 -2.16 0.23 0.00 0.00 176.35 175.60 3gii s PRO 75 N -1.91 4.36 0.11 1.29 0.04 -1.26 -1.50 135.00 136.13 3gii s PRO 75 Ca 0.18 1.27 -0.31 0.00 0.04 0.00 0.00 61.00 62.17 3gii s PRO 75 Cb -0.11 -2.49 -0.09 0.00 0.04 0.00 0.00 34.50 31.85 3gii s PRO 75 CO 0.09 0.08 1.57 1.41 0.04 0.00 0.00 177.00 180.19 3gii s MET 76 N -2.60 4.23 -0.68 4.56 1.75 -0.39 -4.78 119.30 121.39 3gii s MET 76 Ca 0.57 2.28 0.00 0.00 -1.25 0.00 0.00 55.69 57.29 3gii s MET 76 Cb -0.15 -3.38 0.17 0.00 2.84 0.00 0.00 34.83 34.31 3gii s MET 76 CO 0.20 -0.63 0.49 1.03 -0.65 0.00 0.00 175.02 175.45 3gii s ARG 77 N 1.84 2.58 0.20 4.11 0.52 -1.26 -4.96 118.95 121.98 3gii s ARG 77 Ca 0.70 -2.86 -0.11 0.00 -0.52 0.00 0.00 55.73 52.94 3gii s ARG 77 Cb -0.40 -3.64 0.19 0.00 0.52 0.00 0.00 34.95 31.61 3gii s ARG 77 CO 0.31 -1.20 1.81 -0.22 0.02 0.00 0.00 175.30 176.02 3gii h LYS 78 N 6.40 0.65 -0.90 3.54 1.63 -1.99 -2.65 116.57 123.25 3gii h LYS 78 Ca 0.04 -0.04 0.12 0.00 -0.85 0.00 0.00 60.65 59.92 3gii h LYS 78 Cb 0.87 -0.15 -0.08 0.00 -0.60 0.00 0.00 32.23 32.27 3gii h LYS 78 CO 0.74 0.43 0.53 0.93 -3.45 0.00 0.00 179.45 178.63 3gii h GLU 79 N 0.67 0.81 -0.18 1.90 3.07 -1.99 0.78 114.58 119.64 3gii h GLU 79 Ca 0.27 -0.05 -0.19 0.00 -0.50 0.00 0.00 59.36 58.89 3gii h GLU 79 Cb 0.12 -0.18 0.01 0.00 -0.84 0.00 0.00 28.75 27.85 3gii h GLU 79 CO -0.15 0.54 -0.62 0.28 -1.40 0.00 0.00 179.01 177.65 3gii h VAL 80 N 0.83 1.30 -0.19 3.13 2.07 -1.92 -2.67 116.25 118.81 3gii h VAL 80 Ca 0.46 -1.85 -0.06 0.00 0.82 0.00 0.00 66.70 66.07 3gii h VAL 80 Cb 0.49 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 3gii h VAL 80 CO -0.28 0.58 -0.13 1.88 0.02 0.00 0.00 177.57 179.63 3gii h TYR 81 N 0.45 0.32 -0.10 1.57 0.05 -1.04 -2.80 116.97 115.43 3gii h TYR 81 Ca -0.03 -0.04 -0.15 0.00 0.05 0.00 0.00 58.73 58.56 3gii h TYR 81 Cb 1.25 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.89 3gii h TYR 81 CO 0.09 0.44 -0.60 0.37 -1.05 0.00 0.00 178.16 177.41 3gii h GLN 82 N 0.29 0.33 -0.34 4.88 5.75 -0.79 -1.32 115.11 123.91 3gii h GLN 82 Ca 0.06 -0.22 -0.08 0.00 -0.15 0.00 0.00 58.65 58.26 3gii h GLN 82 Cb 0.42 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.99 3gii h GLN 82 CO 0.02 0.83 -0.09 1.96 -2.65 0.00 0.00 178.83 178.90 3gii h GLN 83 N 0.24 0.66 0.04 1.69 4.20 -1.27 -1.32 115.11 119.35 3gii h GLN 83 Ca -0.00 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 3gii h GLN 83 Cb 1.11 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.86 3gii h GLN 83 CO 0.10 0.83 -0.02 0.28 -0.67 0.00 0.00 178.83 179.35 3gii h VAL 84 N 0.44 1.03 -0.57 -0.54 2.07 -1.49 -1.69 116.25 115.50 3gii h VAL 84 Ca 0.09 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.50 3gii h VAL 84 Cb 0.59 1.18 -0.10 0.00 -1.52 0.00 0.00 31.29 31.44 3gii h VAL 84 CO 0.03 0.06 -0.00 -1.28 0.02 0.00 0.00 177.57 176.40 3gii h SER 85 N -0.15 -0.26 -0.48 0.57 0.87 -1.20 -1.41 113.55 111.49 3gii h SER 85 Ca -0.01 0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 3gii h SER 85 Cb 0.13 0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 3gii h SER 85 CO 0.01 -0.10 0.20 0.28 -0.53 0.00 0.00 176.83 176.69 3gii h SER 86 N 0.11 0.66 -0.49 6.23 0.02 -1.06 0.12 113.55 119.14 3gii h SER 86 Ca 0.29 -0.16 0.02 0.00 -0.84 0.00 0.00 61.79 61.11 3gii h SER 86 Cb 0.46 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 3gii h SER 86 CO -0.49 0.64 0.29 0.03 -1.14 0.00 0.00 176.83 176.16 3gii h ARG 87 N 0.63 0.57 -0.63 3.45 3.08 -0.91 -0.11 114.38 120.47 3gii h ARG 87 Ca 0.16 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3gii h ARG 87 Cb 0.18 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 3gii h ARG 87 CO -0.01 0.37 0.26 0.82 -1.07 0.00 0.00 179.97 180.34 3gii h ILE 88 N 0.58 1.23 -0.47 2.04 2.04 -1.02 -0.61 117.51 121.30 3gii h ILE 88 Ca 0.20 -0.72 -0.06 0.00 1.00 0.00 0.00 64.86 65.28 3gii h ILE 88 Cb 0.02 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 3gii h ILE 88 CO -0.09 0.28 0.04 0.24 0.00 0.00 0.00 178.15 178.62 3gii h MET 89 N 0.88 0.76 -0.52 2.37 2.86 -0.51 -0.04 114.93 120.72 3gii h MET 89 Ca 0.21 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 3gii h MET 89 Cb 0.20 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 3gii h MET 89 CO -0.02 0.74 0.18 -0.91 1.06 0.00 0.00 176.91 177.96 3gii h ASN 90 N 0.72 0.75 -0.41 1.22 2.35 -0.74 -2.18 115.58 117.30 3gii h ASN 90 Ca 0.15 -0.20 0.08 0.00 -0.55 0.00 0.00 56.30 55.78 3gii h ASN 90 Cb 0.39 -0.20 -0.08 0.00 0.05 0.00 0.00 38.32 38.48 3gii h ASN 90 CO 0.01 0.75 -0.08 0.25 -1.65 0.00 0.00 177.43 176.71 3gii h LEU 91 N 0.72 -0.35 -1.18 1.61 6.46 -0.26 -2.75 115.31 119.55 3gii h LEU 91 Ca 0.17 0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 58.03 3gii h LEU 91 Cb 0.26 0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.40 3gii h LEU 91 CO -0.01 -0.12 0.33 -0.07 -0.62 0.00 0.00 178.44 177.95 3gii h LEU 92 N 0.02 0.81 -1.41 2.25 3.38 -0.60 -2.59 115.31 117.17 3gii h LEU 92 Ca 0.20 -0.07 0.19 0.00 0.09 0.00 0.00 57.88 58.29 3gii h LEU 92 Cb 0.30 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 3gii h LEU 92 CO -0.41 0.67 0.60 0.03 0.09 0.00 0.00 178.44 179.41 3gii h ARG 93 N 0.90 0.49 0.00 1.13 3.08 -1.09 -0.77 114.38 118.11 3gii h ARG 93 Ca 0.23 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3gii h ARG 93 Cb 0.06 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3gii h ARG 93 CO -0.03 0.32 0.00 0.39 -1.07 0.00 0.00 179.97 179.58 3gii n GLU 94 N -4.55 0.13 -0.05 0.04 1.02 -0.97 -2.26 120.64 113.99 3gii n GLU 94 Ca 0.20 0.40 -0.06 0.00 -0.02 0.00 0.00 57.16 57.68 3gii n GLU 94 Cb 0.64 -1.76 -0.14 0.00 -0.02 0.00 0.00 31.44 30.16 3gii n GLU 94 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3gii n TYR 95 N -2.01 0.45 -3.64 -0.32 4.01 -0.32 -4.94 117.16 110.39 3gii n TYR 95 Ca 0.02 0.16 -0.08 0.00 -0.16 0.00 0.00 57.90 57.84 3gii n TYR 95 Cb 0.18 -1.02 -0.07 0.00 -0.31 0.00 0.00 39.34 38.13 3gii n TYR 95 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3gii s SER 96 N -5.61 -0.85 0.11 7.72 0.15 -0.96 -4.94 113.70 109.32 3gii s SER 96 Ca -0.07 1.41 0.25 0.00 0.70 0.00 0.00 55.95 58.24 3gii s SER 96 Cb 0.08 1.37 0.97 0.00 -1.71 0.00 0.00 66.02 66.73 3gii s SER 96 CO 0.83 -0.23 1.79 1.21 1.20 0.00 0.00 173.24 178.05 3gii n GLU 97 N 3.94 0.12 -3.05 5.44 4.07 -1.16 -4.25 120.64 125.75 3gii n GLU 97 Ca -0.19 0.16 -0.44 0.00 -0.06 0.00 0.00 57.16 56.63 3gii n GLU 97 Cb 0.58 -1.66 -0.01 0.00 -0.06 0.00 0.00 31.44 30.29 3gii n GLU 97 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 3gii s LYS 98 N -3.08 3.88 -0.06 5.31 2.20 -1.26 -4.98 119.74 121.75 3gii s LYS 98 Ca 0.11 -2.39 0.03 0.00 -0.36 0.00 0.00 55.97 53.35 3gii s LYS 98 Cb 0.14 -4.86 0.01 0.00 -1.51 0.00 0.00 37.83 31.62 3gii s LYS 98 CO 0.51 -1.63 -0.13 -1.50 -0.36 0.00 0.00 175.35 172.24 3gii s ILE 99 N 1.33 1.16 -0.39 5.43 2.07 -1.26 -2.31 121.20 127.22 3gii s ILE 99 Ca 0.34 -0.51 -0.05 0.00 -1.41 0.00 0.00 60.65 59.02 3gii s ILE 99 Cb -0.05 -1.05 0.08 0.00 0.13 0.00 0.00 42.46 41.57 3gii s ILE 99 CO -0.06 0.36 0.19 -0.70 -1.91 0.00 0.00 174.94 172.82 3gii s GLU 100 N 0.55 2.35 -0.14 3.50 2.12 -0.18 -4.30 118.70 122.60 3gii s GLU 100 Ca -0.13 -1.55 -0.29 0.00 0.36 0.00 0.00 54.97 53.36 3gii s GLU 100 Cb -0.15 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.63 3gii s GLU 100 CO 0.03 -0.93 1.32 0.42 -0.54 0.00 0.00 175.26 175.56 3gii s ILE 101 N 1.29 4.18 -0.13 -3.70 1.01 -1.26 -0.49 121.20 122.09 3gii s ILE 101 Ca 0.03 1.43 0.15 0.00 0.00 0.00 0.00 60.65 62.26 3gii s ILE 101 Cb -0.22 -3.92 -0.21 0.00 0.01 0.00 0.00 42.46 38.11 3gii s ILE 101 CO -0.01 -0.12 0.11 0.00 0.00 0.00 0.00 174.94 174.93 3gii n ALA 102 N 6.61 1.79 -3.14 9.38 0.00 -0.75 -4.51 120.51 129.90 3gii n ALA 102 Ca 0.14 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.64 3gii n ALA 102 Cb 0.45 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.72 3gii n ALA 102 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3gii n SER 103 N -2.50 -0.38 0.29 0.00 3.41 -1.11 -4.97 113.62 108.36 3gii n SER 103 Ca -0.22 -1.25 0.17 0.00 -0.26 0.00 0.00 58.87 57.31 3gii n SER 103 Cb 0.92 0.63 0.89 0.00 -0.26 0.00 0.00 64.21 66.39 3gii n SER 103 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3gii h ILE 104 N 1.17 0.25 0.00 -1.33 2.10 -2.01 -3.25 117.51 114.43 3gii h ILE 104 Ca -0.06 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.56 3gii h ILE 104 Cb 0.21 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.19 3gii h ILE 104 CO 0.07 0.04 -0.20 -0.90 -1.08 0.00 0.00 178.15 176.08 3gii n ASP 105 N -3.35 0.96 -3.73 2.19 5.75 -1.26 -4.74 116.55 112.37 3gii n ASP 105 Ca -0.02 -2.17 -0.11 0.00 -0.01 0.00 0.00 54.79 52.49 3gii n ASP 105 Cb 0.19 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.00 3gii n ASP 105 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 3gii s GLU 106 N -1.00 0.91 -0.17 0.11 -1.05 -1.23 -0.36 118.70 115.92 3gii s GLU 106 Ca 0.10 -0.66 -0.28 0.00 -0.15 0.00 0.00 54.97 53.97 3gii s GLU 106 Cb 0.08 0.39 0.09 0.00 -0.44 0.00 0.00 34.13 34.25 3gii s GLU 106 CO 0.01 -0.31 0.79 0.00 0.95 0.00 0.00 175.26 176.70 3gii s ALA 107 N -3.24 -1.83 -0.13 -0.84 0.00 -0.90 -1.80 121.76 113.03 3gii s ALA 107 Ca -0.00 1.66 -0.02 0.00 0.00 0.00 0.00 51.96 53.59 3gii s ALA 107 Cb 0.01 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.43 3gii s ALA 107 CO -0.08 -0.33 -0.04 0.71 0.00 0.00 0.00 175.76 176.02 3gii s TYR 108 N -0.49 3.03 -0.14 0.00 2.02 0.36 -1.91 117.35 120.22 3gii s TYR 