#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g1a s LYS 2 N 0.00 4.07 -0.21 2.12 2.20 -1.26 -1.92 119.74 124.75 1g1a s LYS 2 Ca 0.00 -0.27 -0.05 0.00 -0.36 0.00 0.00 55.97 55.29 1g1a s LYS 2 Cb 0.00 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 1g1a s LYS 2 CO 0.00 0.06 -0.01 0.42 -0.36 0.00 0.00 175.35 175.46 1g1a s ILE 3 N 1.05 3.77 -0.23 5.43 1.01 -0.37 -0.03 121.20 131.81 1g1a s ILE 3 Ca 0.07 -0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.17 1g1a s ILE 3 Cb -0.13 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.60 1g1a s ILE 3 CO 0.04 0.43 0.55 -0.22 0.00 0.00 0.00 174.94 175.73 1g1a s LEU 4 N 1.14 4.09 -0.08 2.97 0.20 0.13 -2.06 118.68 125.07 1g1a s LEU 4 Ca 0.02 0.63 0.05 0.00 0.69 0.00 0.00 54.13 55.52 1g1a s LEU 4 Cb -0.14 -2.73 -0.00 0.00 -0.43 0.00 0.00 46.19 42.88 1g1a s LEU 4 CO 0.01 -0.26 -0.23 -0.63 -0.29 0.00 0.00 176.35 174.94 1g1a s ILE 5 N 2.09 1.97 0.07 6.68 1.01 -0.48 -0.90 121.20 131.64 1g1a s ILE 5 Ca 0.24 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.92 1g1a s ILE 5 Cb -0.16 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 1g1a s ILE 5 CO 0.09 0.54 0.10 0.42 0.00 0.00 0.00 174.94 176.09 1g1a s THR 6 N 0.19 4.68 -0.86 2.92 -4.23 -0.59 -0.17 115.64 117.58 1g1a s THR 6 Ca -0.13 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.71 1g1a s THR 6 Cb -0.16 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.44 1g1a s THR 6 CO 0.07 0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.91 1g1a n GLY 7 N 0.53 0.83 0.31 3.99 0.00 -0.51 -2.25 105.19 108.09 1g1a n GLY 7 Ca -0.09 -0.63 0.20 0.00 0.00 0.00 0.00 46.02 45.50 1g1a n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1g1a h GLY 8 N 0.00 0.00 -1.63 -0.02 0.00 -1.76 -1.77 103.07 97.89 1g1a h GLY 8 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1g1a h GLY 8 CO 0.25 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.79 1g1a n ALA 9 N -2.15 2.44 -1.97 3.60 0.00 -1.26 -1.84 120.51 119.32 1g1a n ALA 9 Ca -0.02 -0.78 -0.27 0.00 0.00 0.00 0.00 53.44 52.36 1g1a n ALA 9 Cb 0.12 -0.97 0.16 0.00 0.00 0.00 0.00 19.45 18.77 1g1a n ALA 9 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1g1a s GLY 10 N -1.08 1.78 0.04 0.00 0.00 -0.66 -1.27 107.32 106.14 1g1a s GLY 10 Ca 0.31 -1.56 -0.20 0.00 0.00 0.00 0.00 44.72 43.27 1g1a s GLY 10 CO 0.22 -0.84 1.30 -2.75 0.00 0.00 0.00 173.10 171.03 1g1a h PHE 11 N -1.20 -0.76 -0.20 1.90 3.57 -1.85 0.18 116.94 118.59 1g1a h PHE 11 Ca -0.40 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.00 1g1a h PHE 11 Cb 1.24 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 40.27 1g1a h PHE 11 CO -0.88 -0.37 -0.28 0.82 -2.23 0.00 0.00 178.31 175.37 1g1a h ILE 12 N -0.57 1.33 -0.66 1.41 2.04 -1.94 -3.19 117.51 115.94 1g1a h ILE 12 Ca -0.04 -1.48 0.12 0.00 1.00 0.00 0.00 64.86 64.47 1g1a h ILE 12 Cb 0.49 1.82 -0.09 0.00 -0.74 0.00 0.00 36.82 38.30 1g1a h ILE 12 CO -0.02 0.45 0.18 1.23 0.00 0.00 0.00 178.15 180.00 1g1a h GLY 13 N 0.21 0.90 1.56 5.37 0.00 -1.69 0.54 103.07 109.94 1g1a h GLY 13 Ca 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1g1a h GLY 13 CO 0.06 -0.11 0.12 1.48 0.00 0.00 0.00 176.54 178.09 1g1a h SER 14 N 0.32 0.52 -0.10 0.19 4.64 0.14 -0.66 113.55 118.60 1g1a h SER 14 Ca 0.35 -0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 1g1a h SER 14 Cb 0.53 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 1g1a h SER 14 CO -0.41 0.50 -0.23 0.00 -0.87 0.00 0.00 176.83 175.83 1g1a h ALA 15 N 1.57 1.10 -0.06 5.18 0.00 -0.92 -0.74 119.26 125.39 1g1a h ALA 15 Ca 0.13 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1g1a h ALA 15 Cb 0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1g1a h ALA 15 CO -0.01 0.56 -0.00 0.28 0.00 0.00 0.00 179.25 180.08 1g1a h VAL 16 N 0.46 1.26 0.05 0.00 2.07 -0.24 -1.77 116.25 118.08 1g1a h VAL 16 Ca 0.07 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 1g1a h VAL 16 Cb 0.65 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1g1a h VAL 16 CO 0.05 0.22 -0.02 0.58 0.02 0.00 0.00 177.57 178.42 1g1a h VAL 17 N -0.19 0.98 -0.86 2.57 2.07 -0.99 -1.68 116.25 118.14 1g1a h VAL 17 Ca 0.02 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.54 1g1a h VAL 17 Cb 0.36 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 1g1a h VAL 17 CO 0.00 0.02 0.56 0.03 0.02 0.00 0.00 177.57 178.20 1g1a h ARG 18 N -0.10 0.89 -0.27 1.57 3.08 -1.15 -1.80 114.38 116.59 1g1a h ARG 18 Ca -0.01 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1g1a h ARG 18 Cb 0.08 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1g1a h ARG 18 CO 0.01 0.59 -0.02 1.25 -1.07 0.00 0.00 179.97 180.73 1g1a h HIS 19 N 0.91 0.53 -0.66 3.04 2.76 -0.93 -0.67 115.15 120.14 1g1a h HIS 19 Ca 0.38 -0.10 -0.06 0.00 -2.20 0.00 0.00 60.37 58.40 1g1a h HIS 19 Cb 0.30 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 1g1a h HIS 19 CO -0.00 0.66 0.18 0.82 -1.30 0.00 0.00 177.93 178.28 1g1a h ILE 20 N 0.26 1.25 0.01 6.26 2.04 -0.85 0.13 117.51 126.61 1g1a h ILE 20 Ca 0.07 -0.89 -0.24 0.00 1.00 0.00 0.00 64.86 64.80 1g1a h ILE 20 Cb 0.46 0.55 0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1g1a h ILE 20 CO 0.02 0.34 -1.00 0.40 0.00 0.00 0.00 178.15 177.91 1g1a h ILE 21 N 0.98 1.37 0.00 -0.67 1.08 -1.29 -2.59 117.51 116.40 1g1a h ILE 21 Ca 0.21 -2.44 -0.24 0.00 -0.39 0.00 0.00 64.86 62.00 1g1a h ILE 21 Cb 0.32 2.45 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 1g1a h ILE 21 CO -0.00 0.73 -1.26 0.11 -0.69 0.00 0.00 178.15 177.04 1g1a h LYS 22 N 0.26 0.00 0.00 2.37 1.57 -1.03 -3.40 116.57 116.33 1g1a h LYS 22 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1g1a h LYS 22 Cb 1.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.95 1g1a h LYS 22 CO 0.18 0.81 -0.06 0.09 -0.57 0.00 0.00 179.45 179.89 1g1a n ASN 23 N -3.23 1.34 -3.86 0.86 3.02 0.45 -5.07 115.26 108.76 1g1a n ASN 23 Ca -0.06 -1.99 -0.19 0.00 -0.03 0.00 0.00 54.58 52.30 1g1a n ASN 23 Cb 0.98 -0.12 -0.09 0.00 -0.61 0.00 0.00 39.78 39.95 1g1a n ASN 23 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1g1a s THR 24 N -1.04 0.25 -0.98 3.41 -4.23 -0.97 -4.98 115.64 107.10 1g1a s THR 24 Ca 0.07 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.81 1g1a s THR 24 Cb 0.06 -2.49 -0.10 0.00 1.34 0.00 0.00 72.50 71.31 1g1a s THR 24 CO 0.01 0.00 1.17 0.00 -0.54 0.00 0.00 174.62 175.26 1g1a n GLN 25 N -0.61 0.02 -1.40 3.99 1.13 -1.26 -4.79 117.38 114.45 1g1a n GLN 25 Ca 0.02 -0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.77 1g1a n GLN 25 Cb 0.64 -1.50 0.08 0.00 0.11 0.00 0.00 30.24 29.57 1g1a n GLN 25 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1g1a s ASP 26 N -3.05 4.69 0.25 1.08 1.01 -1.26 -4.62 116.67 114.76 1g1a s ASP 26 Ca 0.09 1.64 0.10 0.00 0.71 0.00 0.00 52.55 55.10 1g1a s ASP 26 Cb 0.17 -2.41 -0.05 0.00 1.01 0.00 0.00 42.92 41.65 1g1a s ASP 26 CO 0.78 -1.89 -0.11 0.28 0.21 0.00 0.00 175.17 174.44 1g1a s THR 27 N -2.99 2.96 0.01 -1.27 -1.32 -0.81 -4.72 115.64 107.50 1g1a s THR 27 Ca 0.60 -2.