108 Ca -0.04 -0.15 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 3gii s TYR 108 Cb -0.02 -1.88 -0.01 0.00 -0.40 0.00 0.00 41.96 39.65 3gii s TYR 108 CO 0.04 0.12 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.48 3gii s LEU 109 N -0.09 2.56 -0.40 -1.29 1.02 0.15 -1.01 118.68 119.61 3gii s LEU 109 Ca 0.02 -0.41 -0.28 0.00 0.02 0.00 0.00 54.13 53.48 3gii s LEU 109 Cb -0.13 -1.57 0.02 0.00 0.02 0.00 0.00 46.19 44.53 3gii s LEU 109 CO 0.03 0.13 1.07 -0.62 0.02 0.00 0.00 176.35 176.98 3gii s ASP 110 N 0.57 6.74 -0.11 2.29 -1.08 -0.98 0.23 116.67 124.33 3gii s ASP 110 Ca -0.09 0.68 0.14 0.00 -0.52 0.00 0.00 52.55 52.76 3gii s ASP 110 Cb -0.16 -2.53 0.44 0.00 -1.46 0.00 0.00 42.92 39.21 3gii s ASP 110 CO 0.04 -1.05 1.35 2.30 0.52 0.00 0.00 175.17 178.33 3gii n ILE 111 N 6.34 1.80 -0.32 4.11 -5.35 -0.66 -4.74 119.36 120.54 3gii n ILE 111 Ca 0.11 -1.55 0.23 0.00 -0.27 0.00 0.00 62.75 61.27 3gii n ILE 111 Cb 0.48 0.03 0.52 0.00 -1.74 0.00 0.00 39.64 38.93 3gii n ILE 111 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 3gii h SER 112 N 1.84 0.42 0.09 7.28 0.02 -1.88 -0.45 113.55 120.89 3gii h SER 112 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3gii h SER 112 Cb 1.17 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.72 3gii h SER 112 CO 0.14 0.08 -0.42 0.47 -1.14 0.00 0.00 176.83 175.96 3gii n ASP 113 N -4.61 1.56 -0.04 3.07 10.43 -1.26 -4.20 116.55 121.49 3gii n ASP 113 Ca 0.25 -1.22 0.10 0.00 2.57 0.00 0.00 54.79 56.50 3gii n ASP 113 Cb 0.89 0.37 -0.06 0.00 1.84 0.00 0.00 41.12 44.16 3gii n ASP 113 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3gii n LYS 114 N -0.37 0.11 -3.85 -1.24 4.76 -0.20 -4.97 118.16 112.40 3gii n LYS 114 Ca 0.10 -0.09 -0.12 0.00 -2.87 0.00 0.00 58.31 55.34 3gii n LYS 114 Cb 0.41 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.00 3gii n LYS 114 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3gii s VAL 115 N -2.95 0.06 -0.48 -0.18 -7.23 -1.09 -5.04 120.40 103.49 3gii s VAL 115 Ca 0.09 -0.46 0.23 0.00 -1.81 0.00 0.00 61.98 60.03 3gii s VAL 115 Cb 0.16 -0.38 0.03 0.00 0.56 0.00 0.00 36.38 36.75 3gii s VAL 115 CO 0.82 -0.25 1.20 0.03 -0.31 0.00 0.00 175.10 176.59 3gii h ARG 116 N 4.78 0.00 -2.70 4.82 3.08 -1.91 -3.46 114.38 118.99 3gii h ARG 116 Ca -0.29 0.00 0.10 0.00 0.07 0.00 0.00 59.98 59.86 3gii h ARG 116 Cb 1.19 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 3gii h ARG 116 CO 0.40 0.00 0.43 0.16 -1.07 0.00 0.00 179.97 179.89 3gii s ASP 117 N -4.71 -0.05 0.55 7.04 3.84 -1.26 -5.04 116.67 117.04 3gii s ASP 117 Ca 0.03 -0.78 0.24 0.00 -0.00 0.00 0.00 52.55 52.04 3gii s ASP 117 Cb 0.12 0.64 1.54 0.00 -1.38 0.00 0.00 42.92 43.83 3gii s ASP 117 CO 0.75 -1.25 2.17 1.88 -0.00 0.00 0.00 175.17 178.73 3gii h TYR 118 N 2.00 0.00 0.03 2.11 0.05 -1.99 -1.31 116.97 117.86 3gii h TYR 118 Ca -0.28 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.25 3gii h TYR 118 Cb 1.23 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.99 3gii h TYR 118 CO 1.11 0.04 -1.04 0.00 -1.05 0.00 0.00 178.16 177.22 3gii h ARG 119 N 0.00 0.51 -0.20 4.88 3.08 -1.99 -1.85 114.38 118.81 3gii h ARG 119 Ca -0.00 -0.59 -0.09 0.00 0.07 0.00 0.00 59.98 59.36 3gii h ARG 119 Cb 0.09 0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3gii h ARG 119 CO 0.01 1.22 -0.29 0.93 -1.07 0.00 0.00 179.97 180.77 3gii h GLU 120 N 0.27 0.38 -0.11 0.04 5.08 -1.91 -2.22 114.58 116.12 3gii h GLU 120 Ca -0.11 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 3gii h GLU 120 Cb 1.69 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.90 3gii h GLU 120 CO 0.19 0.64 -0.03 0.00 -1.00 0.00 0.00 179.01 178.80 3gii h ALA 121 N 1.36 0.06 -0.34 3.43 0.00 -1.03 0.05 119.26 122.80 3gii h ALA 121 Ca 0.05 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3gii h ALA 121 Cb 0.68 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 3gii h ALA 121 CO 0.05 -0.49 -0.24 -0.92 0.00 0.00 0.00 179.25 177.65 3gii h TYR 122 N -0.01 -0.62 -0.96 0.00 3.20 -1.21 0.26 116.97 117.62 3gii h TYR 122 Ca 0.05 0.04 0.08 0.00 3.14 0.00 0.00 58.73 62.05 3gii h TYR 122 Cb 0.09 0.33 -0.07 0.00 1.54 0.00 0.00 36.73 38.62 3gii h TYR 122 CO -0.16 -0.31 0.61 -0.91 -1.64 0.00 0.00 178.16 175.74 3gii h ASN 123 N -0.19 0.93 -0.47 -2.11 2.35 -1.02 -0.03 115.58 115.04 3gii h ASN 123 Ca 0.17 0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.84 3gii h ASN 123 Cb 0.46 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 3gii h ASN 123 CO -0.46 0.56 -0.11 0.25 -1.65 0.00 0.00 177.43 176.02 3gii h LEU 124 N 1.05 0.94 -0.63 1.61 5.85 0.10 -2.18 115.31 122.05 3gii h LEU 124 Ca 0.44 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.93 3gii h LEU 124 Cb 0.29 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 3gii h LEU 124 CO -0.21 1.06 0.29 1.23 -0.34 0.00 0.00 178.44 180.47 3gii h GLY 125 N 0.96 0.90 1.37 3.75 0.00 0.46 -0.53 103.07 109.97 3gii h GLY 125 Ca 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 3gii h GLY 125 CO 0.05 0.06 0.23 1.41 0.00 0.00 0.00 176.54 178.28 3gii h LEU 126 N 0.52 0.74 -0.06 3.11 3.38 -0.63 -1.36 115.31 121.01 3gii h LEU 126 Ca 0.30 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 3gii h LEU 126 Cb 0.30 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3gii h LEU 126 CO -0.25 0.66 -0.10 -0.08 0.09 0.00 0.00 178.44 178.77 3gii h GLU 127 N 0.80 0.17 -0.46 1.13 4.81 -0.86 -1.41 114.58 118.75 3gii h GLU 127 Ca 0.19 -0.10 0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3gii h GLU 127 Cb 0.15 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.48 3gii h GLU 127 CO -0.02 0.67 0.09 0.82 -0.73 0.00 0.00 179.01 179.85 3gii h ILE 128 N -0.32 0.75 -0.64 2.32 2.04 -1.02 0.89 117.51 121.54 3gii h ILE 128 Ca 0.00 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3gii h ILE 128 Cb 0.66 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 3gii h ILE 128 CO 0.02 0.04 0.30 0.11 0.00 0.00 0.00 178.15 178.62 3gii h LYS 129 N 0.23 0.92 -0.26 2.37 1.57 -1.23 -1.96 116.57 118.22 3gii h LYS 129 Ca 0.23 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3gii h LYS 129 Cb 0.29 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3gii h LYS 129 CO -0.30 0.75 0.06 -0.91 -0.57 0.00 0.00 179.45 178.48 3gii h ASN 130 N 0.88 0.40 -0.62 0.86 -0.26 -0.65 -2.64 115.58 113.55 3gii h ASN 130 Ca 0.22 -0.23 -0.08 0.00 -0.56 0.00 0.00 56.30 55.65 3gii h ASN 130 Cb 0.13 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.26 3gii h ASN 130 CO -0.03 0.53 0.09 0.11 -1.06 0.00 0.00 177.43 177.07 3gii h LYS 131 N 0.25 1.03 -0.92 0.81 1.57 -0.66 -0.59 116.57 118.07 3gii h LYS 131 Ca 0.08 -0.28 0.03 0.00 -1.87 0.00 0.00 60.65 58.61 3gii h LYS 131 Cb 0.28 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 3gii h LYS 131 CO 0.00 0.97 0.60 0.82 -0.57 0.00 0.00 179.45 181.27 3gii h ILE 132 N 0.94 1.16 -0.39 1.86 2.04 -1.39 0.92 117.51 122.65 3gii h ILE 132 Ca 0.19 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 3gii h ILE 132 Cb 0.44 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 3gii h ILE 132 CO 0.01 0.21 -0.30 0.25 0.00 0.00 0.00 178.15 178.33 3gii h LEU 133 N 1.16 0.88 -0.47 1.44 5.85 -1.02 0.11 115.31 123.27 3gii h LEU 133 Ca 0.36 -0.36 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 3gii h LEU 133 Cb 0.00 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 3gii h LEU 133 CO -0.11 1.11 -0.51 -0.33 -0.34 0.00 0.00 178.44 178.26 3gii h GLU 134 N 0.71 0.69 0.06 1.25 5.08 -0.42 -1.15 114.58 120.80 3gii h GLU 134 Ca 0.08 -0.41 -0.35 0.00 -1.00 0.00 0.00 59.36 57.68 3gii h GLU 134 Cb 0.85 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 3gii h GLU 134 CO 0.07 1.03 -2.00 1.63 -1.00 0.00 0.00 179.01 178.74 3gii n LYS 135 N -3.99 0.70 0.00 2.33 4.76 0.25 -4.57 118.16 117.64 3gii n LYS 135 Ca -0.03 0.24 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 3gii n LYS 135 Cb 0.59 -1.70 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 3gii n LYS 135 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3gii n GLU 136 N -3.26 -0.75 -1.44 1.97 -0.58 -0.00 -5.02 120.64 111.56 3gii n GLU 136 Ca -0.29 -0.47 -0.15 0.00 -0.42 0.00 0.00 57.16 55.83 3gii n GLU 136 Cb 1.05 -0.94 -0.07 0.00 -0.57 0.00 0.00 31.44 30.92 3gii n GLU 136 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3gii n LYS 137 N -0.02 -1.20 -4.74 3.49 4.76 -0.44 -4.96 118.16 115.06 3gii n LYS 137 Ca 0.00 1.03 -0.33 0.00 -2.87 0.00 0.00 58.31 56.14 3gii n LYS 137 Cb 0.04 -5.23 -0.14 0.00 -1.84 0.00 0.00 35.03 27.86 3gii n LYS 137 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3gii s ILE 138 N -2.49 3.00 0.45 -0.18 1.01 -1.25 -4.94 121.20 116.81 3gii s ILE 138 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 3gii s ILE 138 Cb 0.00 -2.26 -0.07 0.00 0.01 0.00 0.00 42.46 40.14 3gii s ILE 138 CO 0.00 0.52 0.85 0.42 0.00 0.00 0.00 174.94 176.73 3gii s THR 139 N 0.43 4.71 -0.01 2.92 -4.23 -1.26 -3.81 115.64 114.38 3gii s THR 139 Ca -0.10 0.81 -0.15 0.00 -1.18 0.00 0.00 61.69 61.06 3gii s THR 139 Cb -0.16 -3.74 0.02 0.00 1.34 0.00 0.00 72.50 69.97 3gii s THR 139 CO 0.05 -0.60 0.32 0.68 -0.54 0.00 0.00 174.62 174.53 3gii s VAL 140 N -2.49 0.06 -0.14 2.29 -7.23 -1.26 -2.23 120.40 109.39 3gii s VAL 140 Ca 0.54 -0.48 -0.08 0.00 -1.81 0.00 0.00 61.98 60.14 3gii s VAL 140 Cb -0.10 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 3gii s VAL 140 CO 0.32 -0.26 0.15 -0.89 -0.31 0.00 0.00 175.10 174.11 3gii s THR 141 N -1.45 5.46 -0.10 5.32 2.01 -0.60 -3.91 115.64 122.36 