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.04 1g1a s THR 27 Cb -0.16 -2.53 -0.01 0.00 -1.51 0.00 0.00 72.50 68.29 1g1a s THR 27 CO 0.56 -0.30 -0.02 0.54 -2.21 0.00 0.00 174.62 173.19 1g1a s VAL 28 N -2.19 0.09 -0.22 5.08 0.11 0.24 -1.24 120.40 122.26 1g1a s VAL 28 Ca 0.28 -0.28 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 1g1a s VAL 28 Cb -0.07 -0.13 0.01 0.00 -1.53 0.00 0.00 36.38 34.67 1g1a s VAL 28 CO 0.16 -0.12 -0.10 0.54 -3.33 0.00 0.00 175.10 172.25 1g1a s VAL 29 N -0.41 2.76 -0.31 2.04 0.11 -0.88 -0.85 120.40 122.86 1g1a s VAL 29 Ca -0.04 -0.85 -0.11 0.00 -2.93 0.00 0.00 61.98 58.05 1g1a s VAL 29 Cb -0.03 -2.29 -0.03 0.00 -1.53 0.00 0.00 36.38 32.50 1g1a s VAL 29 CO -0.00 0.37 0.19 0.21 -3.33 0.00 0.00 175.10 172.53 1g1a s ASN 30 N 1.36 5.86 -0.31 3.54 2.47 0.13 -1.38 114.94 126.61 1g1a s ASN 30 Ca 0.03 -0.28 -0.11 0.00 0.42 0.00 0.00 52.86 52.92 1g1a s ASN 30 Cb -0.15 -2.09 -0.02 0.00 -1.45 0.00 0.00 41.25 37.54 1g1a s ASN 30 CO -0.07 -0.14 0.19 -0.63 -3.72 0.00 0.00 177.10 172.73 1g1a s ILE 31 N 1.70 5.03 -0.15 -5.21 1.01 0.76 -0.51 121.20 123.83 1g1a s ILE 31 Ca 0.06 -0.18 -0.09 0.00 0.00 0.00 0.00 60.65 60.44 1g1a s ILE 31 Cb -0.17 -3.51 0.05 0.00 0.01 0.00 0.00 42.46 38.84 1g1a s ILE 31 CO 0.09 0.10 0.37 -0.62 0.00 0.00 0.00 174.94 174.88 1g1a s ASP 32 N 1.69 -0.44 0.00 3.58 -1.08 -0.88 -1.43 116.67 118.11 1g1a s ASP 32 Ca 0.06 0.79 0.29 0.00 -0.52 0.00 0.00 52.55 53.17 1g1a s ASP 32 Cb -0.17 0.70 1.22 0.00 -1.46 0.00 0.00 42.92 43.21 1g1a s ASP 32 CO 0.09 -0.17 1.84 2.29 0.52 0.00 0.00 175.17 179.74 1g1a n LYS 33 N 3.95 1.32 -3.27 4.34 2.85 -0.63 -2.77 118.16 123.95 1g1a n LYS 33 Ca -0.21 -0.63 -0.09 0.00 -1.05 0.00 0.00 58.31 56.33 1g1a n LYS 33 Cb 0.55 -1.49 0.01 0.00 -0.65 0.00 0.00 35.03 33.46 1g1a n LYS 33 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1g1a n LEU 34 N -0.29 -5.42 0.00 -5.58 4.77 -1.26 -4.87 117.00 104.34 1g1a n LEU 34 Ca 0.19 -0.40 -0.12 0.00 -0.03 0.00 0.00 56.01 55.65 1g1a n LEU 34 Cb 0.29 -2.92 0.08 0.00 -2.33 0.00 0.00 43.42 38.54 1g1a n LEU 34 CO 0.19 -0.55 0.35 0.35 -1.33 0.00 0.00 177.39 176.40 1g1a n THR 35 N -2.34 0.00 0.16 -5.08 -2.24 -1.26 -4.77 114.28 98.75 1g1a n THR 35 Ca -0.07 -0.43 0.19 0.00 -2.27 0.00 0.00 64.05 61.47 1g1a n THR 35 Cb 0.56 -1.75 0.75 0.00 -2.10 0.00 0.00 70.33 67.79 1g1a n THR 35 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 1g1a h TYR 36 N -1.25 0.00 0.00 4.78 -0.00 -2.04 -0.37 116.97 118.09 1g1a h TYR 36 Ca -0.18 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.53 1g1a h TYR 36 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.22 1g1a h TYR 36 CO 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 178.16 177.97 1g1a h ALA 37 N 1.42 0.89 -2.27 0.10 0.00 -1.98 -3.46 119.26 113.97 1g1a h ALA 37 Ca 0.14 -0.12 -0.47 0.00 0.00 0.00 0.00 54.91 54.46 1g1a h ALA 37 Cb 1.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1g1a h ALA 37 CO -0.00 0.16 0.27 0.20 0.00 0.00 0.00 179.25 179.88 1g1a s GLY 38 N -4.28 2.52 -0.25 0.00 0.00 -0.15 -4.64 107.32 100.52 1g1a s GLY 38 Ca 0.06 0.33 -0.03 0.00 0.00 0.00 0.00 44.72 45.08 1g1a s GLY 38 CO 0.70 0.65 0.22 0.21 0.00 0.00 0.00 173.10 174.87 1g1a s ASN 39 N -1.98 2.01 0.60 1.64 3.84 -0.40 -4.81 114.94 115.85 1g1a s ASN 39 Ca 0.55 -0.66 0.37 0.00 0.21 0.00 0.00 52.86 53.33 1g1a s ASN 39 Cb -0.13 0.22 1.89 0.00 -0.55 0.00 0.00 41.25 42.68 1g1a s ASN 39 CO 0.18 -0.37 2.20 -0.07 -2.79 0.00 0.00 177.10 176.24 1g1a h LEU 40 N 8.33 0.00 -1.52 3.21 3.38 -1.83 -1.39 115.31 125.48 1g1a h LEU 40 Ca -0.16 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1g1a h LEU 40 Cb 1.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1g1a h LEU 40 CO 0.33 0.03 -0.24 -0.33 0.09 0.00 0.00 178.44 178.32 1g1a h GLU 41 N 0.00 0.00 0.00 1.13 5.08 -1.87 -1.50 114.58 117.42 1g1a h GLU 41 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1g1a h GLU 41 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1g1a h GLU 41 CO 0.00 0.24 0.00 0.43 -1.00 0.00 0.00 179.01 178.69 1g1a n SER 42 N -3.90 0.00 -0.19 1.42 7.64 -0.52 -2.08 113.62 115.98 1g1a n SER 42 Ca -0.02 0.29 0.03 0.00 1.01 0.00 0.00 58.87 60.18 1g1a n SER 42 Cb 0.33 -0.40 0.02 0.00 -1.01 0.00 0.00 64.21 63.14 1g1a n SER 42 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1g1a n LEU 43 N -1.40 1.34 -0.33 -3.43 4.77 -0.60 -4.82 117.00 112.54 1g1a n LEU 43 Ca 0.06 -0.96 0.23 0.00 -0.03 0.00 0.00 56.01 55.31 1g1a n LEU 43 Cb 0.17 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.72 1g1a n LEU 43 CO 0.14 0.29 1.11 0.77 -1.33 0.00 0.00 177.39 178.37 1g1a h SER 44 N 0.95 0.49 -0.65 -1.43 4.64 -1.02 0.27 113.55 116.79 1g1a h SER 44 Ca 0.00 0.19 -0.35 0.00 -0.47 0.00 0.00 61.79 61.16 1g1a h SER 44 Cb 0.21 0.14 -0.20 0.00 -0.31 0.00 0.00 62.40 62.25 1g1a h SER 44 CO 0.00 -0.14 0.45 -0.90 -0.87 0.00 0.00 176.83 175.38 1g1a n ASP 45 N -5.06 4.04 0.00 4.97 5.68 -1.26 -3.79 116.55 121.13 1g1a n ASP 45 Ca 0.31 -3.09 0.00 0.00 -0.50 0.00 0.00 54.79 51.51 1g1a n ASP 45 Cb 0.96 -0.77 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 1g1a n ASP 45 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1g1a n ILE 46 N -0.49 0.00 0.24 2.12 0.13 -0.02 -4.92 119.36 116.43 1g1a n ILE 46 Ca 0.39 0.00 0.03 0.00 -1.10 0.00 0.00 62.75 62.07 1g1a n ILE 46 Cb 1.16 0.00 0.14 0.00 -0.84 0.00 0.00 39.64 40.10 1g1a n ILE 46 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 1g1a n SER 47 N -0.07 0.00 0.01 9.51 3.41 -0.60 -2.10 113.62 123.78 1g1a n SER 47 Ca 0.00 0.42 0.11 0.00 -0.26 0.00 0.00 58.87 59.14 1g1a n SER 47 Cb 0.00 -0.45 0.01 0.00 -0.26 0.00 0.00 64.21 63.51 1g1a n SER 47 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1g1a n GLU 48 N -1.45 0.13 -1.77 4.33 -0.58 -1.26 -4.95 120.64 115.10 1g1a n GLU 48 Ca 0.02 -0.01 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 1g1a n GLU 48 Cb 0.07 -1.53 0.01 0.00 -0.57 0.00 0.00 31.44 29.42 1g1a n GLU 48 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1g1a n SER 49 N -1.69 3.50 0.04 1.62 2.88 -0.89 -4.86 113.62 114.21 1g1a n SER 49 Ca 0.03 1.17 0.11 0.00 -1.33 0.00 0.00 58.87 58.85 1g1a n SER 49 Cb 0.38 -1.61 0.46 0.00 -0.75 0.00 0.00 64.21 62.69 1g1a n SER 49 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1g1a n ASN 50 N 0.11 0.24 -0.61 -3.46 3.02 -1.26 -2.20 115.26 111.10 1g1a n ASN 50 Ca 0.04 0.54 0.11 0.00 -0.03 0.00 0.00 54.58 55.24 1g1a n ASN 50 Cb 0.40 -0.60 0.38 0.00 -0.61 0.00 0.00 39.78 39.35 1g1a n ASN 50 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1g1a n ARG 51 N -1.74 1.81 -5.21 3.52 1.74 -1.26 -4.85 116.66 110.68 1g1a n ARG 51 Ca 0.05 -1.22 -0.31 0.00 -0.77 0.00 0.00 57.85 55.60 1g1a n ARG 51 Cb 0.27 -1.42 -0.16 0.00 -1.02 0.00 0.00 32.46 30.13 1g1a n ARG 51 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1g1a s TYR 52 N -1.81 2.34 -0.01 -1.55 5.04 -0.93 -0.59 117.35 119.83 1g1a s TYR 52 Ca 0.34 -0.70 0.02 0.00 -2.44 0.00 0.00 57.07 54.29 1g1a s TYR 52 Cb 0.19 -1.54 -0.00 0.00 0.35 0.00 0.00 41.96 40.96 1g1a s TYR 52 CO 0.28 -0.21 -0.06 -0.80 -1.34 0.00 0.00 175.55 173.42 1g1a s ASN 53 N -0.13 0.75 -0.10 4.32 0.01 -0.03 -4.82 114.94 114.95 1g1a s ASN 53 Ca -0.04 -0.11 0.02 0.00 -0.71 0.00 0.00 52.86 52.01 1g1a s ASN 53 Cb -0.13 -0.12 -0.02 0.00 0.41 0.00 0.00 41.25 41.39 1g1a s ASN 53 CO 0.04 0.06 -0.15 0.12 -1.51 0.00 0.00 177.10 175.66 1g1a s PHE 54 N -0.02 2.74 -0.20 2.20 5.36 -1.26 0.22 117.98 127.02 1g1a s PHE 54 Ca 0.01 -0.51 0.00 0.00 -0.96 0.00 0.00 56.93 55.47 1g1a s PHE 54 Cb -0.04 -1.75 0.05 0.00 -0.34 0.00 0.00 43.02 40.94 1g1a s PHE 54 CO -0.00 -0.09 -0.06 -1.21 -1.46 0.00 0.00 175.22 172.39 1g1a s GLU 55 N -0.03 1.60 -0.99 10.12 0.41 0.33 -4.93 118.70 125.20 1g1a s GLU 55 Ca -0.04 -0.75 -0.23 0.00 -0.41 0.00 0.00 54.97 53.54 1g1a s GLU 55 Cb -0.14 -2.31 0.02 0.00 -1.78 0.00 0.00 34.13 29.92 1g1a s GLU 55 CO 0.04 -0.50 1.60 -1.58 -0.49 0.00 0.00 175.26 174.33 1g1a s HIS 56 N 1.51 2.33 0.15 1.61 5.65 -1.26 -2.08 115.29 123.20 1g1a s HIS 56 Ca -0.02 -0.44 -0.08 0.00 0.25 0.00 0.00 55.06 54.77 1g1a s HIS 56 Cb -0.17 -4.52 -0.01 0.00 -1.18 0.00 0.00 32.58 26.71 1g1a s HIS 56 CO -0.07 -1.88 0.24 0.00 -0.65 0.00 0.00 174.74 172.38 1g1a s ALA 57 N 6.42 0.07 -0.19 1.58 0.00 -1.11 -4.93 121.76 123.59 1g1a s ALA 57 Ca 0.53 -0.91 -0.09 0.00 0.00 0.00 0.00 51.96 51.49 1g1a s ALA 57 Cb -0.02 0.79 -0.05 0.00 0.00 0.00 0.00 23.12 23.85 1g1a s ALA 57 CO -0.07 -0.60 0.10 0.34 0.00 0.00 0.00 175.76 175.53 1g1a s ASP 58 N -2.96 5.97 0.27 0.00 -1.08 -1.26 -1.61 116.67 116.01 1g1a s ASP 58 Ca 0.16 0.17 0.19 0.00 -0.52 0.00 0.00 52.55 52.55 1g1a s ASP 58 Cb 0.04 -2.04 0.99 0.00 -1.46 0.00 0.00 42.92 40.45 1g1a s ASP 58 CO -0.02 0.18 1.58 2.30 0.52 0.00 0.00 175.17 179.73 1g1a n ILE 59 N 3.50 1.13 0.38 4.11 -5.35 -1.26 -1.02 119.36 120.85 1g1a n ILE 59 Ca -0.16 0.63 0.12 0.00 -0.27 0.00 0.00 62.75 63.07 1g1a n ILE 59 Cb 0.52 -1.61 0.26 0.00 -1.74 0.00 0.00 39.64 37.07 1g1a n ILE 59 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1g1a s ASP 61 N -5.54 6.69 0.20 0.00 -1.08 -0.19 -4.87 116.67 111.89 1g1a s ASP 61 Ca 0.08 -2.01 -0.10 0.00 -0.52 0.00 0.00 52.55 50.00 1g1a s ASP 61 Cb 0.08 -2.56 0.26 0.00 -1.46 0.00 0.00 42.92 39.24 1g1a s ASP 61 CO 0.64 -1.30 1.74 0.28 0.52 0.00 0.00 175.17 177.05 1g1a h SER 62 N 8.60 0.17 0.23 -0.34 0.02 -1.85 -0.62 113.55 119.76 1g1a h SER 62 Ca 0.32 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.36 1g1a h SER 62 Cb 0.94 0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.52 1g1a h SER 62 CO 1.42 0.11 -0.37 0.00 -1.14 0.00 0.00 176.83 176.85 1g1a h ALA 63 N 1.41 -0.71 -0.28 3.77 0.00 -1.98 0.35 119.26 121.82 1g1a h ALA 63 Ca 0.29 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1g1a h ALA 63 Cb 0.37 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1g1a h ALA 63 CO -0.31 -0.95 0.15 1.49 0.00 0.00 0.00 179.25 179.63 1g1a h GLU 64 N -0.67 0.30 -0.79 0.00 4.57 -1.88 -1.33 114.58 114.77 1g1a h GLU 64 Ca 0.00 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 1g1a h GLU 64 Cb 0.65 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 1g1a h GLU 64 CO -0.15 0.20 0.42 0.82 -1.18 0.00 0.00 179.01 179.12 1g1a h ILE 65 N 0.31 1.24 -0.58 2.32 1.08 -0.82 -1.21 117.51 119.85 1g1a h ILE 65 Ca 0.11 -0.62 -0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1g1a h ILE 65 Cb 0.02 0.18 -0.03 0.00 -3.07 0.00 0.00 36.82 33.93 1g1a h ILE 65 CO -0.07 0.27 0.34 0.74 -0.69 0.00 0.00 178.15 178.75 1g1a h THR 66 N 1.12 1.17 0.05 -0.27 2.02 0.12 -1.47 112.91 115.66 1g1a h THR 66 Ca 0.28 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 67.08 1g1a h THR 66 Cb 0.05 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1g1a h THR 66 CO -0.04 0.18 -0.12 -0.09 0.37 0.00 0.00 175.52 175.82 1g1a h ARG 67 N 0.78 -0.22 -0.73 6.66 2.43 -0.50 -1.72 114.38 121.08 1g1a h ARG 67 Ca 0.21 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.46 1g1a h ARG 67 Cb -0.01 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.53 1g1a h ARG 67 CO -0.04 -0.15 0.41 0.82 -1.51 0.00 0.00 179.97 179.51 1g1a h ILE 68 N -0.23 0.95 -0.24 1.20 2.04 -0.95 0.71 117.51 120.99 1g1a h ILE 68 Ca 0.03 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1g1a h ILE 68 Cb 0.25 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1g1a h ILE 68 CO -0.08 0.13 0.12 -0.26 0.00 0.00 0.00 178.15 178.06 1g1a h PHE 69 N 0.73 0.35 -0.79 1.37 -1.00 -1.02 0.35 116.94 116.93 1g1a h PHE 69 Ca 0.34 -0.02 -0.00 0.00 2.81 0.00 0.00 57.97 61.10 1g1a h PHE 69 Cb 0.25 -0.11 -0.04 0.00 3.61 0.00 0.00 35.95 39.66 1g1a h PHE 69 CO -0.07 0.33 0.48 1.49 -1.61 0.00 0.00 178.31 178.93 1g1a h GLU 70 N 0.27 1.07 -0.26 1.51 4.57 -0.73 0.12 114.58 121.12 1g1a h GLU 70 Ca 0.08 -0.09 -0.13 0.00 -1.18 0.00 0.00 59.36 58.04 1g1a h GLU 70 Cb 0.11 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.47 1g1a h GLU 70 CO -0.01 0.75 -0.34 0.37 -1.18 0.00 0.00 179.01 178.60 1g1a h GLN 71 N 1.08 0.69 -0.00 1.92 4.15 -0.62 -3.33 115.11 119.00 1g1a h GLN 71 Ca 0.28 -0.40 0.00 0.00 0.77 0.00 0.00 58.65 59.31 1g1a h GLN 71 Cb -0.05 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.67 1g1a h GLN 71 CO -0.05 1.01 -0.70 0.66 -1.93 0.00 0.00 178.83 177.82 1g1a n TYR 72 N -4.24 0.00 -3.80 3.99 4.02 0.09 -5.00 117.16 112.22 1g1a n TYR 72 Ca -0.04 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.57 1g1a n TYR 72 Cb 0.50 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 1g1a n TYR 72 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1g1a n GLN 73 N -1.42 -1.24 -1.93 -0.72 1.13 0.39 -4.85 117.38 108.74 1g1a n GLN 73 Ca 0.05 0.58 -0.37 0.00 -1.94 0.00 0.00 57.00 55.32 1g1a n GLN 73 Cb 0.34 -2.12 0.03 0.00 0.11 0.00 0.00 30.24 28.61 1g1a n GLN 73 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1g1a s PRO 74 N -5.28 3.12 0.08 -1.09 0.02 -1.26 -4.89 135.00 125.69 1g1a s PRO 74 Ca 0.08 2.01 0.22 0.00 0.02 0.00 0.00 61.00 63.34 1g1a s PRO 74 Cb -0.05 -2.13 -0.09 0.00 0.02 0.00 0.00 34.50 32.26 1g1a s PRO 74 CO 0.86 -1.14 0.87 -0.25 -0.33 0.00 0.00 177.00 177.02 1g1a n ASP 75 N -1.22 0.52 -3.47 2.53 9.92 0.95 -4.98 116.55 120.80 1g1a n ASP 75 Ca 0.12 0.01 -0.10 0.00 -0.53 0.00 0.00 54.79 54.29 1g1a n ASP 75 Cb 0.47 1.03 -0.02 0.00 -0.64 0.00 0.00 41.12 41.97 1g1a n ASP 75 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1g1a s ALA 76 N -3.34 -1.67 -0.03 2.24 0.00 -1.11 -3.52 121.76 114.33 1g1a s ALA 76 Ca -0.01 0.64 0.05 0.00 0.00 0.00 0.00 51.96 52.64 1g1a s ALA 76 Cb 0.13 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.95 1g1a s ALA 76 CO 0.83 -0.76 -0.18 0.08 0.00 0.00 0.00 175.76 175.73 1g1a s VAL 77 N -3.52 1.49 -0.22 0.00 1.01 0.04 -0.69 120.40 118.50 1g1a s VAL 77 Ca 0.03 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1g1a s VAL 77 Cb -0.01 -1.26 0.06 0.00 0.00 0.00 0.00 36.38 35.17 1g1a s VAL 77 CO -0.11 0.42 -0.07 -0.04 0.00 0.00 0.00 175.10 175.31 1g1a s MET 78 N -0.22 1.72 -0.52 2.72 -1.94 -0.08 -0.29 119.30 120.69 1g1a s MET 78 Ca 0.02 -0.95 -0.17 0.00 -1.71 0.00 0.00 55.69 52.88 1g1a s MET 78 Cb -0.09 -2.53 0.09 0.00 2.01 0.00 0.00 34.83 34.31 1g1a s MET 78 CO 0.01 -0.55 0.54 -1.58 -0.01 0.00 0.00 175.02 173.42 1g1a s HIS 79 N 1.40 3.16 -0.12 -0.03 2.46 0.22 -1.54 115.29 120.84 1g1a s HIS 79 Ca -0.05 -0.97 0.04 0.00 0.47 0.00 0.00 55.06 54.55 1g1a s HIS 79 Cb -0.18 -3.61 -0.05 0.00 -0.13 0.00 0.00 32.58 28.60 1g1a s HIS 79 CO -0.07 -1.02 0.14 1.28 -2.47 0.00 0.00 174.74 172.61 1g1a n LEU 80 N 5.64 0.11 -4.72 8.88 4.32 -0.95 -1.87 117.00 128.42 1g1a n LEU 80 Ca -0.11 -0.29 -0.42 0.00 -0.02 0.00 0.00 56.01 55.17 1g1a n LEU 80 Cb 0.43 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.20 1g1a n LEU 80 CO 0.53 0.03 1.38 0.00 -1.22 0.00 0.00 177.39 178.11 1g1a s ALA 81 N -1.77 3.95 -0.03 -1.18 0.00 -1.08 -4.73 121.76 116.91 1g1a s ALA 81 Ca 0.00 1.60 -0.29 0.00 0.00 0.00 0.00 51.96 53.27 1g1a s ALA 81 Cb 0.03 -3.70 0.10 0.00 0.00 0.00 0.00 23.12 19.55 1g1a s ALA 81 CO 0.17 -0.93 0.84 0.00 0.00 0.00 0.00 175.76 175.84 1g1a s ALA 82 N 1.21 -1.81 -0.24 0.00 0.00 -1.26 -4.88 121.76 114.78 1g1a s ALA 82 Ca 0.75 1.14 -0.07 0.00 0.00 0.00 0.00 51.96 53.79 1g1a s ALA 82 Cb -0.50 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1g1a s ALA 82 CO 0.32 -0.55 0.06 -2.00 0.00 0.00 0.00 175.76 173.59 1g1a s GLU 83 N -2.35 3.66 0.00 0.00 2.56 -1.26 -4.97 118.70 116.34 1g1a s GLU 83 Ca -0.00 -0.48 0.20 0.00 0.00 0.00 0.00 54.97 54.69 1g1a s GLU 83 Cb -0.01 -3.28 0.05 0.00 2.00 0.00 0.00 34.13 32.89 1g1a s GLU 83 CO -0.04 -0.13 1.03 -1.13 -0.56 0.00 0.00 175.26 174.43 1g1a n SER 84 N 4.74 2.12 -4.65 -1.70 3.41 -1.26 -4.78 113.62 111.50 1g1a n SER 84 Ca -0.16 -1.56 -0.39 0.00 -0.26 0.00 0.00 58.87 56.50 1g1a n SER 84 Cb 0.51 0.33 -0.07 0.00 -0.26 0.00 0.00 64.21 64.72 1g1a n SER 84 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1g1a s HIS 85 N -2.05 3.34 -0.51 7.33 5.65 -1.26 -5.00 115.29 122.80 1g1a s HIS 85 Ca 0.18 0.69 -0.21 0.00 0.25 0.00 0.00 55.06 55.97 1g1a s HIS 85 Cb 0.16 -2.64 0.05 0.00 -1.18 0.00 0.00 32.58 28.96 1g1a s HIS 85 CO 0.42 -0.13 0.73 0.08 -0.65 0.00 0.00 174.74 175.19 1g1a s VAL 86 N 1.74 4.71 0.52 0.89 1.01 -1.26 -4.42 120.40 123.60 1g1a s VAL 86 Ca 0.22 -0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.12 1g1a s VAL 86 Cb -0.15 -4.36 0.04 0.00 0.00 0.00 0.00 36.38 31.91 1g1a s VAL 86 CO 0.09 -0.87 0.52 1.51 0.00 0.00 0.00 175.10 176.35 1g1a s ASP 87 N 2.62 4.89 -0.46 3.32 -4.77 -1.26 -5.11 116.67 115.91 1g1a s ASP 87 Ca 0.21 -0.99 0.06 0.00 -3.30 0.00 0.00 52.55 48.53 1g1a s ASP 87 Cb -0.16 0.13 0.20 0.00 -1.09 0.00 0.00 42.92 42.00 1g1a s ASP 87 CO 0.15 -1.06 0.46 0.54 0.70 0.00 0.00 175.17 175.96 1g1a n ARG 88 N -1.86 0.77 -1.63 2.11 1.74 -1.26 -4.80 116.66 111.72 1g1a n ARG 88 Ca 0.05 -3.48 -0.43 0.00 -0.77 0.00 0.00 57.85 53.22 1g1a n ARG 88 Cb 0.63 -1.64 -0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1g1a n ARG 88 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1g1a n SER 89 N 2.06 1.84 0.00 0.55 2.88 -1.24 -4.96 113.62 114.75 1g1a n SER 89 Ca 0.26 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.96 1g1a n SER 89 Cb 0.48 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 1g1a n SER 89 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1g1a