3gii s THR 141 Ca -0.13 0.23 0.02 0.00 0.31 0.00 0.00 61.69 62.12 3gii s THR 141 Cb -0.05 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 3gii s THR 141 CO 0.04 0.55 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.69 3gii s VAL 142 N -0.54 3.00 -0.15 3.82 1.01 -0.42 -1.65 120.40 125.45 3gii s VAL 142 Ca 0.13 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.40 3gii s VAL 142 Cb -0.12 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.07 3gii s VAL 142 CO 0.02 0.55 -0.12 -0.83 0.00 0.00 0.00 175.10 174.73 3gii s GLY 143 N -0.08 1.08 -0.16 4.51 0.00 0.11 -2.21 107.32 110.58 3gii s GLY 143 Ca -0.02 -0.89 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 3gii s GLY 143 CO 0.04 0.64 -0.06 -0.42 0.00 0.00 0.00 173.10 173.30 3gii s ILE 144 N 1.52 3.58 0.00 0.90 1.01 -0.70 -0.12 121.20 127.39 3gii s ILE 144 Ca 0.04 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3gii s ILE 144 Cb -0.14 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.77 3gii s ILE 144 CO -0.10 0.48 0.00 -0.24 0.00 0.00 0.00 174.94 175.09 3gii n SER 145 N 3.79 0.00 0.23 3.58 2.88 -0.67 -2.06 113.62 121.37 3gii n SER 145 Ca -0.18 -0.68 0.13 0.00 -1.33 0.00 0.00 58.87 56.81 3gii n SER 145 Cb 0.52 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 64.31 3gii n SER 145 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 3gii h LYS 146 N 0.00 0.00 -3.37 -1.46 2.10 -1.78 0.15 116.57 112.21 3gii h LYS 146 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.59 3gii h LYS 146 Cb 0.00 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 31.20 3gii h LYS 146 CO 0.00 0.05 -0.09 0.54 -2.00 0.00 0.00 179.45 177.95 3gii s ASN 147 N -6.07 -0.23 0.21 7.07 2.20 -1.26 -4.23 114.94 112.63 3gii s ASN 147 Ca 0.05 -0.30 -0.22 0.00 -0.94 0.00 0.00 52.86 51.45 3gii s ASN 147 Cb 0.07 0.46 0.14 0.00 -2.00 0.00 0.00 41.25 39.92 3gii s ASN 147 CO 0.63 -0.83 1.55 0.11 -2.94 0.00 0.00 177.10 175.63 3gii h LYS 148 N 2.45 -0.01 -0.73 3.55 1.57 -1.91 -0.08 116.57 121.41 3gii h LYS 148 Ca -0.34 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.39 3gii h LYS 148 Cb 1.25 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.53 3gii h LYS 148 CO 0.47 -0.01 0.23 0.28 -0.57 0.00 0.00 179.45 179.86 3gii h VAL 149 N -0.01 1.26 -0.00 0.50 2.07 -1.95 -0.14 116.25 117.99 3gii h VAL 149 Ca 0.29 -0.89 -0.17 0.00 0.82 0.00 0.00 66.70 66.75 3gii h VAL 149 Cb 0.54 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3gii h VAL 149 CO -0.96 0.35 -0.79 -0.26 0.02 0.00 0.00 177.57 175.92 3gii h PHE 150 N 1.07 0.04 -0.94 1.57 0.04 -1.81 -1.88 116.94 115.03 3gii h PHE 150 Ca 0.23 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.98 3gii h PHE 150 Cb 0.29 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.39 3gii h PHE 150 CO 0.02 0.80 0.57 0.00 -0.60 0.00 0.00 178.31 179.10 3gii h ALA 151 N 1.19 1.20 -0.23 2.45 0.00 -0.26 -0.60 119.26 123.01 3gii h ALA 151 Ca -0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3gii h ALA 151 Cb 1.39 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3gii h ALA 151 CO 0.11 0.65 -0.06 -0.22 0.00 0.00 0.00 179.25 179.73 3gii h LYS 152 N 1.30 0.45 -0.33 0.00 3.64 -0.89 -2.46 116.57 118.28 3gii h LYS 152 Ca 0.34 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3gii h LYS 152 Cb -0.06 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3gii h LYS 152 CO -0.06 0.69 0.21 0.82 -2.27 0.00 0.00 179.45 178.84 3gii h ILE 153 N 0.18 1.09 -0.78 2.00 2.04 -1.15 -1.65 117.51 119.24 3gii h ILE 153 Ca 0.06 -0.19 0.18 0.00 1.00 0.00 0.00 64.86 65.91 3gii h ILE 153 Cb 0.53 0.63 -0.12 0.00 -0.74 0.00 0.00 36.82 37.12 3gii h ILE 153 CO 0.02 0.09 0.16 0.00 0.00 0.00 0.00 178.15 178.42 3gii h ALA 154 N 1.11 1.01 -0.55 1.87 0.00 -1.11 -1.37 119.26 120.21 3gii h ALA 154 Ca 0.12 0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.14 3gii h ALA 154 Cb -0.03 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3gii h ALA 154 CO -0.02 -0.39 -0.02 0.00 0.00 0.00 0.00 179.25 178.81 3gii h ALA 155 N 1.68 0.75 -0.88 0.00 0.00 -0.88 -2.94 119.26 117.00 3gii h ALA 155 Ca 0.46 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3gii h ALA 155 Cb 0.83 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3gii h ALA 155 CO -0.59 0.60 0.52 -0.44 0.00 0.00 0.00 179.25 179.33 3gii h ASP 156 N 0.87 1.07 0.72 0.00 3.32 -0.49 -1.52 116.42 120.40 3gii h ASP 156 Ca 0.15 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 3gii h ASP 156 Cb 0.57 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 3gii h ASP 156 CO 0.03 0.84 -0.03 0.24 -1.72 0.00 0.00 179.24 178.60 3gii h MET 157 N 1.22 0.00 0.00 3.56 2.86 -1.11 -3.19 114.93 118.27 3gii h MET 157 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 3gii h MET 157 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 3gii h MET 157 CO -0.06 0.03 -1.07 0.00 1.06 0.00 0.00 176.91 176.88 3gii n ALA 158 N -2.12 4.21 -1.78 6.32 0.00 -0.63 -5.01 120.51 121.50 3gii n ALA 158 Ca -0.00 -0.53 -0.36 0.00 0.00 0.00 0.00 53.44 52.54 3gii n ALA 158 Cb 0.26 -0.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 3gii n ALA 158 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3gii s LYS 159 N -2.90 4.06 0.60 0.00 -2.85 -0.86 -3.69 119.74 114.10 3gii s LYS 159 Ca 0.05 1.54 -0.01 0.00 -1.00 0.00 0.00 55.97 56.55 3gii s LYS 159 Cb 0.14 -2.48 0.04 0.00 -2.06 0.00 0.00 37.83 33.47 3gii s LYS 159 CO 0.79 -0.24 0.85 -1.25 0.10 0.00 0.00 175.35 175.60 3gii s PRO 160 N -2.60 2.45 -1.62 1.78 0.04 -1.26 -4.96 135.00 128.83 3gii s PRO 160 Ca 0.60 -0.61 -0.13 0.00 0.04 0.00 0.00 61.00 60.90 3gii s PRO 160 Cb -0.23 -2.39 0.13 0.00 0.04 0.00 0.00 34.50 32.05 3gii s PRO 160 CO 0.28 -0.87 0.32 -1.71 0.04 0.00 0.00 177.00 175.06 3gii n ASN 161 N -2.52 -0.59 -4.24 6.66 2.85 -1.26 -4.92 115.26 111.25 3gii n ASN 161 Ca 0.08 -1.17 -0.28 0.00 -0.11 0.00 0.00 54.58 53.10 3gii n ASN 161 Cb 0.60 -1.48 -0.06 0.00 1.24 0.00 0.00 39.78 40.08 3gii n ASN 161 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3gii n GLY 162 N -1.64 3.58 3.38 8.20 0.00 -1.24 -4.94 105.19 112.53 3gii n GLY 162 Ca -0.07 -2.31 -0.10 0.00 0.00 0.00 0.00 46.02 43.55 3gii n GLY 162 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3gii s ILE 163 N -2.69 -0.02 -0.02 -0.61 2.07 -1.26 -1.30 121.20 117.38 3gii s ILE 163 Ca 0.03 0.06 -0.01 0.00 -1.41 0.00 0.00 60.65 59.33 3gii s ILE 163 Cb 0.00 -0.72 0.01 0.00 0.13 0.00 0.00 42.46 41.89 3gii s ILE 163 CO 0.02 0.02 0.03 -0.75 -1.91 0.00 0.00 174.94 172.36 3gii s LYS 164 N 1.29 0.00 -0.42 3.50 2.20 -0.94 -4.99 119.74 120.39 3gii s LYS 164 Ca -0.08 0.11 0.03 0.00 -0.36 0.00 0.00 55.97 55.67 3gii s LYS 164 Cb -0.07 -0.10 0.11 0.00 -1.51 0.00 0.00 37.83 36.27 3gii s LYS 164 CO -0.13 -0.08 0.16 0.08 -0.36 0.00 0.00 175.35 175.02 3gii s VAL 165 N 0.48 2.58 -0.47 4.02 1.01 -1.26 -1.72 120.40 125.05 3gii s VAL 165 Ca -0.04 -2.65 -0.25 0.00 0.00 0.00 0.00 61.98 59.04 3gii s VAL 165 Cb -0.06 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.52 3gii s VAL 165 CO -0.01 -0.69 0.93 -0.63 0.00 0.00 0.00 175.10 174.70 3gii s ILE 166 N 0.51 4.46 0.73 2.22 1.01 -0.87 -5.02 121.20 124.24 3gii s ILE 166 Ca 0.13 0.74 -0.05 0.00 0.00 0.00 0.00 60.65 61.46 3gii s ILE 166 Cb -0.22 -4.44 0.10 0.00 0.01 0.00 0.00 42.46 37.91 3gii s ILE 166 CO -0.05 -0.85 1.03 1.51 0.00 0.00 0.00 174.94 176.58 3gii s ASP 167 N 2.29 4.44 0.59 3.58 3.84 -1.26 -4.13 116.67 126.01 3gii s ASP 167 Ca 0.37 0.09 0.28 0.00 -0.00 0.00 0.00 52.55 53.30 3gii s ASP 167 Cb -0.10 -0.58 1.59 0.00 -1.38 0.00 0.00 42.92 42.45 3gii s ASP 167 CO 0.26 -1.81 2.04 -2.24 -0.00 0.00 0.00 175.17 173.42 3gii h ASP 168 N -0.66 0.00 0.80 2.11 3.04 -1.96 -0.77 116.42 118.98 3gii h ASP 168 Ca -0.41 0.00 -0.15 0.00 -3.24 0.00 0.00 57.03 53.23 3gii h ASP 168 Cb 1.28 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.55 3gii h ASP 168 CO 0.49 0.00 -1.29 -0.33 -2.04 0.00 0.00 179.24 176.07 3gii h GLU 169 N 0.00 0.00 0.00 4.15 5.08 -2.03 -3.34 114.58 118.44 3gii h GLU 169 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3gii h GLU 169 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3gii h GLU 169 CO -0.00 0.29 -0.39 0.93 -1.00 0.00 0.00 179.01 178.83 3gii h GLU 170 N 0.00 0.00 -0.48 2.33 5.08 -1.54 -3.35 114.58 116.62 3gii h GLU 170 Ca -0.13 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3gii h GLU 170 Cb 1.52 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.74 3gii h GLU 170 CO 0.04 0.00 0.30 0.28 -1.00 0.00 0.00 179.01 178.64 3gii h VAL 171 N 0.00 1.09 -0.31 3.13 2.07 -1.41 -1.67 116.25 119.15 3gii h VAL 171 Ca 0.00 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.38 3gii h VAL 171 Cb 0.88 0.