n ILE 90 N 0.13 0.00 0.00 2.46 5.41 -1.26 -4.45 119.36 121.64 1g1a n ILE 90 Ca 0.08 0.86 0.00 0.00 1.00 0.00 0.00 62.75 64.69 1g1a n ILE 90 Cb 0.35 -1.85 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 1g1a n ILE 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1g1a n THR 91 N -1.98 0.00 0.00 1.39 -1.04 -1.26 -4.93 114.28 106.45 1g1a n THR 91 Ca 0.00 1.10 0.00 0.00 -2.04 0.00 0.00 64.05 63.11 1g1a n THR 91 Cb 0.00 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 66.75 1g1a n THR 91 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1g1a n GLY 92 N -0.87 1.54 3.69 3.41 0.00 -1.26 -5.14 105.19 106.56 1g1a n GLY 92 Ca 0.00 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 1g1a n GLY 92 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1g1a n PRO 93 N 0.00 1.62 -3.63 1.61 -0.02 -1.26 -4.56 135.00 128.76 1g1a n PRO 93 Ca 0.00 0.59 -0.36 0.00 -2.02 0.00 0.00 63.50 61.71 1g1a n PRO 93 Cb 0.00 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.05 1g1a n PRO 93 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g1a s ALA 94 N -1.29 3.65 0.33 3.55 0.00 -1.26 -3.70 121.76 123.04 1g1a s ALA 94 Ca 0.67 -0.55 0.12 0.00 0.00 0.00 0.00 51.96 52.20 1g1a s ALA 94 Cb -0.47 -2.29 0.97 0.00 0.00 0.00 0.00 23.12 21.33 1g1a s ALA 94 CO 0.54 0.15 1.71 0.00 0.00 0.00 0.00 175.76 178.16 1g1a h ALA 95 N 6.55 1.90 -0.28 0.00 0.00 -1.90 0.06 119.26 125.59 1g1a h ALA 95 Ca -0.42 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1g1a h ALA 95 Cb 1.16 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1g1a h ALA 95 CO 0.75 -0.41 -0.03 0.27 0.00 0.00 0.00 179.25 179.84 1g1a h PHE 96 N 0.49 0.45 -0.13 0.00 -0.00 -1.86 0.12 116.94 116.00 1g1a h PHE 96 Ca 0.67 -0.04 -0.06 0.00 -0.00 0.00 0.00 57.97 58.54 1g1a h PHE 96 Cb 1.40 -0.13 -0.00 0.00 -0.00 0.00 0.00 35.95 37.22 1g1a h PHE 96 CO -0.01 0.47 -0.14 0.82 -0.00 0.00 0.00 178.31 179.46 1g1a h ILE 97 N 0.42 1.35 0.06 0.88 1.08 -1.38 -1.56 117.51 118.36 1g1a h ILE 97 Ca 0.09 -1.31 0.01 0.00 -0.39 0.00 0.00 64.86 63.26 1g1a h ILE 97 Cb 0.32 1.92 -0.01 0.00 -3.07 0.00 0.00 36.82 35.97 1g1a h ILE 97 CO 0.01 0.38 -0.08 -0.33 -0.69 0.00 0.00 178.15 177.44 1g1a h GLU 98 N -0.06 -0.17 -0.01 2.37 4.39 -1.03 -1.53 114.58 118.55 1g1a h GLU 98 Ca 0.02 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1g1a h GLU 98 Cb 0.67 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1g1a h GLU 98 CO 0.03 -0.11 -0.08 1.15 -1.16 0.00 0.00 179.01 178.84 1g1a h THR 99 N -0.18 1.56 -0.20 1.13 2.02 -0.85 0.38 112.91 116.77 1g1a h THR 99 Ca 0.01 -1.74 -0.19 0.00 0.77 0.00 0.00 66.41 65.26 1g1a h THR 99 Cb 0.18 2.69 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1g1a h THR 99 CO -0.04 0.46 -0.65 0.78 0.37 0.00 0.00 175.52 176.44 1g1a h ASN 100 N -0.62 0.84 0.00 4.18 2.35 -1.36 -3.09 115.58 117.88 1g1a h ASN 100 Ca -0.01 -0.50 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1g1a h ASN 100 Cb 0.80 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.92 1g1a h ASN 100 CO 0.02 1.27 -0.45 -0.38 -1.65 0.00 0.00 177.43 176.24 1g1a n ILE 101 N -3.95 0.68 -0.32 2.81 5.41 -0.61 -3.81 119.36 119.56 1g1a n ILE 101 Ca -0.05 0.34 0.01 0.00 1.00 0.00 0.00 62.75 64.05 1g1a n ILE 101 Cb 0.67 -1.88 0.14 0.00 -0.71 0.00 0.00 39.64 37.86 1g1a n ILE 101 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1g1a h VAL 102 N -0.45 1.05 -0.80 1.39 2.07 -1.31 -0.93 116.25 117.26 1g1a h VAL 102 Ca 0.00 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1g1a h VAL 102 Cb 0.45 -0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 1g1a h VAL 102 CO 0.00 0.18 0.49 1.23 0.02 0.00 0.00 177.57 179.49 1g1a h GLY 103 N 0.99 1.16 1.36 2.17 0.00 -0.15 0.36 103.07 108.96 1g1a h GLY 103 Ca 0.38 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 47.12 1g1a h GLY 103 CO -0.17 0.46 -0.19 -0.84 0.00 0.00 0.00 176.54 175.80 1g1a h THR 104 N 1.10 1.27 -0.27 4.70 2.02 -1.38 -0.13 112.91 120.23 1g1a h THR 104 Ca 0.29 -1.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 1g1a h THR 104 Cb -0.05 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1g1a h THR 104 CO -0.06 0.43 0.08 0.22 0.37 0.00 0.00 175.52 176.56 1g1a h TYR 105 N 0.66 0.44 -0.18 3.16 3.20 -0.50 0.01 116.97 123.75 1g1a h TYR 105 Ca 0.10 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.93 1g1a h TYR 105 Cb 0.68 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1g1a h TYR 105 CO 0.03 0.47 0.10 0.00 -1.64 0.00 0.00 178.16 177.13 1g1a h ALA 106 N 0.91 0.22 -0.79 1.82 0.00 -0.03 -1.60 119.26 119.79 1g1a h ALA 106 Ca 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1g1a h ALA 106 Cb 0.25 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1g1a h ALA 106 CO -0.00 -0.31 0.40 1.25 0.00 0.00 0.00 179.25 180.58 1g1a h LEU 107 N 0.22 1.02 -1.02 0.00 5.85 -0.91 -2.31 115.31 118.16 1g1a h LEU 107 Ca 0.07 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1g1a h LEU 107 Cb -0.01 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 1g1a h LEU 107 CO -0.03 0.86 0.52 -0.07 -0.34 0.00 0.00 178.44 179.37 1g1a h LEU 108 N 1.12 1.06 -0.48 2.25 3.38 -0.58 -0.34 115.31 121.72 1g1a h LEU 108 Ca 0.28 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 58.03 1g1a h LEU 108 Cb 0.09 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1g1a h LEU 108 CO -0.04 0.82 -0.35 -0.33 0.09 0.00 0.00 178.44 178.63 1g1a h GLU 109 N 1.21 0.87 -0.26 1.13 4.39 -0.95 0.23 114.58 121.21 1g1a h GLU 109 Ca 0.31 -0.44 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 1g1a h GLU 109 Cb -0.03 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1g1a h GLU 109 CO -0.06 1.08 0.03 0.28 -1.16 0.00 0.00 179.01 179.19 1g1a h VAL 110 N 0.72 1.24 0.00 3.13 2.07 -1.04 -2.63 116.25 119.74 1g1a h VAL 110 Ca 0.07 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 1g1a h VAL 110 Cb 0.93 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1g1a h VAL 110 CO 0.09 0.26 -0.18 0.00 0.02 0.00 0.00 177.57 177.75 1g1a h ALA 111 N 0.85 1.67 -0.12 1.67 0.00 -0.95 -1.95 119.26 120.44 1g1a h ALA 111 Ca 0.08 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1g1a h ALA 111 Cb 0.35 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1g1a h ALA 111 CO 0.01 0.22 -0.08 -0.09 0.00 0.00 0.00 179.25 179.31 1g1a h ARG 112 N 0.00 0.26 -0.79 0.00 2.43 -0.62 0.02 114.38 115.68 1g1a h ARG 112 Ca -0.00 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1g1a h ARG 112 Cb 0.32 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 1g1a h ARG 112 CO 0.02 0.63 0.43 0.87 -1.51 0.00 0.00 179.97 180.41 1g1a h LYS 113 N -0.11 1.10 0.15 0.20 1.57 -1.29 -0.25 116.57 117.93 1g1a h LYS 113 Ca 0.02 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1g1a h LYS 113 Cb 0.57 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1g1a h LYS 113 CO 0.02 0.82 -0.07 -0.92 -0.57 0.00 0.00 179.45 178.73 1g1a h TYR 114 N 1.10 -0.18 -0.43 -1.35 3.20 -1.33 -2.72 116.97 115.25 1g1a h TYR 114 Ca 0.28 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.16 1g1a h TYR 114 Cb 0.04 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1g1a h TYR 114 CO 0.00 0.01 0.26 2.35 -1.64 0.00 0.00 178.16 179.14 1g1a h TRP 115 N -0.34 0.50 0.00 -3.82 7.01 -0.72 -2.48 115.95 116.09 1g1a h TRP 115 Ca -0.02 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.99 1g1a h TRP 115 Cb 0.27 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.17 1g1a h TRP 115 CO -0.02 0.30 0.00 0.66 -2.79 0.00 0.00 178.44 176.58 1g1a h SER 116 N 0.53 0.00 -0.51 2.65 4.64 -1.02 -2.39 113.55 117.45 1g1a h SER 116 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1g1a h SER 116 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1g1a h SER 116 CO -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.90 1g1a n ALA 117 N -1.89 2.93 -2.18 5.18 0.00 -0.94 -4.93 120.51 118.68 1g1a n ALA 117 Ca 0.01 -1.21 -0.22 0.00 0.00 0.00 0.00 53.44 52.03 1g1a n ALA 117 Cb 0.24 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.70 1g1a n ALA 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1g1a s LEU 118 N -1.50 3.52 0.05 0.00 1.43 -0.90 -5.07 118.68 116.21 1g1a s LEU 118 Ca 0.40 0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 53.44 1g1a s LEU 118 Cb 0.25 -3.02 -0.06 0.00 0.03 0.00 0.00 46.19 43.39 1g1a s LEU 118 CO 0.20 -0.86 0.54 -0.83 0.23 0.00 0.00 176.35 175.63 1g1a s GLY 119 N -4.30 2.63 0.00 -3.19 0.00 -1.26 -4.78 107.32 96.42 1g1a s GLY 119 Ca 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1g1a s GLY 119 CO 0.38 0.44 0.00 -2.21 0.00 0.00 0.00 173.10 171.71 1g1a n GLU 120 N 1.85 0.00 0.14 2.90 2.13 -1.26 -1.10 120.64 125.30 1g1a n GLU 120 Ca -0.11 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.66 1g1a n GLU 120 Cb 0.51 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.19 1g1a n GLU 120 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1g1a h ASP 121 N 0.00 -0.31 -0.12 4.31 3.32 -2.00 -2.30 116.42 119.32 1g1a h ASP 121 Ca 0.00 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.10 1g1a h ASP 121 Cb 0.00 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1g1a h ASP 121 CO 0.00 -0.18 0.12 0.50 -1.72 0.00 0.00 179.24 177.95 1g1a h LYS 122 N -0.45 0.00 -0.01 3.56 3.64 -1.52 -1.22 116.57 120.57 1g1a h LYS 122 Ca -0.04 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 1g1a h LYS 122 Cb 0.28 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1g1a h LYS 122 CO 0.06 0.00 -0.73 -0.22 -2.27 0.00 0.00 179.45 176.30 1g1a h LYS 123 N 0.00 0.05 0.00 1.90 3.64 -1.11 -2.22 116.57 118.83 1g1a h LYS 123 Ca 0.06 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1g1a h LYS 123 Cb 0.29 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1g1a h LYS 123 CO -0.00 0.75 -0.29 0.09 -2.27 0.00 0.00 179.45 177.74 1g1a n ASN 124 N -3.70 0.77 -0.00 4.20 3.02 -0.48 -3.70 115.26 115.36 1g1a n ASN 124 Ca -0.01 0.37 0.10 0.00 -0.03 0.00 0.00 54.58 55.01 1g1a n ASN 124 Cb 0.71 -0.36 -0.14 0.00 -0.61 0.00 0.00 39.78 39.37 1g1a n ASN 124 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1g1a n ASN 125 N -2.20 0.61 -4.74 6.41 3.02 -1.07 -4.98 115.26 112.31 1g1a n ASN 125 Ca 0.04 -0.59 -0.37 0.00 -0.03 0.00 0.00 54.58 53.64 1g1a n ASN 125 Cb 0.44 1.40 0.06 0.00 -0.61 0.00 0.00 39.78 41.07 1g1a n ASN 125 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1g1a s PHE 126 N -3.19 2.15 -0.10 3.10 5.36 -0.85 -4.93 117.98 119.52 1g1a s PHE 126 Ca 0.01 1.47 -0.07 0.00 -0.96 0.00 0.00 56.93 57.38 1g1a s PHE 126 Cb 0.15 -3.69 0.04 0.00 -0.34 0.00 0.00 43.02 39.18 1g1a s PHE 126 CO 0.88 -2.84 0.26 1.03 -1.46 0.00 0.00 175.22 173.09 1g1a s ARG 127 N -3.29 0.27 -0.39 10.12 1.81 -1.23 -4.72 118.95 121.52 1g1a s ARG 127 Ca 0.80 0.46 -0.01 0.00 -1.72 0.00 0.00 55.73 55.25 1g1a s ARG 127 Cb -0.37 0.03 0.10 0.00 -0.45 0.00 0.00 34.95 34.26 1g1a s ARG 127 CO 0.40 -0.10 0.16 0.12 -0.68 0.00 0.00 175.30 175.21 1g1a s PHE 128 N 0.67 3.60 -0.31 -0.53 2.19 -0.00 -0.78 117.98 122.82 1g1a s PHE 128 Ca -0.04 -2.49 -0.14 0.00 0.33 0.00 0.00 56.93 54.59 1g1a s PHE 128 Cb -0.06 -3.09 -0.03 0.00 -1.31 0.00 0.00 43.02 38.54 1g1a s PHE 128 CO -0.04 -0.96 0.31 -1.58 1.83 0.00 0.00 175.22 174.78 1g1a s HIS 129 N 1.10 3.22 -0.24 10.12 5.65 0.61 -0.86 115.29 134.89 1g1a s HIS 129 Ca 0.08 0.11 -0.10 0.00 0.25 0.00 0.00 55.06 55.39 1g1a s HIS 129 Cb -0.22 -2.55 -0.05 0.00 -1.18 0.00 0.00 32.58 28.58 1g1a s HIS 129 CO -0.05 -0.30 0.16 -1.58 -0.65 0.00 0.00 174.74 172.32 1g1a s HIS 130 N 1.94 3.30 -0.23 3.88 2.46 0.30 -0.61 115.29 126.32 1g1a s HIS 130 Ca 0.11 0.20 -0.16 0.00 0.47 0.00 0.00 55.06 55.68 1g1a s HIS 130 Cb -0.16 -2.28 -0.04 0.00 -0.13 0.00 0.00 32.58 29.97 1g1a s HIS 130 CO 0.11 0.03 0.41 0.42 -2.47 0.00 0.00 174.74 173.24 1g1a s ILE 131 N 1.14 5.17 0.36 0.89 1.09 -0.78 -1.87 121.20 127.20 1g1a s ILE 131 Ca 0.07 0.68 0.05 0.00 -1.10 0.00 0.00 60.65 60.36 1g1a s ILE 131 Cb -0.14 -3.73 -0.02 0.00 -1.06 0.00 0.00 42.46 37.51 1g1a s ILE 131 CO 0.05 0.20 0.17 -0.24 -0.10 0.00 0.00 174.94 175.02 1g1a n SER 132 N 4.90 0.65 -4.73 3.58 2.88 0.17 -4.85 113.62 116.23 1g1a n SER 132 Ca -0.08 -3.03 -0.25 0.00 -1.33 0.00 0.00 58.87 54.19 1g1a n SER 132 Cb 0.51 1.14 -0.06 0.00 -0.75 0.00 0.00 64.21 65.04 1g1a n SER 132 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1g1a s THR 133 N -3.06 4.05 -0.85 2.46 -1.32 -1.26 -1.69 115.64 113.96 1g1a s THR 133 Ca 0.25 -1.41 0.21 0.00 -1.21 0.00 0.00 61.69 59.53 1g1a s THR 133 Cb 0.01 -3.10 0.20 0.00 -1.51 0.00 0.00 72.50 68.10 1g1a s THR 133 CO 0.17 -0.21 1.67 -0.90 -2.21 0.00 0.00 174.62 173.14 1g1a n ASP 134 N -0.54 0.25 0.30 8.08 5.75 -0.01 -3.07 116.55 127.30 1g1a n ASP 134 Ca -0.08 0.55 0.17 0.00 -0.01 0.00 0.00 54.79 55.42 1g1a n ASP 134 Cb 0.56 -0.61 0.95 0.00 -1.03 0.00 0.00 41.12 41.00 1g1a n ASP 134 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1g1a h GLU 135 N 0.00 0.00 -0.01 0.11 5.08 -1.90 -2.29 114.58 115.57 1g1a h GLU 135 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1g1a h GLU 135 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1g1a h GLU 135 CO 0.00 0.03 0.01 -0.39 -1.00 0.00 0.00 179.01 177.67 1g1a h VAL 136 N 0.00 0.56 0.00 3.13 -1.51 -1.82 -2.27 116.25 114.34 1g1a h VAL 136 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1g1a h VAL 136 Cb 0.13 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 30.28 1g1a h VAL 136 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 1g1a n TYR 137 N -3.90 0.00 -1.27 5.19 4.01 -0.86 -0.16 117.16 120.16 1g1a n TYR 137 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1g1a n TYR 137 Cb 0.10 -0.37 0.00 0.00 -0.31 0.00 0.00 39.34 38.76 1g1a n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1g1a n GLY 138 N 0.82 0.67 3.43 2.72 0.00 -0.85 -4.08 105.19 107.90 1g1a n GLY 138 Ca 0.09 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.71 1g1a n GLY 138 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1g1a s ASP 139 N -4.00 3.15 0.24 1.61 -1.08 -1.26 -4.89 116.67 110.44 1g1a s ASP 139 Ca 0.00 -1.07 0.10 0.00 -0.52 0.00 0.00 52.55 51.06 1g1a s ASP 139 Cb 0.00 -0.23 -0.04 0.00 -1.46 0.00 0.00 42.92 41.18 1g1a s ASP 139 CO 0.00 -0.11 -0.05 -0.76 0.52 0.00 0.00 175.17 174.77 1g1a s LEU 140 N -3.45 3.07 0.32 -1.34 1.43 -0.89 -5.03 118.68 112.79 1g1a s LEU 140 Ca 0.28 -0.66 -0.29 0.00 -1.03 0.00 0.00 54.13 52.44 1g1a s LEU 140 Cb -0.01 -1.65 -0.13 0.00 0.03 0.00 0.00 46.19 44.43 1g1a s LEU 140 CO 0.12 0.04 1.28 -2.65 0.23 0.00 0.00 176.35 175.37 1g1a n PRO 141 N -0.58 2.03 -3.20 1.29 -0.02 -1.26 -4.31 135.00 128.95 1g1a n PRO 141 Ca -0.08 0.71 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 1g1a n PRO 141 Cb 0.58 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 1g1a n PRO 141 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1g1a s HIS 142 N -0.92 3.45 0.48 6.00 2.46 -1.26 -4.88 115.29 120.63 1g1a s HIS 142 Ca 0.58 0.86 0.23 0.00 0.47 0.00 0.00 55.06 57.21 1g1a s HIS 142 Cb -0.60 -2.28 1.27 0.00 -0.13 0.00 0.00 32.58 30.85 1g1a s HIS 142 CO 0.60 0.11 1.91 -1.35 -2.47 0.00 0.00 174.74 173.53 1g1a h PRO 143 N 1.81 0.19 -0.77 2.88 0.11 -1.94 -1.31 132.00 132.96 1g1a h PRO 143 Ca -0.47 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 1g1a h PRO 143 Cb 1.18 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1g1a h PRO 143 CO 0.66 0.12 0.07 -0.40 -0.21 0.00 0.00 178.00 178.25 1g1a n ASP 144 N -4.40 4.01 0.00 -2.05 3.85 -1.26 -3.52 116.55 113.18 1g1a n ASP 144 Ca 0.16 -2.68 0.00 0.00 -0.71 0.00 0.00 54.79 51.56 1g1a n ASP 144 Cb 0.73 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.86 1g1a n ASP 144 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1g1a n GLU 145 N 0.25 3.77 -3.54 0.11 1.02 -0.50 -4.93 120.64 116.81 1g1a n GLU 145 Ca 0.22 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.99 1g1a n GLU 145 Cb 0.94 -0.98 -0.08 0.00 -0.02 0.00 0.00 31.44 31.30 1g1a n GLU 145 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1g1a s VAL 146 N -1.97 5.30 0.37 2.62 1.01 -1.16 -5.02 120.40 121.56 1g1a s VAL 146 Ca 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 61.98 62.38 1g1a s VAL 146 Cb 0.00 -3.62 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 1g1a s VAL 146 CO 0.00 0.36 0.72 -0.70 0.00 0.00 0.00 175.10 