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 3gii h VAL 171 CO 0.00 0.11 -0.14 0.11 0.02 0.00 0.00 177.57 177.67 3gii h LYS 172 N 0.61 -0.08 -0.77 1.57 1.79 -1.77 -1.09 116.57 116.82 3gii h LYS 172 Ca 0.18 0.01 0.11 0.00 -2.18 0.00 0.00 60.65 58.76 3gii h LYS 172 Cb -0.03 0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 30.56 3gii h LYS 172 CO -0.06 -0.05 0.40 -0.09 -1.08 0.00 0.00 179.45 178.56 3gii h ARG 173 N -0.08 0.63 0.09 3.15 2.43 -1.66 -2.84 114.38 116.10 3gii h ARG 173 Ca 0.16 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3gii h ARG 173 Cb 0.33 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3gii h ARG 173 CO -0.37 0.42 -0.06 1.25 -1.51 0.00 0.00 179.97 179.70 3gii h LEU 174 N 0.65 -0.15 -0.96 3.80 6.46 -0.30 -2.67 115.31 122.14 3gii h LEU 174 Ca 0.39 0.01 0.26 0.00 -0.12 0.00 0.00 57.88 58.42 3gii h LEU 174 Cb 0.43 0.05 -0.13 0.00 -0.73 0.00 0.00 40.66 40.27 3gii h LEU 174 CO -0.29 -0.10 0.50 0.40 -0.62 0.00 0.00 178.44 178.33 3gii h ILE 175 N -0.15 0.43 -0.56 4.05 2.04 -1.02 -0.81 117.51 121.49 3gii h ILE 175 Ca -0.01 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 3gii h ILE 175 Cb 0.13 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.16 3gii h ILE 175 CO 0.01 0.08 -0.08 0.03 0.00 0.00 0.00 178.15 178.18 3gii h ARG 176 N 0.42 1.04 -0.35 2.37 3.08 -1.43 -3.06 114.38 116.46 3gii h ARG 176 Ca 0.64 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3gii h ARG 176 Cb 1.30 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3gii h ARG 176 CO -0.55 1.06 0.00 0.39 -1.07 0.00 0.00 179.97 179.81 3gii n GLU 177 N -4.15 2.62 -2.68 0.04 -0.58 -0.56 -4.68 120.64 110.64 3gii n GLU 177 Ca 0.02 -2.02 -0.42 0.00 -0.42 0.00 0.00 57.16 54.32 3gii n GLU 177 Cb 0.39 -1.29 -0.03 0.00 -0.57 0.00 0.00 31.44 29.93 3gii n GLU 177 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3gii s LEU 178 N -1.00 4.40 0.14 -4.62 2.96 -0.42 -5.01 118.68 115.12 3gii s LEU 178 Ca 0.25 1.73 -0.31 0.00 -0.22 0.00 0.00 54.13 55.58 3gii s LEU 178 Cb 0.13 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.17 3gii s LEU 178 CO 0.17 -0.24 1.30 -1.81 -1.32 0.00 0.00 176.35 174.45 3gii s ASP 179 N 0.80 6.93 0.37 3.68 -0.00 -1.26 -2.03 116.67 125.16 3gii s ASP 179 Ca 0.52 2.28 0.11 0.00 -0.00 0.00 0.00 52.55 55.45 3gii s ASP 179 Cb -0.22 -2.60 0.88 0.00 -0.00 0.00 0.00 42.92 40.98 3gii s ASP 179 CO 0.29 -0.54 1.88 -0.29 -0.00 0.00 0.00 175.17 176.51 3gii h ILE 180 N 4.07 0.83 0.00 0.77 6.09 -0.85 0.40 117.51 128.82 3gii h ILE 180 Ca -0.43 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 62.85 3gii h ILE 180 Cb 1.21 0.15 0.00 0.00 0.47 0.00 0.00 36.82 38.66 3gii h ILE 180 CO 0.81 0.11 0.00 0.00 -3.07 0.00 0.00 178.15 176.00 3gii h ALA 181 N 1.61 1.00 -0.01 0.18 0.00 -1.85 -2.50 119.26 117.69 3gii h ALA 181 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3gii h ALA 181 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3gii h ALA 181 CO -0.18 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.82 3gii n ASP 182 N -2.81 0.82 -4.69 0.00 8.00 0.14 -4.80 116.55 113.20 3gii n ASP 182 Ca 0.01 -1.28 -0.42 0.00 0.71 0.00 0.00 54.79 53.81 3gii n ASP 182 Cb 0.25 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 3gii n ASP 182 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3gii s VAL 183 N -2.00 4.50 0.27 2.53 1.01 -0.94 -4.94 120.40 120.83 3gii s VAL 183 Ca 0.42 1.80 -0.30 0.00 0.00 0.00 0.00 61.98 63.90 3gii s VAL 183 Cb 0.21 -4.15 -0.11 0.00 0.00 0.00 0.00 36.38 32.33 3gii s VAL 183 CO 0.35 0.03 1.62 -2.16 0.00 0.00 0.00 175.10 174.94 3gii s PRO 184 N 1.92 4.12 0.00 2.72 0.04 -1.26 -1.25 135.00 141.29 3gii s PRO 184 Ca 0.53 2.58 0.00 0.00 0.04 0.00 0.00 61.00 64.15 3gii s PRO 184 Cb -0.22 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.28 3gii s PRO 184 CO 0.22 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 177.01 3gii n GLY 185 N 2.58 1.72 3.28 0.56 0.00 -1.26 -5.04 105.19 107.03 3gii n GLY 185 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 3gii n GLY 185 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gii s ILE 186 N -2.36 4.86 0.00 -0.61 -1.09 -0.38 -4.99 121.20 116.63 3gii s ILE 186 Ca 0.00 -1.57 0.00 0.00 -2.23 0.00 0.00 60.65 56.85 3gii s ILE 186 Cb 0.00 -4.13 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 3gii s ILE 186 CO 0.00 -0.82 0.00 0.61 -1.23 0.00 0.00 174.94 173.50 3gii n GLY 187 N 5.13 0.51 0.26 6.18 0.00 -1.26 -4.68 105.19 111.33 3gii n GLY 187 Ca -0.12 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 3gii n GLY 187 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3gii h ASN 188 N 0.00 0.88 0.43 1.61 2.35 -1.97 -1.25 115.58 117.64 3gii h ASN 188 Ca 0.00 -0.38 -0.02 0.00 -0.55 0.00 0.00 56.30 55.34 3gii h ASN 188 Cb 0.00 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.13 3gii h ASN 188 CO 0.00 1.14 -0.21 0.40 -1.65 0.00 0.00 177.43 177.12 3gii h ILE 189 N 0.70 0.00 -0.33 2.81 5.03 -1.99 -1.16 117.51 122.56 3gii h ILE 189 Ca 0.07 -0.10 0.04 0.00 -0.12 0.00 0.00 64.86 64.75 3gii h ILE 189 Cb 0.91 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 34.67 3gii h ILE 189 CO 0.08 0.00 0.10 0.74 -0.68 0.00 0.00 178.15 178.40 3gii h THR 190 N -0.67 0.89 -0.45 -0.27 2.02 -1.93 -0.37 112.91 112.13 3gii h THR 190 Ca -0.06 -0.08 0.13 0.00 0.77 0.00 0.00 66.41 67.17 3gii h THR 190 Cb 0.44 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3gii h THR 190 CO 0.10 0.04 0.36 0.00 0.37 0.00 0.00 175.52 176.39 3gii h ALA 191 N 1.22 2.32 0.16 6.16 0.00 -1.27 -1.53 119.26 126.31 3gii h ALA 191 Ca 0.15 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.71 3gii h ALA 191 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gii h ALA 191 CO -0.16 -0.59 -1.72 1.49 0.00 0.00 0.00 179.25 178.27 3gii h GLU 192 N 0.00 0.33 -0.90 0.00 4.22 0.19 -3.20 114.58 115.22 3gii h GLU 192 Ca 0.21 -0.56 0.06 0.00 0.08 0.00 0.00 59.36 59.16 3gii h GLU 192 Cb 0.94 0.21 -0.06 0.00 0.50 0.00 0.00 28.75 30.34 3gii h GLU 192 CO -0.00 1.22 0.58 0.87 -2.18 0.00 0.00 179.01 179.50 3gii h LYS 193 N 0.09 0.99 0.00 1.92 1.57 -0.48 -2.78 116.57 117.88 3gii h LYS 193 Ca -0.32 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.27 3gii h LYS 193 Cb 2.07 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 3gii h LYS 193 CO 0.16 0.66 -0.59 -0.07 -0.57 0.00 0.00 179.45 179.04 3gii h LEU 194 N 1.02 0.00 -1.49 2.94 3.38 -1.39 -2.51 115.31 117.27 3gii h LEU 194 Ca 0.38 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.31 3gii h LEU 194 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3gii h LEU 194 CO -0.14 0.59 -0.12 0.11 0.09 0.00 0.00 178.44 178.97 3gii h LYS 195 N 0.00 0.18 -2.10 1.13 1.79 -1.48 -2.76 116.57 113.33 3gii h LYS 195 Ca -0.01 -0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 3gii h LYS 195 Cb 1.06 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.66 3gii h LYS 195 CO 0.08 0.31 -0.06 1.17 -1.08 0.00 0.00 179.45 179.87 3gii n LYS 196 N -4.30 1.04 0.00 3.15 4.81 -0.94 -2.13 118.16 119.79 3gii n LYS 196 Ca -0.01 -0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.13 3gii n LYS 196 Cb 0.25 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 33.87 3gii n LYS 196 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3gii n LEU 197 N 2.03 0.00 0.00 3.14 4.77 -1.15 -5.04 117.00 120.75 3gii n LEU 197 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3gii n LEU 197 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3gii n LEU 197 CO 0.06 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 3gii n GLY 198 N 0.00 0.75 3.37 -0.72 0.00 -0.90 -5.00 105.19 102.69 3gii n GLY 198 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3gii n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gii s ILE 199 N -2.61 4.91 -0.19 -0.61 1.01 -1.05 -4.80 121.20 117.85 3gii s ILE 199 Ca 0.00 -1.22 -0.03 0.00 0.00 0.00 0.00 60.65 59.41 3gii s ILE 199 Cb 0.00 -4.50 -0.11 0.00 0.01 0.00 0.00 42.46 37.85 3gii s ILE 199 CO 0.00 -1.14 -0.20 0.59 0.00 0.00 0.00 174.94 174.19 3gii n ASN 200 N 6.06 2.15 -4.94 3.58 3.02 -1.26 -4.12 115.26 119.75 3gii n ASN 200 Ca -0.05 0.02 -0.24 0.00 -0.03 0.00 0.00 54.58 54.28 3gii n ASN 200 Cb 0.43 -0.40 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 3gii n ASN 200 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3gii s LYS 201 N -2.38 3.47 0.19 3.52 -0.14 -1.26 -0.20 119.74 122.93 3gii s LYS 201 Ca -0.27 -0.35 -0.12 0.00 -1.36 0.00 0.00 55.97 53.87 3gii s LYS 201 Cb 0.08 -2.66 0.15 0.00 -1.68 0.00 0.00 37.83 33.72 3gii s LYS 201 CO 0.41 0.14 1.80 1.25 -0.76 0.00 0.00 175.35 178.19 3gii h LEU 202 N 0.75 0.44 -2.47 3.17 7.12 -1.55 -2.91 115.31 119.87 3gii h LEU 202 Ca -0.50 0.02 0.02 0.00 0.13 0.00 0.00 57.88 57.56 3gii h LEU 202 Cb 1.22 -0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 41.28 3gii h LEU 202 CO 0.61 0.30 0.12 1.62 -0.13 0.00 0.00 178.44 180.96 3gii h VAL 203 N 0.57 0.29 0.00 1.05 3.04 -1.81 -2.43 116.25 116.97 3gii h VAL 203 Ca 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.93 3gii h VAL 203 Cb 0.11 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 3gii h VAL 203 CO -0.15 0.00 0.00 0.44 -1.01 0.00 0.00 177.57 176.85 3gii h ASP 204 N 0.00 0.00 -0.53 3.17 3.45 -1.86 -2.49 116.42 118.17 3gii h ASP 204 Ca 0.03 0.00 0.08 0.00 0.43 0.00 0.00 57.03 57.57 3gii h ASP 204 Cb 0.27 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.00 3gii h ASP 204 CO -0.00 0.00 0.36 0.71 -1.57 0.00 0.00 179.24 178.74 3gii h THR 205 N 0.00 0.92 0.00 0.35 1.35 -1.63 -2.58 112.91 111.32 3gii h THR 205 Ca 0.00 -0.13 -0.01 0.00 -0.55 0.00 0.00 66.41 65.72 3gii h THR 205 Cb 0.36 0.51 -0.00 0.00 -1.73 0.00 0.00 68.15 67.29 3gii h THR 205 CO 0.00 0.07 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.22 3gii h LEU 206 N 0.37 0.00 -4.03 3.87 3.38 -1.68 -3.17 115.31 114.05 3gii h LEU 206 Ca 0.24 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.55 3gii h LEU 206 Cb 0.45 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.88 3gii h LEU 206 CO -0.06 0.05 0.47 -1.54 0.09 0.00 0.00 178.44 177.45 3gii n SER 207 N -3.16 7.01 -3.71 -0.43 3.41 -0.97 -4.93 113.62 110.85 3gii n SER 207 Ca 0.01 -3.78 -0.12 0.00 -0.26 0.00 0.00 58.87 54.72 3gii n SER 207 Cb 0.34 -0.83 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 3gii n SER 207 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3gii s ILE 208 N -4.81 -0.01 0.34 -1.33 2.07 -1.20 -5.10 121.20 111.16 3gii s ILE 208 Ca 0.60 0.04 -0.25 0.00 -1.41 0.00 0.00 60.65 59.64 3gii s ILE 208 Cb 0.48 -0.64 -0.14 0.00 0.13 0.00 0.00 42.46 42.29 3gii s ILE 208 CO -0.03 0.02 0.58 -0.62 -1.91 0.00 0.00 174.94 172.97 3gii n GLU 209 N 3.53 0.53 -0.20 3.50 -0.58 -1.26 -4.86 120.64 121.30 3gii n GLU 209 Ca -0.18 0.19 -0.07 0.00 -0.42 0.00 0.00 57.16 56.68 3gii n GLU 209 Cb 0.56 -1.40 0.03 0.00 -0.57 0.00 0.00 31.44 30.06 3gii n GLU 209 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 3gii h PHE 210 N 1.02 0.82 -0.97 -0.32 3.57 -1.99 -2.99 116.94 116.08 3gii h PHE 210 Ca -0.37 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.12 3gii h PHE 210 Cb 1.40 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.84 3gii h PHE 210 CO 0.39 0.62 0.64 -0.44 -2.23 0.00 0.00 178.31 177.29 3gii h ASP 211 N 0.77 1.08 0.14 0.41 3.45 -1.98 0.22 116.42 120.52 3gii h ASP 211 Ca 0.20 -0.02 -0.12 0.00 0.43 0.00 0.00 57.03 57.52 3gii h ASP 211 Cb 0.11 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 3gii h ASP 211 CO -0.03 0.76 -0.41 0.11 -1.57 0.00 0.00 179.24 178.10 3gii h LYS 212 N 1.27 0.35 0.26 3.56 1.79 -1.91 0.36 116.57 122.25 3gii h LYS 212 Ca 0.37 -0.17 -0.01 0.00 -2.18 0.00 0.00 60.65 58.66 3gii h LYS 212 Cb -0.