175.48 1g1a s GLU 147 N 0.73 3.76 0.00 2.72 2.56 -1.26 -4.84 118.70 122.37 1g1a s GLU 147 Ca 0.15 0.38 0.00 0.00 0.00 0.00 0.00 54.97 55.49 1g1a s GLU 147 Cb -0.13 -2.45 0.00 0.00 2.00 0.00 0.00 34.13 33.55 1g1a s GLU 147 CO 0.04 0.03 0.00 0.09 -0.56 0.00 0.00 175.26 174.86 1g1a n ASN 148 N -1.17 0.00 -3.56 -1.70 3.02 -1.26 -3.68 115.26 106.90 1g1a n ASN 148 Ca 0.02 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.38 1g1a n ASN 148 Cb 0.54 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.66 1g1a n ASN 148 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1g1a n SER 149 N 0.00 0.26 -4.39 6.41 3.41 -1.26 -4.95 113.62 113.10 1g1a n SER 149 Ca 0.00 -0.72 -0.35 0.00 -0.26 0.00 0.00 58.87 57.54 1g1a n SER 149 Cb 0.00 -0.89 -0.13 0.00 -0.26 0.00 0.00 64.21 62.92 1g1a n SER 149 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1g1a s VAL 150 N -3.82 3.78 -0.12 -3.33 1.01 -1.24 -5.06 120.40 111.62 1g1a s VAL 150 Ca 0.03 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 1g1a s VAL 150 Cb -0.02 -2.73 -0.08 0.00 0.00 0.00 0.00 36.38 33.56 1g1a s VAL 150 CO 0.56 0.41 2.10 0.41 0.00 0.00 0.00 175.10 178.58 1g1a n THR 151 N 4.61 0.52 -2.33 3.92 -1.04 -1.26 -4.94 114.28 113.75 1g1a n THR 151 Ca -0.17 -0.30 -0.36 0.00 -2.04 0.00 0.00 64.05 61.18 1g1a n THR 151 Cb 0.51 -2.35 -0.02 0.00 -1.82 0.00 0.00 70.33 66.66 1g1a n THR 151 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1g1a s LEU 152 N 6.42 3.98 0.65 -4.42 1.43 -1.26 -5.03 118.68 120.45 1g1a s LEU 152 Ca 0.96 2.21 -0.16 0.00 -1.03 0.00 0.00 54.13 56.11 1g1a s LEU 152 Cb -0.44 -4.31 -0.01 0.00 0.03 0.00 0.00 46.19 41.46 1g1a s LEU 152 CO 0.40 -0.88 1.12 -2.84 0.23 0.00 0.00 176.35 174.38 1g1a s PRO 153 N -2.80 2.84 0.21 1.29 0.02 -1.26 -5.08 135.00 130.21 1g1a s PRO 153 Ca 0.64 1.45 0.07 0.00 0.02 0.00 0.00 61.00 63.18 1g1a s PRO 153 Cb -0.26 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 1g1a s PRO 153 CO 0.31 -1.23 -0.12 -0.51 -0.33 0.00 0.00 177.00 175.12 1g1a s LEU 154 N -4.73 2.52 -0.13 -5.54 1.43 -1.26 -4.89 118.68 106.08 1g1a s LEU 154 Ca 0.68 -1.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.44 1g1a s LEU 154 Cb -0.22 -0.60 -0.01 0.00 0.03 0.00 0.00 46.19 45.40 1g1a s LEU 154 CO 0.40 -0.24 1.02 -0.36 0.23 0.00 0.00 176.35 177.40 1g1a s PHE 155 N -3.06 3.47 0.39 0.29 2.99 -0.36 -4.84 117.98 116.86 1g1a s PHE 155 Ca 0.23 1.56 0.05 0.00 0.00 0.00 0.00 56.93 58.77 1g1a s PHE 155 Cb 0.01 -3.21 -0.07 0.00 0.00 0.00 0.00 43.02 39.75 1g1a s PHE 155 CO 0.07 -0.31 0.03 0.95 -0.00 0.00 0.00 175.22 175.96 1g1a s THR 156 N 2.26 1.63 -0.67 0.64 -4.23 -1.26 -1.23 115.64 112.78 1g1a s THR 156 Ca 0.48 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.10 1g1a s THR 156 Cb -0.18 -2.86 0.11 0.00 1.34 0.00 0.00 72.50 70.91 1g1a s THR 156 CO 0.16 0.00 1.36 -0.62 -0.54 0.00 0.00 174.62 174.97 1g1a n GLU 157 N -0.89 0.07 -0.25 3.99 4.71 -1.26 -1.65 120.64 125.36 1g1a n GLU 157 Ca -0.05 0.51 0.06 0.00 -0.01 0.00 0.00 57.16 57.68 1g1a n GLU 157 Cb 0.67 -1.70 0.18 0.00 -1.01 0.00 0.00 31.44 29.58 1g1a n GLU 157 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1g1a n THR 158 N -1.84 1.26 -2.29 2.62 -2.24 -1.26 -4.98 114.28 105.55 1g1a n THR 158 Ca 0.00 -1.17 -0.41 0.00 -2.27 0.00 0.00 64.05 60.21 1g1a n THR 158 Cb 0.06 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 1g1a n THR 158 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1g1a s THR 159 N -1.36 3.14 0.36 4.28 2.01 -0.66 -4.97 115.64 118.43 1g1a s THR 159 Ca 0.28 1.11 -0.28 0.00 0.31 0.00 0.00 61.69 63.12 1g1a s THR 159 Cb 0.17 -3.71 -0.10 0.00 0.01 0.00 0.00 72.50 68.87 1g1a s THR 159 CO 0.15 0.25 1.32 0.00 -0.69 0.00 0.00 174.62 175.66 1g1a s ALA 160 N -0.99 3.44 0.30 7.40 0.00 -1.26 -4.96 121.76 125.69 1g1a s ALA 160 Ca 0.48 1.28 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 1g1a s ALA 160 Cb -0.36 -3.49 -0.10 0.00 0.00 0.00 0.00 23.12 19.17 1g1a s ALA 160 CO 0.46 -0.72 1.19 0.71 0.00 0.00 0.00 175.76 177.40 1g1a s TYR 161 N -1.17 3.35 -0.46 0.00 1.51 -1.26 -4.61 117.35 114.70 1g1a s TYR 161 Ca 0.51 1.57 0.05 0.00 -1.01 0.00 0.00 57.07 58.18 1g1a s TYR 161 Cb -0.40 -3.46 0.24 0.00 -0.11 0.00 0.00 41.96 38.23 1g1a s TYR 161 CO 0.53 -1.14 0.94 0.00 -1.11 0.00 0.00 175.55 174.76 1g1a n ALA 162 N 1.08 -1.84 -1.70 3.71 0.00 0.77 -4.93 120.51 117.60 1g1a n ALA 162 Ca -0.00 -1.17 -0.44 0.00 0.00 0.00 0.00 53.44 51.83 1g1a n ALA 162 Cb 0.43 -1.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 1g1a n ALA 162 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1g1a n PRO 163 N 1.74 2.56 0.00 0.00 -0.02 -1.20 -2.34 135.00 135.74 1g1a n PRO 163 Ca 0.08 0.92 0.04 0.00 -2.02 0.00 0.00 63.50 62.53 1g1a n PRO 163 Cb 0.64 -2.75 0.03 0.00 -0.02 0.00 0.00 33.50 31.40 1g1a n PRO 163 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1g1a n SER 164 N 4.11 1.59 -4.33 2.55 3.41 -1.26 -4.83 113.62 114.86 1g1a n SER 164 Ca 0.17 -1.30 -0.18 0.00 -0.26 0.00 0.00 58.87 57.31 1g1a n SER 164 Cb 0.33 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.21 1g1a n SER 164 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1g1a s SER 165 N -0.67 2.27 0.24 4.04 1.04 -1.26 -5.02 113.70 114.35 1g1a s SER 165 Ca 0.09 -1.09 -0.05 0.00 0.48 0.00 0.00 55.95 55.38 1g1a s SER 165 Cb 0.06 -0.08 0.31 0.00 0.10 0.00 0.00 66.02 66.41 1g1a s SER 165 CO 0.10 -0.31 1.88 -0.65 0.98 0.00 0.00 173.24 175.24 1g1a h PRO 166 N 2.55 1.07 0.42 4.02 0.11 -1.98 0.86 132.00 139.04 1g1a h PRO 166 Ca -0.38 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1g1a h PRO 166 Cb 1.22 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1g1a h PRO 166 CO 0.64 0.71 -0.20 -0.92 -0.21 0.00 0.00 178.00 178.01 1g1a h TYR 167 N 1.10 -0.53 -0.51 0.65 3.20 -1.96 0.13 116.97 119.05 1g1a h TYR 167 Ca 0.37 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.20 1g1a h TYR 167 Cb 0.07 0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 1g1a h TYR 167 CO -0.02 -0.32 0.19 0.66 -1.64 0.00 0.00 178.16 177.04 1g1a h SER 168 N -0.59 0.66 -0.57 -2.11 4.64 -1.89 -1.32 113.55 112.37 1g1a h SER 168 Ca -0.06 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.17 1g1a h SER 168 Cb 0.45 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 1g1a h SER 168 CO 0.10 0.61 0.33 0.00 -0.87 0.00 0.00 176.83 176.99 1g1a h ALA 169 N 1.49 0.73 -0.62 5.18 0.00 -0.50 0.56 119.26 126.10 1g1a h ALA 169 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1g1a h ALA 169 Cb 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1g1a h ALA 169 CO -0.02 0.23 0.19 0.66 0.00 0.00 0.00 179.25 180.32 1g1a h SER 170 N 0.77 0.87 -0.37 0.00 4.64 0.09 -1.71 113.55 117.84 1g1a h SER 170 Ca 0.20 -0.15 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1g1a h SER 170 Cb 0.02 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 1g1a h SER 170 CO -0.04 0.82 -0.23 0.11 -0.87 0.00 0.00 176.83 176.63 1g1a h LYS 171 N 0.91 0.81 -0.92 4.77 1.79 -0.77 -2.36 116.57 120.80 1g1a h LYS 171 Ca 0.20 -0.37 0.08 0.00 -2.18 0.00 0.00 60.65 58.38 1g1a h LYS 171 Cb 0.26 -0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 30.83 1g1a h LYS 171 CO -0.01 1.00 0.57 0.00 -1.08 0.00 0.00 179.45 179.94 1g1a h ALA 172 N 0.79 1.31 -0.29 3.86 0.00 -0.65 -0.59 119.26 123.69 1g1a h ALA 172 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1g1a h ALA 172 Cb 0.79 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1g1a h ALA 172 CO 0.06 0.27 0.13 0.77 0.00 0.00 0.00 179.25 180.48 1g1a h SER 173 N 0.99 0.38 -0.43 0.00 0.02 -1.10 -1.58 113.55 111.84 1g1a h SER 173 Ca 0.42 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 1g1a h SER 173 Cb 0.29 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1g1a h SER 173 CO -0.21 0.42 0.25 0.77 -1.14 0.00 0.00 176.83 176.92 1g1a h SER 174 N 0.32 0.53 -0.38 3.07 4.64 -0.86 -0.84 113.55 120.03 1g1a h SER 174 Ca 0.10 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1g1a h SER 174 Cb 0.15 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1g1a h SER 174 CO -0.01 0.42 0.23 0.44 -0.87 0.00 0.00 176.83 177.05 1g1a h ASP 175 N 0.61 0.46 -0.78 4.97 5.19 -0.44 -1.28 116.42 125.14 1g1a h ASP 175 Ca 0.16 -0.05 -0.03 0.00 -0.62 0.00 0.00 57.03 56.49 1g1a h ASP 175 Cb 0.00 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 39.36 1g1a h ASP 175 CO -0.03 0.38 0.39 0.45 -3.12 0.00 0.00 179.24 177.31 1g1a h HIS 176 N 0.51 1.11 -0.45 4.55 3.86 -0.34 -1.90 115.15 122.49 1g1a h HIS 176 Ca 0.14 -0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1g1a h HIS 176 Cb -0.00 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.10 1g1a h HIS 176 CO -0.04 0.80 0.20 -0.07 0.86 0.00 0.00 177.93 179.69 1g1a h LEU 177 N 1.10 0.59 -0.93 2.43 3.38 -0.81 -0.95 115.31 120.12 1g1a h LEU 177 Ca 0.27 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1g1a h LEU 177 Cb 0.09 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1g1a h LEU 177 CO -0.04 0.57 0.62 0.58 0.09 0.00 0.00 178.44 180.26 1g1a h VAL 178 N 0.58 1.23 -0.14 1.22 2.07 -0.88 -2.07 116.25 118.26 1g1a h VAL 178 Ca 0.15 -0.43 -0.19 0.00 0.82 0.00 0.00 66.70 67.05 1g1a h VAL 178 Cb 0.14 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1g1a h VAL 178 CO -0.02 0.23 -0.69 0.03 0.02 0.00 0.00 177.57 177.14 1g1a h ARG 179 N 1.25 0.58 -0.52 1.57 3.08 -1.09 -3.15 114.38 116.10 1g1a h ARG 179 Ca 0.35 -0.44 -0.08 0.00 0.07 0.00 0.00 59.98 59.88 1g1a h ARG 179 Cb -0.13 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1g1a h ARG 179 CO -0.08 1.06 0.02 0.00 -1.07 0.00 0.00 179.97 179.90 1g1a h ALA 180 N 0.82 1.05 -0.04 0.04 0.00 -0.96 -1.71 119.26 118.47 1g1a h ALA 180 Ca -0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1g1a h ALA 180 Cb 1.28 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1g1a h ALA 180 CO 0.13 0.60 -0.18 -1.49 0.00 0.00 0.00 179.25 178.31 1g1a h TRP 181 N 0.81 0.06 0.17 0.00 6.55 -1.40 0.45 115.95 122.59 1g1a h TRP 181 Ca 0.16 -0.01 -0.01 0.00 0.95 0.00 0.00 58.89 59.98 1g1a h TRP 181 Cb 0.46 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 1g1a h TRP 181 CO 0.03 0.24 -0.08 -0.09 -1.05 0.00 0.00 178.44 177.48 1g1a h ARG 182 N 0.05 -0.22 0.00 0.49 9.65 -1.39 0.14 114.38 123.11 1g1a h ARG 182 Ca 0.01 0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 58.84 1g1a h ARG 182 Cb 0.35 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 1g1a h ARG 182 CO 0.02 0.20 -0.29 0.00 2.80 0.00 0.00 179.97 182.71 1g1a h ARG 183 N -0.76 0.00 0.07 0.20 3.08 -1.05 0.30 114.38 116.21 1g1a h ARG 183 Ca -0.02 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.67 1g1a h ARG 183 Cb 0.52 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 1g1a h ARG 183 CO 0.04 0.29 -2.09 2.41 -1.07 0.00 0.00 179.97 179.54 1g1a n THR 184 N -3.71 1.66 0.23 2.04 -1.04 0.16 -4.58 114.28 109.04 1g1a n THR 184 Ca -0.01 -0.68 0.03 0.00 -2.04 0.00 0.00 64.05 61.35 1g1a n THR 184 Cb 0.39 -1.45 -0.00 0.00 -1.82 0.00 0.00 70.33 67.45 1g1a n THR 184 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1g1a n TYR 185 N -3.31 0.00 -0.94 -1.42 4.01 0.01 -4.99 117.16 110.53 1g1a n TYR 185 Ca -0.33 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 1g1a n TYR 185 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.07 1g1a n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1g1a n GLY 186 N 0.74 0.63 3.73 2.72 0.00 0.10 -4.98 105.19 108.12 1g1a n GLY 186 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1g1a n GLY 186 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1g1a n LEU 187 N 0.00 4.02 -3.50 0.99 7.94 -1.16 -4.86 117.00 120.43 1g1a n LEU 187 Ca 0.00 1.18 -0.39 0.00 -1.11 0.00 0.00 56.01 55.70 1g1a n LEU 187 Cb 0.00 -1.54 -0.06 0.00 0.53 0.00 0.00 43.42 42.34 1g1a n LEU 187 CO 0.00 -0.14 1.93 -2.65 -1.11 0.00 0.00 177.39 175.42 1g1a n PRO 188 N 1.25 1.12 -4.00 1.96 -0.02 -1.26 -4.17 135.00 129.87 1g1a n PRO 188 Ca 0.06 -1.52 -0.24 0.00 -2.02 0.00 0.00 63.50 59.79 1g1a n PRO 188 Cb 0.36 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.10 1g1a n PRO 188 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1g1a s THR 189 N 5.30 5.04 0.02 3.45 -4.23 -1.26 -0.82 115.64 123.14 1g1a s THR 189 Ca 0.55 -0.96 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 1g1a s THR 189 Cb 0.13 -3.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.30 1g1a s THR 189 CO 0.15 -0.21 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.34 1g1a s ILE 190 N -1.88 0.28 -0.06 2.99 1.01 -0.04 -0.76 121.20 122.74 1g1a s ILE 190 Ca 0.34 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 60.31 1g1a s ILE 190 Cb -0.10 -0.35 0.01 0.00 0.01 0.00 0.00 42.46 42.03 1g1a s ILE 190 CO 0.27 -0.28 -0.13 -0.69 0.00 0.00 0.00 174.94 174.11 1g1a s VAL 191 N -0.97 1.21 -0.02 2.92 1.01 -1.03 -0.54 120.40 122.98 1g1a s VAL 191 Ca -0.08 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.42 1g1a s VAL 191 Cb -0.07 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 1g1a s VAL 191 CO -0.00 0.37 -0.22 0.42 0.00 0.00 0.00 175.10 175.66 1g1a s THR 192 N 0.51 1.76 -0.13 3.92 -4.23 -0.78 -1.10 115.64 115.58 1g1a s THR 192 Ca -0.12 -0.95 0.03 0.00 -1.18 0.00 0.00 61.69 59.46 1g1a s THR 192 Cb -0.15 -1.47 0.01 0.00 1.34 0.00 0.00 72.50 72.24 1g1a s THR 192 CO 0.04 0.50 -0.22 0.20 -0.54 0.00 0.00 174.62 174.60 1g1a s ASN 193 N -0.50 3.08 0.30 3.99 -0.87 -0.52 0.45 114.94 120.87 1g1a s ASN 193 Ca 0.08 -0.59 0.08 0.00 -1.57 0.00 0.00 52.86 50.86 1g1a s ASN 193 Cb -0.09 -1.43 -0.06 0.00 -0.02 0.00 0.00 41.25 39.66 1g1a s ASN 193 CO -0.01 0.09 -0.08 0.00 -2.57 0.00 0.00 177.10 174.53 1g1a n SER 195 N -0.64 0.00 -4.70 0.00 3.41 -0.92 -0.83 113.62 109.93 1g1a n SER 195 Ca -0.05 -0.83 -0.42 0.00 -0.26 0.00 0.00 58.87 57.31 1g1a n SER 195 Cb 0.63 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.55 1g1a n SER 195 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1g1a s ASN 196 N -1.00 6.48 0.23 4.04 -0.87 -0.98 -4.77 114.94 118.07 1g1a s ASN 196 Ca 0.00 2.71 -0.03 0.00 -1.57 0.00 0.00 52.86 53.97 1g1a s ASN 196 Cb 0.00 -2.58 -0.05 0.00 -0.02 0.00 0.00 41.25 38.60 1g1a s ASN 196 CO 0.00 -0.93 0.46 0.20 -2.57 0.00 0.00 177.10 174.25 1g1a s ASN 197 N 1.88 6.43 0.14 -1.22 0.02 -1.26 0.08 114.94 121.00 1g1a s ASN 197 Ca 0.76 0.55 -0.15 0.00 -1.02 0.00 0.00 52.86 53.00 1g1a s ASN 197 Cb -0.45 -2.07 0.02 0.00 0.02 0.00 0.00 41.25 38.76 1g1a s ASN 197 CO 0.33 -0.09 0.38 -0.72 0.02 0.00 0.00 177.10 177.02 1g1a s TYR 198 N -1.93 -0.07 -5.00 2.20 1.13 -0.86 -4.88 117.35 107.93 1g1a s TYR 198 Ca 0.41 -0.27 0.00 0.00 -1.41 0.00 0.00 57.07 55.80 1g1a s TYR 198 Cb -0.11 0.21 0.00 0.00 -1.10 0.00 0.00 41.96 40.96 1g1a s TYR 198 CO 0.29 -0.72 0.00 0.41 -2.51 0.00 0.00 175.55 173.01 1g1a n GLY 199 N -0.22 0.89 3.74 5.49 0.00 -1.26 -0.81 105.19 113.02 1g1a n GLY 199 Ca -0.14 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 1g1a n GLY 199 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1g1a n PRO 200 N 0.00 1.65 -1.30 1.61 -0.02 -1.26 -3.36 135.00 132.32 1g1a n PRO 200 Ca 0.00 0.61 -0.10 0.00 -2.02 0.00 0.00 63.50 61.99 1g1a n PRO 200 Cb 0.00 -2.58 -0.04 0.00 -0.02 0.00 0.00 33.50 30.85 1g1a n PRO 200 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1g1a n TYR 201 N -1.11 0.00 -2.90 6.00 4.02 -1.26 -5.00 117.16 116.90 1g1a n TYR 201 Ca 0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.59 1g1a n TYR 201 Cb 0.45 -2.02 -0.05 0.00 -0.02 0.00 0.00 39.34 37.71 1g1a n TYR 201 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1g1a s HIS 202 N -2.36 3.71 0.43 -0.72 2.46 -1.21 -4.73 115.29 112.87 1g1a s HIS 202 Ca 0.00 1.53 -0.24 0.00 0.47 0.00 0.00 55.06 56.82 1g1a s HIS 202 Cb 0.00 -2.91 -0.10 0.00 -0.13 0.00 0.00 32.58 29.44 1g1a s HIS 202 CO 0.00 0.19 1.15 1.19 -2.47 0.00 0.00 174.74 174.79 1g1a n PHE 203 N 3.12 1.66 -0.34 3.88 3.01 -1.26 -4.88 117.46 122.65 1g1a n PHE 203 Ca -0.00 0.52 0.27 0.00 1.01 0.00 0.00 57.45 59.26 1g1a n PHE 203 Cb 0.50 -2.30 0.57 0.00 -0.01 0.00 0.00 39.48 38.25 1g1a n PHE 203 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1g1a h PRO 204 N 1.74 0.26 -0.00 -1.08 0.11 -1.93 -1.31 132.00 129.79 1g1a h PRO 204 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1g1a h PRO 204 Cb 1.32 