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 3gii h LYS 212 CO -0.10 0.71 -0.13 1.25 -1.08 0.00 0.00 179.45 180.10 3gii h LEU 213 N 0.29 -0.30 -1.64 2.94 5.85 -1.24 -2.61 115.31 118.61 3gii h LEU 213 Ca 0.03 -0.21 0.18 0.00 0.84 0.00 0.00 57.88 58.71 3gii h LEU 213 Cb 0.85 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 3gii h LEU 213 CO 0.07 0.19 0.54 0.50 -0.34 0.00 0.00 178.44 179.39 3gii h LYS 214 N -0.93 0.32 -0.51 1.25 3.64 -0.54 -1.50 116.57 118.30 3gii h LYS 214 Ca -0.04 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.22 3gii h LYS 214 Cb 0.50 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 3gii h LYS 214 CO 0.06 0.21 -0.10 0.78 -2.27 0.00 0.00 179.45 178.13 3gii h GLY 215 N 0.33 1.06 0.51 5.01 0.00 -0.25 -0.10 103.07 109.64 3gii h GLY 215 Ca 0.40 -0.86 -0.14 0.00 0.00 0.00 0.00 47.33 46.72 3gii h GLY 215 CO -0.12 0.78 -0.65 1.98 0.00 0.00 0.00 176.54 178.54 3gii h MET 216 N 0.84 0.22 -0.03 4.80 1.85 -0.98 -3.41 114.93 118.23 3gii h MET 216 Ca 0.13 -0.38 0.00 0.00 -0.61 0.00 0.00 59.70 58.84 3gii h MET 216 Cb 0.66 0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.83 3gii h MET 216 CO 0.05 1.18 0.00 0.44 -0.40 0.00 0.00 176.91 178.18 3gii n ILE 217 N -4.24 0.25 0.00 1.77 -5.35 -0.63 -5.08 119.36 106.09 3gii n ILE 217 Ca -0.14 -0.63 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 3gii n ILE 217 Cb 0.74 0.93 0.00 0.00 -1.74 0.00 0.00 39.64 39.57 3gii n ILE 217 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gii n GLY 218 N 0.09 -0.88 0.32 3.28 0.00 -0.05 -4.54 105.19 103.41 3gii n GLY 218 Ca 0.02 -1.65 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 3gii n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3gii h GLU 219 N 0.00 -0.76 -0.66 1.61 4.81 -1.92 -2.57 114.58 115.09 3gii h GLU 219 Ca 0.00 0.05 0.14 0.00 -0.13 0.00 0.00 59.36 59.42 3gii h GLU 219 Cb 0.00 0.17 -0.12 0.00 0.63 0.00 0.00 28.75 29.43 3gii h GLU 219 CO 0.00 -0.51 -0.09 0.00 -0.73 0.00 0.00 179.01 177.68 3gii h ALA 220 N -1.57 0.54 0.00 2.92 0.00 -1.97 -0.52 119.26 118.66 3gii h ALA 220 Ca -0.08 0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 3gii h ALA 220 Cb 0.61 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3gii h ALA 220 CO 0.13 -0.42 -0.67 -0.22 0.00 0.00 0.00 179.25 178.07 3gii h LYS 221 N 0.05 0.00 -0.22 0.00 3.64 -1.80 -1.97 116.57 116.27 3gii h LYS 221 Ca 0.33 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 3gii h LYS 221 Cb 0.53 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 3gii h LYS 221 CO -0.63 0.67 -0.12 0.00 -2.27 0.00 0.00 179.45 177.10 3gii h ALA 222 N 1.33 0.32 -0.90 5.00 0.00 -0.76 -1.40 119.26 122.84 3gii h ALA 222 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3gii h ALA 222 Cb 1.44 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 3gii h ALA 222 CO 0.09 0.18 0.57 0.87 0.00 0.00 0.00 179.25 180.96 3gii h LYS 223 N 0.18 1.19 0.46 0.00 1.57 -1.08 -2.08 116.57 116.82 3gii h LYS 223 Ca 0.05 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3gii h LYS 223 Cb 0.63 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3gii h LYS 223 CO 0.04 0.81 -0.30 -0.92 -0.57 0.00 0.00 179.45 178.51 3gii h TYR 224 N 1.22 -0.78 -0.82 -1.35 3.20 -1.26 -0.88 116.97 116.29 3gii h TYR 224 Ca 0.33 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 3gii h TYR 224 Cb -0.11 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 3gii h TYR 224 CO -0.00 -0.45 0.47 -0.07 -1.64 0.00 0.00 178.16 176.47 3gii h LEU 225 N -0.73 1.00 0.04 2.82 3.38 -1.06 -2.16 115.31 118.60 3gii h LEU 225 Ca -0.05 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3gii h LEU 225 Cb 0.60 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3gii h LEU 225 CO 0.04 0.78 -0.02 0.40 0.09 0.00 0.00 178.44 179.73 3gii h ILE 226 N 1.14 1.25 -0.25 1.22 2.04 -1.30 -2.44 117.51 119.17 3gii h ILE 226 Ca 0.29 -0.98 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 3gii h ILE 226 Cb -0.02 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3gii h ILE 226 CO -0.05 0.25 0.14 0.77 0.00 0.00 0.00 178.15 179.26 3gii h SER 227 N -0.49 0.30 -0.36 1.72 4.64 -1.05 -1.67 113.55 116.64 3gii h SER 227 Ca -0.01 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 3gii h SER 227 Cb 0.45 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 3gii h SER 227 CO 0.01 0.24 -0.25 0.25 -0.87 0.00 0.00 176.83 176.21 3gii h LEU 228 N 0.34 0.89 -1.15 5.97 5.85 -1.36 -1.06 115.31 124.80 3gii h LEU 228 Ca 0.09 -0.34 -0.07 0.00 0.84 0.00 0.00 57.88 58.40 3gii h LEU 228 Cb 0.00 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 3gii h LEU 228 CO -0.02 1.10 -0.15 0.00 -0.34 0.00 0.00 178.44 179.03 3gii h ALA 229 N 0.96 1.29 -0.00 1.25 0.00 -0.82 -2.64 119.26 119.30 3gii h ALA 229 Ca 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3gii h ALA 229 Cb 0.80 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3gii h ALA 229 CO 0.07 0.47 -0.09 0.54 0.00 0.00 0.00 179.25 180.24 3gii n ARG 230 N -4.20 0.31 -3.41 0.00 1.74 -0.82 -4.93 116.66 105.35 3gii n ARG 230 Ca 0.00 -0.06 -0.19 0.00 -0.77 0.00 0.00 57.85 56.83 3gii n ARG 230 Cb 0.33 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.34 3gii n ARG 230 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3gii n ASP 231 N -1.29 -4.44 -2.71 0.55 2.03 -1.00 -4.95 116.55 104.75 3gii n ASP 231 Ca 0.11 -0.51 -0.20 0.00 0.52 0.00 0.00 54.79 54.71 3gii n ASP 231 Cb 0.29 -4.62 0.00 0.00 -0.72 0.00 0.00 41.12 36.07 3gii n ASP 231 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3gii n GLU 232 N -4.28 2.30 -3.20 -0.67 1.02 -0.44 -4.95 120.64 110.43 3gii n GLU 232 Ca -0.10 -3.99 -0.23 0.00 -0.02 0.00 0.00 57.16 52.83 3gii n GLU 232 Cb 0.59 -1.83 -0.06 0.00 -0.02 0.00 0.00 31.44 30.12 3gii n GLU 232 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 3gii n TYR 233 N -0.20 0.36 -3.25 -0.32 9.36 -1.24 -4.74 117.16 117.13 3gii n TYR 233 Ca 0.26 -3.71 -0.46 0.00 3.32 0.00 0.00 57.90 57.31 3gii n TYR 233 Cb 0.67 -0.39 -0.01 0.00 -0.63 0.00 0.00 39.34 38.97 3gii n TYR 233 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 3gii s ASN 234 N -1.74 6.91 0.20 2.98 -0.87 -1.26 -4.89 114.94 116.27 3gii s ASN 234 Ca 0.37 -2.85 -0.20 0.00 -1.57 0.00 0.00 52.86 48.61 3gii s ASN 234 Cb 0.22 -2.25 -0.08 0.00 -0.02 0.00 0.00 41.25 39.12 3gii s ASN 234 CO -0.09 -0.58 0.71 -1.83 -2.57 0.00 0.00 177.10 172.74 3gii s GLU 235 N 0.27 4.28 0.41 -0.60 -1.05 -1.26 -5.03 118.70 115.71 3gii s GLU 235 Ca 0.25 0.89 -0.12 0.00 -0.15 0.00 0.00 54.97 55.83 3gii s GLU 235 Cb -0.09 -2.96 -0.07 0.00 -0.44 0.00 0.00 34.13 30.57 3gii s GLU 235 CO -0.08 0.44 0.80 -1.25 0.95 0.00 0.00 175.26 176.12 3gii s PRO 236 N -1.79 3.85 -0.23 -4.83 0.05 -1.26 -4.66 135.00 126.12 3gii s PRO 236 Ca 0.41 0.59 -0.29 0.00 0.05 0.00 0.00 61.00 61.75 3gii s PRO 236 Cb -0.18 -2.35 -0.00 0.00 0.05 0.00 0.00 34.50 32.01 3gii s PRO 236 CO 0.21 -0.04 1.26 0.42 0.05 0.00 0.00 177.00 178.90 3gii s ILE 237 N -2.35 4.25 0.00 0.56 -1.09 -1.26 -5.03 121.20 116.28 3gii s ILE 237 Ca 0.53 1.47 0.03 0.00 -2.23 0.00 0.00 60.65 60.44 3gii s ILE 237 Cb -0.10 -4.10 -0.01 0.00 -1.58 0.00 0.00 42.46 36.67 3gii s ILE 237 CO 0.29 -0.30 -0.08 0.00 -1.23 0.00 0.00 174.94 173.62 3gii s ARG 238 N 3.78 0.64 0.17 2.79 1.70 -1.26 -4.92 118.95 121.84 3gii s ARG 238 Ca 0.55 -0.34 -0.33 0.00 -0.47 0.00 0.00 55.73 55.13 3gii s ARG 238 Cb -0.19 -0.60 -0.16 0.00 -0.57 0.00 0.00 34.95 33.43 3gii s ARG 238 CO 0.18 0.16 1.22 2.41 -1.08 0.00 0.00 175.30 178.19 3gii n THR 239 N 2.72 0.77 -2.44 4.99 -1.04 -1.26 -4.52 114.28 113.51 3gii n THR 239 Ca -0.14 -0.19 -0.42 0.00 -2.04 0.00 0.00 64.05 61.26 3gii n THR 239 Cb 0.57 -0.92 -0.03 0.00 -1.82 0.00 0.00 70.33 68.13 3gii n THR 239 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 3gii s ARG 240 N -0.25 4.46 -0.13 -2.82 6.06 -1.26 -5.03 118.95 119.98 3gii s ARG 240 Ca 0.74 1.76 -0.02 0.00 -2.50 0.00 0.00 55.73 55.72 3gii s ARG 240 Cb -0.84 -3.33 -0.02 0.00 0.06 0.00 0.00 34.95 30.82 3gii s ARG 240 CO 0.51 -0.19 -0.08 0.08 -2.50 0.00 0.00 175.30 173.12 3gii s VAL 241 N 0.75 3.48 -0.03 7.11 1.01 -1.26 -5.04 120.40 126.43 3gii s VAL 241 Ca 0.57 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 3gii s VAL 241 Cb -0.30 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 3gii s VAL 241 CO 0.31 0.52 1.20 -0.13 0.00 0.00 0.00 175.10 177.00 3gii s ARG 242 N 0.23 4.37 -0.03 2.72 1.81 -1.26 -4.92 118.95 121.87 3gii s ARG 242 Ca -0.05 1.69 0.16 0.00 -1.72 0.00 0.00 55.73 55.81 3gii s ARG 242 Cb -0.15 -3.52 -0.24 0.00 -0.45 0.00 0.00 34.95 30.59 3gii s ARG 242 CO 0.04 -0.41 0.33 1.63 -0.68 0.00 0.00 175.30 176.21 3gii n LYS 243 N 4.96 0.55 -3.67 3.54 5.02 -1.26 -4.97 118.16 122.33 3gii n LYS 243 Ca 0.11 -0.14 -0.15 0.00 -2.02 0.00 0.00 58.31 56.11 3gii n LYS 243 Cb 0.46 -1.38 -0.08 0.00 -0.02 0.00 0.00 35.03 34.02 3gii n LYS 243 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3gii s SER 244 N -3.89 -0.40 -0.02 4.39 1.04 -1.26 -3.67 113.70 109.90 3gii s SER 244 Ca -0.06 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.81 3gii s SER 244 Cb 0.10 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.73 3gii s SER 244 CO 0.66 -0.46 0.01 -0.63 0.98 0.00 0.00 173.24 173.80 3gii s ILE 245 N -1.04 0.02 0.23 -1.02 1.01 -0.31 -4.97 121.20 115.12 3gii s ILE 245 Ca -0.11 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.57 3gii s ILE 245 Cb -0.03 -0.10 0.04 0.00 0.01 0.00 0.00 42.46 42.37 3gii s ILE 245 CO 0.06 0.08 0.47 0.61 0.00 0.00 0.00 174.94 176.15 3gii n GLY 246 N 3.82 1.37 3.63 6.18 0.00 -1.26 -0.35 105.19 118.59 3gii n GLY 246 Ca -0.23 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 3gii n GLY 246 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gii s ARG 247 N -2.05 0.82 0.01 1.61 6.06 -0.58 -4.87 118.95 119.95 3gii s ARG 247 Ca 0.09 1.01 0.02 0.00 -2.50 0.00 0.00 55.73 54.36 3gii s ARG 247 Cb -0.03 0.38 -0.01 0.00 0.06 0.00 0.00 34.95 35.35 3gii s ARG 247 CO 0.07 -0.10 -0.07 -1.50 -2.50 0.00 0.00 175.30 171.19 3gii s ILE 248 N 0.50 0.54 0.11 4.11 2.07 -1.26 -1.41 121.20 125.85 3gii s ILE 248 Ca -0.01 -0.49 0.05 0.00 -1.41 0.00 0.00 60.65 58.79 3gii s ILE 248 Cb -0.05 -0.50 -0.04 0.00 0.13 0.00 0.00 42.46 42.01 3gii s ILE 248 CO -0.01 0.02 -0.13 0.68 -1.91 0.00 0.00 174.94 173.59 3gii s VAL 249 N -0.46 1.19 -0.20 4.00 -7.23 -0.09 -4.96 120.40 112.66 3gii s VAL 249 Ca -0.00 -1.65 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 3gii s VAL 249 Cb -0.04 -1.43 -0.05 0.00 0.56 0.00 0.00 36.38 35.42 3gii s VAL 249 CO 0.00 -0.44 0.18 -0.89 -0.31 0.00 0.00 175.10 173.65 3gii s THR 250 N -2.13 5.37 0.44 5.32 2.01 -1.26 -1.24 115.64 124.15 3gii s THR 250 Ca 0.07 0.29 -0.21 0.00 0.31 0.00 0.00 61.69 62.15 3gii s THR 250 Cb -0.05 -3.52 -0.10 0.00 0.01 0.00 0.00 72.50 68.83 3gii s THR 250 CO 0.02 0.40 0.97 -0.04 -0.69 0.00 0.00 174.62 175.28 3gii s MET 251 N 0.56 4.14 0.30 4.92 -1.94 -0.63 -4.97 119.30 121.68 3gii s MET 251 Ca 0.10 1.15 0.06 0.00 -1.71 0.00 0.00 55.69 55.30 3gii s MET 251 Cb -0.12 -2.16 0.46 0.00 2.01 0.00 0.00 34.83 35.02 3gii s MET 251 CO 0.01 -0.11 1.71 -0.22 -0.01 0.00 0.00 175.02 176.39 3gii h LYS 252 N 1.80 0.25 -3.95 2.03 1.63 -1.87 -3.44 116.57 113.03 3gii h LYS 252 Ca -0.49 -0.12 -0.12 0.00 -0.85 0.00 0.00 60.65 59.07 3gii h LYS 252 Cb 1.19 -0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.65 3gii h LYS 252 CO 0.61 0.62 -0.56 -0.98 -3.45 0.00 0.00 179.45 175.69 3gii s ARG 253 N -4.17 0.62 0.62 1.90 1.70 -1.26 -4.70 118.95 113.65 3gii s ARG 253 Ca -0.05 -0.92 -0.19 0.00 -0.47 0.00 0.00 55.73 54.11 3gii s ARG 253 Cb 0.13 0.24 -0.02 0.00 -0.57 0.00 0.00 34.95 34.73 3gii s ARG 253 CO 0.77 -0.15 1.29 -0.80 -1.08 0.00 0.00 175.30 175.33 3gii s ASN 254 N -2.44 4.85 0.05 -2.89 0.01 -1.26 -4.90 114.94 108.36 3gii s ASN 254 Ca -0.00 2.60 -0.27 0.00 -0.71 0.00 0.00 52.86 54.47 3gii s ASN 254 Cb 0.02 -2.62 0.09 0.00 0.41 0.00 0.00 41.25 39.15 3gii s ASN 254 CO -0.07 -1.84 0.74 -0.55 -1.51 0.00 0.00 177.10 173.87 3gii s SER 255 N -1.36 -0.49 0.00 -1.22 0.15 -0.72 -4.92 113.70 105.13 3gii s SER 255 Ca 0.80 0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.57 3gii s SER 255 Cb -0.36 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 3gii s SER 255 CO 0.39 -0.75 0.82 0.54 1.20 0.00 0.00 173.24 175.45 3gii n ARG 256 N -0.09 1.93 -2.95 5.44 1.74 -1.26 -0.92 116.66 120.55 3gii n ARG 256 Ca -0.14 -1.16 -0.40 0.00 -0.77 0.00 0.00 57.85 55.37 3gii n ARG 256 Cb 0.62 -0.89 -0.04 0.00 -1.02 0.00 0.00 32.46 31.13 3gii n ARG 256 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3gii s ASN 257 N -0.68 7.04 0.09 0.55 3.84 -1.26 -4.96 114.94 119.56 3gii s ASN 257 Ca 0.00 1.26 -0.19 0.00 0.21 0.00 0.00 52.86 54.13 3gii s ASN 257 Cb 0.00 -2.45 -0.08 0.00 -0.55 0.00 0.00 41.25 38.17 3gii s ASN 257 CO 0.00 -0.21 1.59 0.25 -2.79 0.00 0.00 177.10 175.94 3gii h LEU 258 N 7.17 0.33 -1.51 3.21 5.85 -1.99 -2.13 115.31 126.24 3gii h LEU 258 Ca -0.38 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.09 3gii h LEU 258 Cb 1.18 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 3gii h LEU 258 CO 0.77 0.46 -0.02 -0.08 -0.34 0.00 0.00 178.44 179.23 3gii h GLU 259 N 0.18 0.29 0.00 1.25 4.57 -2.01 -0.54 114.58 118.33 3gii h GLU 259 Ca 0.07 -0.05 -0.07 0.00 -1.18 0.00 0.00 59.36 58.13 3gii h GLU 259 Cb 0.25 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 3gii h GLU 259 CO -0.00 0.34 -0.34 1.49 -1.18 0.00 0.00 179.01 179.31 3gii h GLU 260 N 0.29 0.00 0.03 1.92 4.81 -1.88 -3.30 114.58 116.44 3gii h GLU 260 Ca 0.07 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.98 3gii h GLU 260 Cb 0.23 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 3gii h GLU 260 CO 0.01 0.34 -1.87 -0.89 -0.73 0.00 0.00 179.01 175.88 3gii n ILE 261 N -3.47 1.63 -0.12 2.32 5.41 -0.63 -4.58 119.36 119.93 3gii n ILE 261 Ca 0.00 -0.76 -0.06 0.00 1.00 0.00 0.00 62.75 62.93 3gii n ILE 261 Cb 0.51 -1.17 0.01 0.00 -0.71 0.00 0.00 39.64 38.27 3gii n ILE 261 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3gii h LYS 262 N 0.02 -0.14 -0.97 0.38 1.57 -1.21 -1.80 116.57 114.41 3gii h LYS 262 Ca -0.35 0.01 0.29 0.00 -1.87 0.00 0.00 60.65 58.73 3gii h LYS 262 Cb 2.04 0.03 -0.15 0.00 0.08 0.00 0.00 32.23 34.23 3gii h LYS 262 CO 0.07 -0.09 0.48 -1.35 -0.57 0.00 0.00 179.45 177.99 3gii h PRO 263 N -0.15 0.30 -0.12 3.15 0.11 -1.81 0.28 132.00 133.76 3gii h PRO 263 Ca 0.19 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 66.08 3gii h PRO 263 Cb 0.45 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.49 3gii h PRO 263 CO -0.49 0.20 -0.74 1.88 -0.21 0.00 0.00 178.00 178.64 3gii h TYR 264 N 0.31 0.83 -0.21 0.65 0.05 -1.63 -1.89 116.97 115.07 3gii h TYR 264 Ca 0.68 -0.36 -0.02 0.00 0.05 0.00 0.00 58.73 59.08 3gii h TYR 264 Cb 1.49 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 39.09 3gii h TYR 264 CO -0.08 1.16 0.06 1.25 -1.05 0.00 0.00 178.16 179.49 3gii h LEU 265 N 0.42 0.32 -1.15 3.88 5.85 -0.22 -2.15 115.31 122.27 3gii h LEU 265 Ca -0.04 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 3gii h LEU 265 Cb 1.35 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 3gii h LEU 265 CO 0.14 0.46 0.17 -0.26 -0.34 0.00 0.00 178.44 178.62 3gii h PHE 266 N 0.17 0.77 -0.41 1.25 0.04 -0.76 -0.83 116.94 117.17 3gii h PHE 266 Ca 0.07 -0.05 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 3gii h PHE 266 Cb 0.26 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 3gii h PHE 266 CO 0.01 0.63 0.02 -0.09 -0.60 0.00 0.00 178.31 178.28 3gii h ARG 267 N 0.75 0.65 -0.16 1.51 2.43 -1.18 -1.24 114.38 117.13 3gii h ARG 267 Ca 0.17 -0.15 -0.20 0.00 -0.81 0.00 0.00 59.98 59.00 3gii h ARG 267 Cb 0.21 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3gii h ARG 267 CO -0.01 0.66 -0.70 0.00 -1.51 0.00 0.00 179.97 178.41 3gii h ALA 268 N 1.40 0.46 0.04 2.80 0.00 -0.66 -2.12 119.26 121.18 3gii h ALA 268 Ca 0.13 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 3gii h ALA 268 Cb 0.36 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3gii h ALA 268 CO 0.01 0.70 -0.02 0.82 0.00 0.00 0.00 179.25 180.77 3gii h ILE 269 N 0.49 1.11 -0.22 0.00 2.04 -1.03 -1.17 117.51 118.73 3gii h ILE 269 Ca -0.03 -0.48 0.04 0.00 1.00 0.00 0.00 64.86 65.40 3gii h ILE 269 Cb 1.30 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 38.77 3gii h ILE 269 CO 0.14 0.12 -0.04 -0.33 0.00 0.00 0.00 178.15 178.04 3gii h GLU 270 N -0.26 0.01 -0.13 2.37 4.39 -1.23 0.14 114.58 119.87 3gii h GLU 270 Ca -0.01 -0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 3gii h GLU 270 Cb 0.24 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 3gii h GLU 270 CO 0.01 0.01 -0.27 0.93 -1.16 0.00 0.00 179.01 178.53 3gii h GLU 271 N 0.01 0.23 0.00 2.33 5.08 -1.36 -2.06 114.58 118.82 3gii h GLU 271 Ca 0.11 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 3gii h GLU 271 Cb 0.16 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3gii h GLU 271 CO -0.22 0.49 -1.20 0.66 -1.00 0.00 0.00 179.01 177.74 3gii h SER 272 N 0.21 0.00 0.67 1.42 4.64 -0.78 -2.53 113.55 117.18 3gii h SER 272 Ca 0.03 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.24 3gii h SER 272 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 3gii h SER 272 CO 0.04 0.51 -0.55 0.22 -0.87 0.00 0.00 176.83 176.19 3gii h TYR 273 N 0.00 0.00 0.08 4.77 5.03 -0.60 -1.61 116.97 124.65 3gii h TYR 273 Ca -0.12 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.19 3gii h TYR 273 Cb 1.50 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.78 3gii h TYR 273 CO 0.00 0.55 -0.04 -0.92 -1.32 0.00 0.00 178.16 176.43 3gii h TYR 274 N 0.00 -0.11 -0.16 -3.82 3.20 -1.39 -3.08 116.97 111.62 3gii h TYR 274 Ca -0.01 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 3gii h TYR 274 Cb 1.03 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.33 3gii h TYR 274 CO 0.00 0.33 0.23 0.87 -1.64 0.00 0.00 178.16 177.95 3gii h LYS 275 N -0.58 0.00 -0.62 1.82 1.57 -1.39 -0.92 116.57 116.45 3gii h LYS 275 Ca -0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3gii h LYS 275 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 3gii h LYS 275 CO 0.02 0.00 0.38 -0.07 -0.57 0.00 0.00 179.45 179.21 3gii h LEU 276 N 0.00 0.74 -3.44 2.94 3.38 -1.20 -3.48 115.31 114.26 3gii h LEU 276 Ca 0.07 -0.04 -0.41 0.00 0.09 0.00 0.00 57.88 57.60 3gii h LEU 276 Cb 0.54 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.12 3gii h LEU 276 CO -0.00 0.57 -0.86 -0.67 0.09 0.00 0.00 178.44 177.57 3gii n ASP 277 N -4.41 -5.37 0.00 -0.43 4.64 -0.35 -2.31 116.55 108.32 3gii n ASP 277 Ca 0.06 -0.87 0.00 0.00 -1.38 0.00 0.00 54.79 52.60 3gii n ASP 277 Cb 0.07 -2.63 0.00 0.00 -1.04 0.00 0.00 41.12 37.52 3gii n ASP 277 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 3gii n LYS 278 N -3.12 0.00 -1.57 -0.67 4.76 -1.26 -5.01 118.16 111.29 3gii n LYS 278 Ca -0.19 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 54.90 3gii n LYS 278 Cb 0.62 -1.18 0.08 0.00 -1.84 0.00 0.00 35.03 32.71 3gii n LYS 278 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3gii s ARG 279 N 0.00 2.36 -0.21 1.97 0.52 -0.98 -5.03 118.95 117.58 3gii s ARG 279 Ca 0.00 1.74 -0.01 0.00 -0.52 0.00 0.00 55.73 56.93 3gii s ARG 279 Cb 0.00 -1.86 0.06 0.00 0.52 0.00 0.00 34.95 33.67 3gii s ARG 279 CO 0.00 -1.66 0.00 0.42 0.02 0.00 0.00 175.30 174.08 3gii s ILE 280 N -1.94 0.94 0.33 1.52 1.01 -1.26 -4.96 121.20 116.83 3gii s ILE 280 Ca 0.74 -0.85 -0.09 0.00 0.00 0.00 0.00 60.65 60.45 3gii s ILE 280 Cb -0.29 -1.36 -0.06 0.00 0.01 0.00 0.00 42.46 40.76 3gii s ILE 280 CO 0.43 -0.18 0.66 -2.16 0.00 0.00 0.00 174.94 173.69 3gii s PRO 281 N 1.67 3.75 0.00 2.79 0.04 -1.26 -1.05 135.00 140.93 3gii s PRO 281 Ca -0.03 0.29 0.10 0.00 0.04 0.00 0.00 61.00 61.41 3gii s PRO 281 Cb -0.18 -2.52 0.13 0.00 0.04 0.00 0.00 34.50 31.98 3gii s PRO 281 CO -0.08 0.12 0.93 1.63 0.04 0.00 0.00 177.00 179.65 3gii n LYS 282 N -0.93 1.09 -4.26 4.56 5.02 0.07 -0.11 118.16 123.59 3gii n LYS 282 Ca 0.01 -1.35 -0.19 0.00 -2.02 0.00 0.00 58.31 54.76 3gii n LYS 282 Cb 0.54 -1.21 -0.15 0.00 -0.02 0.00 0.00 35.03 34.19 3gii n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gii s ALA 283 N -0.89 0.67 0.03 7.82 0.00 -0.87 -0.41 121.76 128.12 3gii s ALA 283 Ca 0.14 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 51.92 3gii s ALA 283 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 3gii s ALA 283 CO 0.13 0.10 -0.14 -1.50 0.00 0.00 0.00 175.76 174.35 3gii s ILE 284 N 0.22 1.13 -0.01 0.00 2.07 -0.85 -1.74 121.20 122.02 3gii s ILE 284 Ca -0.03 -0.93 0.01 0.00 -1.41 0.00 0.00 60.65 58.29 3gii s ILE 284 Cb -0.07 -1.01 0.01 0.00 0.13 0.00 0.00 42.46 41.52 3gii s ILE 284 CO 0.00 0.07 -0.01 -1.00 -1.91 0.00 0.00 174.94 172.10 3gii s HIS 285 N -0.74 0.22 -0.24 3.50 3.76 0.00 -1.57 115.29 120.22 3gii s HIS 285 Ca 0.03 -0.00 -0.15 0.00 -0.15 0.00 0.00 55.06 54.79 3gii s HIS 285 Cb -0.07 -0.25 -0.04 0.00 1.11 0.00 0.00 32.58 33.33 3gii s HIS 285 CO 0.01 -0.06 0.35 0.08 -0.85 0.00 0.00 174.74 174.27 3gii s VAL 286 N 0.49 5.21 -0.11 -0.90 1.01 -0.06 -0.37 120.40 125.67 3gii s VAL 286 Ca -0.05 0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.48 3gii s VAL 286 Cb -0.07 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3gii s VAL 286 CO -0.01 0.21 -0.02 -0.69 0.00 0.00 0.00 175.10 174.59 3gii s VAL 287 N 1.69 4.13 -0.06 2.92 1.01 0.15 -2.34 120.40 127.91 3gii s VAL 287 Ca 0.15 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.88 3gii s VAL 287 Cb -0.15 -2.76 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 3gii s VAL 287 CO 0.09 0.57 -0.20 0.00 0.00 0.00 0.00 175.10 175.56 3gii s ALA 288 N -0.49 1.79 -0.21 5.51 0.00 -0.18 -1.12 121.76 127.06 3gii s ALA 288 Ca 0.08 -0.80 -0.12 0.00 0.00 0.00 0.00 51.96 51.13 3gii s ALA 288 Cb -0.12 -0.63 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 3gii s ALA 288 CO 0.02 0.28 0.21 0.08 0.00 0.00 0.00 175.76 176.35 3gii s VAL 289 N 0.18 5.34 0.70 0.00 1.01 0.11 -1.63 120.40 126.11 3gii s VAL 289 Ca -0.10 0.31 -0.09 0.00 0.00 0.00 0.00 61.98 62.11 3gii s VAL 289 Cb -0.14 -3.54 0.04 0.00 0.00 0.00 0.00 36.38 32.73 3gii s VAL 289 CO 0.05 0.36 1.04 0.42 0.00 0.00 0.00 175.10 176.97 3gii s THR 290 N 0.81 2.80 0.52 3.92 -4.23 0.13 -0.47 115.64 119.11 3gii s THR 290 Ca 0.11 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 60.84 3gii s THR 290 Cb -0.13 -3.21 0.37 0.00 1.34 0.00 0.00 72.50 70.87 3gii s THR 290 CO 0.03 -0.24 2.02 1.05 -0.54 0.00 0.00 174.62 176.94 3gii h GLU 291 N -0.60 0.06 -0.68 3.99 4.11 -1.65 0.38 114.58 120.17 3gii h GLU 291 Ca -0.45 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3gii h GLU 291 Cb 1.29 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3gii h GLU 291 CO 0.62 0.04 0.00 -0.40 0.07 0.00 0.00 179.01 179.34 3gii n ASP 292 N -4.42 4.60 -1.76 3.06 3.85 -1.26 -4.94 116.55 115.68 3gii n ASP 292 Ca 0.08 -2.71 -0.21 0.00 -0.71 0.00 0.00 54.79 51.24 3gii n ASP 292 Cb 0.50 -0.64 -0.07 0.00 -1.35 0.00 0.00 41.12 39.55 3gii n ASP 292 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3gii n LEU 293 N 0.47 -1.60 -4.87 -2.12 4.77 0.13 -5.02 117.00 108.77 3gii n LEU 293 Ca 0.21 0.42 -0.30 0.00 -0.03 0.00 0.00 56.01 56.30 3gii n LEU 293 Cb 0.97 -2.88 0.05 0.00 -2.33 0.00 0.00 43.42 39.22 3gii n LEU 293 CO 0.25 -0.93 0.74 -0.62 -1.33 0.00 0.00 177.39 175.50 3gii s ASP 294 N -2.63 5.44 -0.11 -1.43 2.15 -1.26 -4.77 116.67 114.06 3gii s ASP 294 Ca 0.00 1.24 0.02 0.00 0.43 0.00 0.00 52.55 54.24 3gii s ASP 294 Cb 0.00 -2.08 0.02 0.00 -0.30 0.00 0.00 42.92 40.55 3gii s ASP 294 CO 0.00 -1.35 -0.15 -0.63 -0.17 0.00 0.00 175.17 172.86 3gii s ILE 295 N -3.28 1.53 0.09 4.11 1.01 -1.26 -0.69 121.20 122.71 3gii s ILE 295 Ca 0.58 -0.66 0.09 0.00 0.00 0.00 0.00 60.65 60.66 3gii s ILE 295 Cb -0.12 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 3gii s ILE 295 CO 0.53 0.45 -0.22 0.68 0.00 0.00 0.00 174.94 176.37 3gii s VAL 296 N 1.02 1.81 0.02 2.92 -7.23 -0.65 -4.99 120.40 113.31 3gii s VAL 296 Ca -0.06 -1.50 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 3gii s VAL 296 Cb -0.15 -1.62 -0.01 0.00 0.56 0.00 0.00 36.38 35.17 3gii s VAL 296 CO -0.02 0.03 0.07 -0.94 -0.31 0.00 0.00 175.10 173.93 3gii s SER 297 N -1.76 0.16 0.01 4.85 1.04 -1.26 -1.01 113.70 115.73 3gii s SER 297 Ca 0.08 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.07 3gii s SER 297 Cb -0.10 0.19 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 3gii s SER 297 CO 0.04 -0.43 -0.06 -0.13 0.98 0.00 0.00 173.24 173.64 3gii s ARG 298 N -2.07 0.46 0.32 4.02 1.81 -0.99 -5.00 118.95 117.50 3gii s ARG 298 Ca -0.10 -0.34 -0.10 0.00 -1.72 0.00 0.00 55.73 53.47 3gii s ARG 298 Cb -0.05 -0.39 0.02 0.00 -0.45 0.00 0.00 34.95 34.08 3gii s ARG 298 CO -0.02 0.10 0.58 0.20 -0.68 0.00 0.00 175.30 175.47 3gii s GLY 299 N -0.50 0.83 -0.02 -3.53 0.00 -1.26 -0.88 107.32 101.95 3gii s GLY 299 Ca -0.01 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.62 3gii s GLY 299 CO -0.00 -0.66 0.06 -1.60 0.00 0.00 0.00 173.10 170.91 3gii s ARG 300 N -3.17 0.12 -0.24 2.90 3.52 -0.61 -5.00 118.95 116.48 3gii s ARG 300 Ca 0.23 0.01 -0.07 0.00 -0.13 0.00 0.00 55.73 55.77 3gii s ARG 300 Cb -0.02 0.05 -0.03 0.00 -1.56 0.00 0.00 34.95 33.39 3gii s ARG 300 CO 0.14 -0.02 0.05 0.99 -0.81 0.00 0.00 175.30 175.65 3gii s THR 301 N -0.16 4.24 0.39 4.11 2.01 -1.26 -2.02 115.64 122.96 3gii s THR 301 Ca -0.02 -0.20 -0.01 0.00 0.31 0.00 0.00 61.69 61.77 3gii s THR 301 Cb -0.02 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 3gii s THR 301 CO 0.00 0.37 0.63 -0.36 -0.69 0.00 0.00 174.62 174.57 3gii s PHE 302 N 1.42 3.51 -0.82 4.92 0.40 0.45 -5.00 117.98 122.87 3gii s PHE 302 Ca 0.05 0.49 0.26 0.00 -0.60 0.00 0.00 56.93 57.13 3gii s PHE 302 Cb -0.15 -2.04 0.77 0.00 0.51 0.00 0.00 43.02 42.11 3gii s PHE 302 CO 0.03 -0.03 1.66 -0.35 0.70 0.00 0.00 175.22 177.23 3gii n PRO 303 N -1.95 0.17 -4.58 0.24 -0.04 -1.26 -4.81 135.00 122.77 3gii n PRO 303 Ca -0.03 0.10 -0.27 0.00 -0.04 0.00 0.00 63.50 63.26 3gii n PRO 303 Cb 0.56 -1.66 -0.11 0.00 -0.04 0.00 0.00 33.50 32.25 3gii n PRO 303 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3gii s HIS 304 N -3.08 2.42 0.73 0.54 3.76 -1.26 -5.11 115.29 113.31 3gii s HIS 304 Ca 0.11 -0.66 -0.13 0.00 -0.15 0.00 0.00 55.06 54.23 3gii s HIS 304 Cb 0.15 -1.62 0.04 0.00 1.11 0.00 0.00 32.58 32.26 3gii s HIS 304 CO 0.62 0.43 1.12 0.20 -0.85 0.00 0.00 174.74 176.27 3gii s GLY 305 N -3.66 1.95 -0.28 -2.22 0.00 -1.26 -4.56 107.32 97.30 3gii s GLY 305 Ca 0.34 0.49 -0.09 0.00 0.00 0.00 0.00 44.72 45.46 3gii s GLY 305 CO 0.17 0.85 0.14 -0.42 0.00 0.00 0.00 173.10 173.84 3gii s ILE 306 N -2.54 4.70 0.82 0.90 1.01 0.84 -4.95 121.20 121.97 3gii s ILE 306 Ca 0.66 -0.18 -0.11 0.00 0.00 0.00 0.00 60.65 61.01 3gii s ILE 306 Cb -0.20 -3.29 0.08 0.00 0.01 0.00 0.00 42.46 39.06 3gii s ILE 306 CO 0.49 0.20 1.09 -0.94 0.00 0.00 0.00 174.94 175.78 3gii s SER 307 N 1.65 4.23 0.41 3.58 1.04 -1.26 -4.69 113.70 118.66 3gii s SER 307 Ca 0.06 1.53 0.13 0.00 0.48 0.00 0.00 55.95 58.16 3gii s SER 307 Cb -0.16 -2.26 0.88 0.00 0.10 0.00 0.00 66.02 64.58 3gii s SER 307 CO 0.07 -2.17 1.93 0.50 0.98 0.00 0.00 173.24 174.54 3gii h LYS 308 N -1.22 0.02 -0.14 4.02 3.64 -1.99 -1.30 116.57 119.60 3gii h LYS 308 Ca -0.47 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.88 3gii h LYS 308 Cb 1.26 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3gii h LYS 308 CO 0.55 0.27 -0.03 1.49 -2.27 0.00 0.00 179.45 179.46 3gii h GLU 309 N 0.02 0.27 -0.81 1.90 4.57 -2.00 -1.74 114.58 116.79 3gii h GLU 309 Ca 0.00 -0.10 0.07 0.00 -1.18 0.00 0.00 59.36 58.15 3gii h GLU 309 Cb 0.45 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.95 3gii h GLU 309 CO 0.03 0.55 0.48 1.15 -1.18 0.00 0.00 179.01 180.04 3gii h THR 310 N -0.02 0.98 -0.13 0.32 2.02 -1.83 -2.04 112.91 112.21 3gii h THR 310 Ca 0.04 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.92 3gii h THR 310 Cb 0.44 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 3gii h THR 310 CO 0.01 0.16 0.08 0.00 0.37 0.00 0.00 175.52 176.14 3gii h ALA 311 N 1.41 0.16 -0.58 6.16 0.00 -1.13 0.11 119.26 125.40 3gii h ALA 311 Ca 0.37 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.34 3gii h ALA 311 Cb 0.24 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 3gii h ALA 311 CO -0.20 -0.35 0.24 1.88 0.00 0.00 0.00 179.25 180.82 3gii h TYR 312 N 0.17 0.42 0.06 0.00 0.05 -0.98 -1.83 116.97 114.85 3gii h TYR 312 Ca 0.05 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 3gii h TYR 312 Cb -0.01 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.63 3gii h TYR 312 CO -0.07 0.14 -0.03 1.03 -1.05 0.00 0.00 178.16 178.19 3gii h SER 313 N 0.44 -0.07 0.71 3.88 0.87 -0.85 -3.18 113.55 115.36 3gii h SER 313 Ca 0.28 -0.34 -0.13 0.00 -1.23 0.00 0.00 61.79 60.37 3gii h SER 313 Cb 0.30 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 3gii h SER 313 CO -0.26 0.31 -0.61 -0.08 -0.53 0.00 0.00 176.83 175.66 3gii h GLU 314 N -0.45 0.00 -0.36 2.24 4.57 -0.78 -3.02 114.58 116.78 3gii h GLU 314 Ca -0.01 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.05 3gii h GLU 314 Cb 0.40 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 3gii h GLU 314 CO 0.01 0.61 -0.27 0.66 -1.18 0.00 0.00 179.01 178.85 3gii h SER 315 N 0.00 0.78 -0.52 1.04 4.64 -1.40 0.09 113.55 118.18 3gii h SER 315 Ca -0.01 -0.30 -0.03 0.00 -0.47 0.00 0.00 61.79 60.99 3gii h SER 315 Cb 1.14 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 3gii h SER 315 CO 0.08 1.01 0.23 0.58 -0.87 0.00 0.00 176.83 177.86 3gii h VAL 316 N 0.65 1.21 -0.93 0.95 2.07 -1.51 -0.06 116.25 118.62 3gii h VAL 316 Ca 0.08 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 3gii h VAL 316 Cb 0.79 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 3gii h VAL 316 CO 0.07 0.24 0.55 0.11 0.02 0.00 0.00 177.57 178.55 3gii h LYS 317 N 0.70 1.27 -0.15 1.57 1.57 -1.32 0.19 116.57 120.40 3gii h LYS 317 Ca 0.18 -0.12 -0.18 0.00 -1.87 0.00 0.00 60.65 58.66 3gii h LYS 317 Cb 0.16 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 3gii h LYS 317 CO -0.02 0.89 -0.65 -0.07 -0.57 0.00 0.00 179.45 179.04 3gii h LEU 318 N 1.28 0.64 -0.40 2.94 3.38 -0.80 -1.73 115.31 120.63 3gii h LEU 318 Ca 0.33 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3gii h LEU 318 Cb -0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3gii h LEU 318 CO -0.06 1.12 0.21 0.25 0.09 0.00 0.00 178.44 180.05 3gii h LEU 319 N 0.41 0.50 -0.61 1.67 5.85 -0.69 -1.92 115.31 120.52 3gii h LEU 319 Ca -0.01 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.71 3gii h LEU 319 Cb 1.22 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.04 3gii h LEU 319 CO 0.12 0.46 0.19 1.56 -0.34 0.00 0.00 178.44 180.43 3gii h GLN 320 N 0.51 0.33 -0.02 1.25 4.20 -0.40 -1.27 115.11 119.71 3gii h GLN 320 Ca 0.14 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.85 3gii h GLN 320 Cb 0.07 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 3gii h GLN 320 CO -0.02 0.22 -0.11 -0.22 -0.67 0.00 0.00 178.83 178.03 3gii h LYS 321 N 0.34 -0.17 -0.27 1.46 3.64 -1.06 -0.92 116.57 119.58 3gii h LYS 321 Ca 0.32 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.77 3gii h LYS 321 Cb 0.43 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.23 3gii h LYS 321 CO -0.35 -0.11 -0.13 0.82 -2.27 0.00 0.00 179.45 177.41 3gii h ILE 322 N -0.18 0.60 -0.64 2.00 2.04 -0.59 0.31 117.51 121.05 3gii h ILE 322 Ca 0.05 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3gii h ILE 322 Cb 0.24 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3gii h ILE 322 CO -0.13 0.00 0.42 -0.07 0.00 0.00 0.00 178.15 178.38 3gii h LEU 323 N -0.09 0.59 0.04 1.44 4.07 -0.83 0.10 115.31 120.63 3gii h LEU 323 Ca 0.14 -0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.93 3gii h LEU 323 Cb 0.30 -0.13 0.02 0.00 1.08 0.00 0.00 40.66 41.93 3gii h LEU 323 CO -0.33 0.39 -0.69 -0.33 -1.08 0.00 0.00 178.44 176.40 3gii h GLU 324 N 0.67 0.39 0.00 1.13 5.08 0.13 -3.36 114.58 118.62 3gii h GLU 324 Ca 0.27 -0.48 -0.05 0.00 -1.00 0.00 0.00 59.36 58.10 3gii h GLU 324 Cb 0.21 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3gii h GLU 324 CO -0.08 1.16 -0.23 0.93 -1.00 0.00 0.00 179.01 179.79 3gii h GLU 325 N -0.15 0.00 -5.68 2.33 5.08 -0.06 -3.44 114.58 112.65 3gii h GLU 325 Ca -0.10 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.69 3gii h GLU 325 Cb 1.43 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.38 3gii h GLU 325 CO 0.13 0.23 -0.84 0.34 -1.00 0.00 0.00 179.01 177.87 3gii s ASP 326 N -6.32 2.23 0.01 1.42 -1.08 0.33 -5.07 116.67 108.18 3gii s ASP 326 Ca 0.06 -0.35 0.24 0.00 -0.52 0.00 0.00 52.55 51.97 3gii s ASP 326 Cb 0.06 -0.36 0.24 0.00 -1.46 0.00 0.00 42.92 41.40 3gii s ASP 326 CO 0.70 0.21 1.22 -1.84 0.52 0.00 0.00 175.17 175.98 3gii n GLU 327 N 2.77 0.04 -1.91 4.34 -0.00 -1.26 -4.49 120.64 120.13 3gii n GLU 327 Ca -0.16 0.00 -0.30 0.00 -0.00 0.00 0.00 57.16 56.70 3gii n GLU 327 Cb 0.53 -1.51 0.02 0.00 -0.00 0.00 0.00 31.44 30.48 3gii n GLU 327 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 3gii s ARG 328 N -3.03 3.30 0.68 3.44 0.52 -1.26 -5.05 118.95 117.55 3gii s ARG 328 Ca 0.09 0.60 -0.13 0.00 -0.52 0.00 0.00 55.73 55.77 3gii s ARG 328 Cb 0.17 -2.07 0.01 0.00 0.52 0.00 0.00 34.95 33.57 3gii s ARG 328 CO 0.76 -0.74 1.08 0.15 0.02 0.00 0.00 175.30 176.58 3gii s LYS 329 N -5.23 2.82 -0.13 3.54 1.02 -1.26 -4.90 119.74 115.59 3gii s LYS 329 Ca 0.56 1.21 -0.08 0.00 0.02 0.00 0.00 55.97 57.68 3gii s LYS 329 Cb -0.11 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.19 3gii s LYS 329 CO 0.53 -1.21 0.15 0.42 -0.92 0.00 0.00 175.35 174.32 3gii s ILE 330 N -2.63 5.46 -0.14 2.17 1.01 -0.10 -1.73 121.20 125.25 3gii s ILE 330 Ca 0.63 0.24 0.02 0.00 0.00 0.00 0.00 60.65 61.54 3gii s ILE 330 Cb -0.17 -3.43 -0.10 0.00 0.01 0.00 0.00 42.46 38.76 3gii s ILE 330 CO 0.46 0.58 -0.11 -1.14 0.00 0.00 0.00 174.94 174.73 3gii n ARG 331 N 2.30 0.56 -4.08 2.79 0.63 0.38 -1.76 116.66 117.47 3gii n ARG 331 Ca -0.19 0.07 -0.14 0.00 -0.92 0.00 0.00 57.85 56.68 3gii n ARG 331 Cb 0.54 -1.29 -0.12 0.00 0.45 0.00 0.00 32.46 32.04 3gii n ARG 331 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3gii s ARG 332 N -2.29 0.55 -0.02 -0.14 0.52 -0.90 -1.60 118.95 115.07 3gii s ARG 332 Ca -0.18 -0.73 -0.02 0.00 -0.52 0.00 0.00 55.73 54.28 3gii s ARG 332 Cb 0.05 -0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.17 3gii s ARG 332 CO 0.35 0.07 0.06 -1.50 0.02 0.00 0.00 175.30 174.30 3gii s ILE 333 N -1.27 0.01 0.27 1.52 1.10 -0.37 -0.71 121.20 121.75 3gii s ILE 333 Ca -0.08 -0.07 -0.21 0.00 -0.51 0.00 0.00 60.65 59.78 3gii s ILE 333 Cb -0.09 -0.11 0.05 0.00 0.15 0.00 0.00 42.46 42.45 3gii s ILE 333 CO 0.01 -0.04 0.84 -0.83 -2.11 0.00 0.00 174.94 172.81 3gii s GLY 334 N -0.09 0.04 0.09 1.50 0.00 -0.28 -0.91 107.32 107.68 3gii s GLY 334 Ca -0.01 -0.34 0.03 0.00 0.00 0.00 0.00 44.72 44.39 3gii s GLY 334 CO 0.00 0.21 -0.08 -1.34 0.00 0.00 0.00 173.10 171.89 3gii s VAL 335 N -3.06 0.81 -0.04 1.40 -7.23 -0.50 -0.67 120.40 111.10 3gii s VAL 335 Ca 0.14 -1.69 -0.03 0.00 -1.81 0.00 0.00 61.98 58.59 3gii s VAL 335 Cb -0.04 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.51 3gii s VAL 335 CO 0.07 -0.66 0.10 -0.60 -0.31 0.00 0.00 175.10 173.70 3gii s ARG 336 N -3.06 0.09 -0.04 4.82 3.52 0.51 -1.53 118.95 123.27 3gii s ARG 336 Ca 0.06 0.18 0.03 0.00 -0.13 0.00 0.00 55.73 55.88 3gii s ARG 336 Cb -0.01 -0.01 -0.03 0.00 -1.56 0.00 0.00 34.95 33.34 3gii s ARG 336 CO -0.02 -0.05 -0.12 -0.06 -0.81 0.00 0.00 175.30 174.24 3gii s PHE 337 N 0.34 2.76 0.33 5.12 0.08 0.53 -0.82 117.98 126.32 3gii s PHE 337 Ca -0.02 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 56.92 3gii s PHE 337 Cb -0.04 -1.62 -0.00 0.00 -0.57 0.00 0.00 43.02 40.79 3gii s PHE 337 CO -0.01 0.25 0.41 -1.13 -0.10 0.00 0.00 175.22 174.64 3gii n SER 338 N 2.10 -1.13 -3.10 1.36 3.41 -0.71 -1.17 113.62 114.39 3gii n SER 338 Ca -0.17 -2.90 -0.06 0.00 -0.26 0.00 0.00 58.87 55.47 3gii n SER 338 Cb 0.52 2.20 0.03 0.00 -0.26 0.00 0.00 64.21 66.70 3gii n SER 338 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3gii n LYS 339 N -0.57 -1.67 -2.76 4.33 5.02 -1.24 -2.04 118.16 119.23 3gii n LYS 339 Ca 0.03 1.21 -0.35 0.00 -2.02 0.00 0.00 58.31 57.17 3gii n LYS 339 Cb 0.57 -5.68 -0.06 0.00 -0.02 0.00 0.00 35.03 29.83 3gii n LYS 339 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3gii s PHE 340 N -3.16 3.44 -2.00 2.13 0.08 -1.26 -0.75 117.98 116.46 3gii s PHE 340 Ca 0.19 1.68 0.24 0.00 0.12 0.00 0.00 56.93 59.16 3gii s PHE 340 Cb -0.02 -2.92 1.41 0.00 -0.57 0.00 0.00 43.02 40.92 3gii s PHE 340 CO 0.73 -0.07 1.78 -0.89 -0.10 0.00 0.00 175.22 176.66