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1g1a h PRO 204 CO 0.58 0.17 -0.08 0.39 -0.21 0.00 0.00 178.00 178.86 1g1a n GLU 205 N -4.56 0.31 -1.58 1.05 -0.58 -1.26 -2.90 120.64 111.11 1g1a n GLU 205 Ca 0.27 -0.05 -0.33 0.00 -0.42 0.00 0.00 57.16 56.63 1g1a n GLU 205 Cb 1.04 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 30.48 1g1a n GLU 205 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1g1a s LYS 206 N -2.73 2.52 0.02 3.49 -0.14 -0.50 -4.69 119.74 117.72 1g1a s LYS 206 Ca 0.22 1.44 -0.05 0.00 -1.36 0.00 0.00 55.97 56.21 1g1a s LYS 206 Cb 0.20 -1.91 -0.02 0.00 -1.68 0.00 0.00 37.83 34.42 1g1a s LYS 206 CO 0.51 -1.47 1.09 1.25 -0.76 0.00 0.00 175.35 175.97 1g1a h LEU 207 N -0.27 -0.34 -0.02 3.17 5.85 -1.89 0.47 115.31 122.28 1g1a h LEU 207 Ca -0.46 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 1g1a h LEU 207 Cb 1.25 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 1g1a h LEU 207 CO 0.52 -0.06 0.02 0.40 -0.34 0.00 0.00 178.44 178.98 1g1a h ILE 208 N -0.04 1.03 -0.88 4.05 2.04 -1.95 -1.86 117.51 119.90 1g1a h ILE 208 Ca 0.02 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.82 1g1a h ILE 208 Cb 0.09 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1g1a h ILE 208 CO -0.13 0.03 0.58 -0.65 0.00 0.00 0.00 178.15 177.98 1g1a h PRO 209 N 0.00 1.08 -0.90 2.37 0.11 -1.81 -1.97 132.00 130.89 1g1a h PRO 209 Ca 0.01 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1g1a h PRO 209 Cb 0.03 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 30.86 1g1a h PRO 209 CO -0.00 0.71 0.50 1.25 -0.21 0.00 0.00 178.00 180.26 1g1a h LEU 210 N 1.11 1.11 -0.24 2.35 5.85 0.33 -0.52 115.31 125.29 1g1a h LEU 210 Ca 0.35 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.94 1g1a h LEU 210 Cb 0.01 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1g1a h LEU 210 CO -0.10 0.88 0.03 0.58 -0.34 0.00 0.00 178.44 179.49 1g1a h VAL 211 N 1.25 1.23 -0.36 1.05 2.07 -0.75 -0.64 116.25 120.10 1g1a h VAL 211 Ca 0.32 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 67.05 1g1a h VAL 211 Cb 0.01 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1g1a h VAL 211 CO -0.05 0.25 0.22 0.40 0.02 0.00 0.00 177.57 178.41 1g1a h ILE 212 N 0.21 1.05 -0.15 4.57 2.04 -0.91 -0.59 117.51 123.73 1g1a h ILE 212 Ca 0.07 -0.15 -0.13 0.00 1.00 0.00 0.00 64.86 65.65 1g1a h ILE 212 Cb 0.34 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1g1a h ILE 212 CO 0.01 0.08 -0.42 -0.07 0.00 0.00 0.00 178.15 177.75 1g1a h LEU 213 N 0.45 0.62 -0.80 1.44 3.38 -1.08 -2.79 115.31 116.53 1g1a h LEU 213 Ca 0.14 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 1g1a h LEU 213 Cb -0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1g1a h LEU 213 CO -0.06 1.11 0.41 0.78 0.09 0.00 0.00 178.44 180.77 1g1a h ASN 214 N 0.17 1.03 -0.12 -0.43 2.35 -1.08 0.14 115.58 117.64 1g1a h ASN 214 Ca -0.01 -0.12 0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1g1a h ASN 214 Cb 1.04 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 39.10 1g1a h ASN 214 CO 0.09 0.86 -0.40 0.00 -1.65 0.00 0.00 177.43 176.33 1g1a h ALA 215 N 1.22 -0.76 -0.80 -0.83 0.00 -1.08 0.76 119.26 117.76 1g1a h ALA 215 Ca 0.28 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.25 1g1a h ALA 215 Cb 0.08 0.91 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 1g1a h ALA 215 CO -0.04 -0.91 0.52 -0.07 0.00 0.00 0.00 179.25 178.75 1g1a h LEU 216 N -0.42 0.65 -0.40 0.00 3.38 -1.07 -1.23 115.31 116.23 1g1a h LEU 216 Ca 0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1g1a h LEU 216 Cb 0.50 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1g1a h LEU 216 CO -0.34 0.38 0.00 -0.62 0.09 0.00 0.00 178.44 177.96 1g1a n GLU 217 N -4.51 1.25 -3.14 1.13 1.02 0.42 -4.86 120.64 111.94 1g1a n GLU 217 Ca 0.14 -0.38 -0.16 0.00 -0.02 0.00 0.00 57.16 56.74 1g1a n GLU 217 Cb 0.34 -1.09 0.05 0.00 -0.02 0.00 0.00 31.44 30.73 1g1a n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1g1a n GLY 218 N 0.67 -0.06 3.58 0.62 0.00 -0.46 -5.03 105.19 104.50 1g1a n GLY 218 Ca 0.04 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1g1a n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g1a s LYS 219 N -5.77 1.88 0.11 1.61 1.02 0.19 -5.04 119.74 113.75 1g1a s LYS 219 Ca 0.36 -2.02 -0.34 0.00 0.02 0.00 0.00 55.97 53.98 1g1a s LYS 219 Cb -0.16 -1.67 -0.14 0.00 -0.52 0.00 0.00 37.83 35.34 1g1a s LYS 219 CO 0.44 0.05 1.58 -2.30 -0.92 0.00 0.00 175.35 174.20 1g1a n PRO 220 N -0.87 1.99 -3.52 -1.68 -0.02 -1.26 -4.23 135.00 125.40 1g1a n PRO 220 Ca -0.05 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.73 1g1a n PRO 220 Cb 0.65 -2.48 -0.09 0.00 -0.02 0.00 0.00 33.50 31.57 1g1a n PRO 220 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1g1a s LEU 221 N 1.26 5.50 0.25 2.45 1.43 -0.48 -4.85 118.68 124.24 1g1a s LEU 221 Ca 0.82 -1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 52.00 1g1a s LEU 221 Cb -0.73 -2.05 -0.09 0.00 0.03 0.00 0.00 46.19 43.35 1g1a s LEU 221 CO 0.41 -0.63 0.96 -2.16 0.23 0.00 0.00 176.35 175.16 1g1a s PRO 222 N 1.46 4.81 -0.19 1.29 0.04 -1.26 -1.01 135.00 140.16 1g1a s PRO 222 Ca 0.04 1.52 0.01 0.00 0.04 0.00 0.00 61.00 62.61 1g1a s PRO 222 Cb -0.25 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.07 1g1a s PRO 222 CO 0.02 0.47 -0.19 0.42 0.04 0.00 0.00 177.00 177.76 1g1a s ILE 223 N -1.20 2.13 -0.07 0.56 1.01 -0.81 -4.94 121.20 117.88 1g1a s ILE 223 Ca 0.42 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.85 1g1a s ILE 223 Cb -0.26 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 1g1a s ILE 223 CO 0.33 0.50 0.83 -0.31 0.00 0.00 0.00 174.94 176.29 1g1a s TYR 224 N 1.29 3.57 0.00 3.97 1.51 -1.26 -1.49 117.35 124.94 1g1a s TYR 224 Ca 0.04 1.41 0.00 0.00 -1.01 0.00 0.00 57.07 57.51 1g1a s TYR 224 Cb -0.13 -2.96 0.00 0.00 -0.11 0.00 0.00 41.96 38.76 1g1a s TYR 224 CO -0.12 -0.02 0.00 0.41 -1.11 0.00 0.00 175.55 174.71 1g1a n GLY 225 N 3.10 3.13 0.00 0.71 0.00 -0.75 -0.61 105.19 110.77 1g1a n GLY 225 Ca 0.03 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1g1a n GLY 225 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g1a n LYS 226 N 14.00 0.95 -1.30 1.61 5.02 -1.26 -4.77 118.16 132.41 1g1a n LYS 226 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1g1a n LYS 226 Cb 0.00 -1.34 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 1g1a n LYS 226 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1g1a n GLY 227 N 0.76 1.14 0.26 0.72 0.00 0.22 -4.79 105.19 103.50 1g1a n GLY 227 Ca 0.15 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 1g1a n GLY 227 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1g1a h ASP 228 N 0.00 -0.63 -0.92 1.61 1.82 -1.86 -2.79 116.42 113.65 1g1a h ASP 228 Ca -0.21 0.07 -0.75 0.00 -0.39 0.00 0.00 57.03 55.76 1g1a h ASP 228 Cb 0.80 0.24 0.04 0.00 0.68 0.00 0.00 39.33 41.09 1g1a h ASP 228 CO 0.31 -0.31 0.18 0.00 -1.61 0.00 0.00 179.24 177.81 1g1a n GLN 229 N -5.35 0.00 -4.43 0.28 3.00 -1.26 -4.63 117.38 104.99 1g1a n GLN 229 Ca -0.07 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.59 1g1a n GLN 229 Cb 0.26 -1.38 -0.11 0.00 0.00 0.00 0.00 30.24 29.00 1g1a n GLN 229 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1g1a s ILE 230 N 0.58 3.94 0.02 5.09 1.01 -0.02 -1.55 121.20 130.28 1g1a s ILE 230 Ca 0.87 -0.36 -0.02 0.00 0.00 0.00 0.00 60.65 61.14 1g1a s ILE 230 Cb -1.21 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1g1a s ILE 230 CO 0.57 0.53 0.02 -0.13 0.00 0.00 0.00 174.94 175.93 1g1a s ARG 231 N -0.03 0.39 -0.44 2.79 1.81 -0.71 -1.39 118.95 121.37 1g1a s ARG 231 Ca 0.01 -0.62 -0.17 0.00 -1.72 0.00 0.00 55.73 53.24 1g1a s ARG 231 Cb -0.13 0.15 0.03 0.00 -0.45 0.00 0.00 34.95 34.55 1g1a s ARG 231 CO 0.03 -0.08 0.44 0.34 -0.68 0.00 0.00 175.30 175.35 1g1a s ASP 232 N -1.60 6.19 -0.24 0.23 -1.08 -1.17 -1.43 116.67 117.58 1g1a s ASP 232 Ca -0.13 -0.80 -0.18 0.00 -0.52 0.00 0.00 52.55 50.91 1g1a s ASP 232 Cb -0.08 -2.22 -0.03 0.00 -1.46 0.00 0.00 42.92 39.13 1g1a s ASP 232 CO -0.01 -0.62 0.53 0.26 0.52 0.00 0.00 175.17 175.85 1g1a s TRP 233 N 2.10 3.31 -0.20 -5.34 0.52 -1.26 -2.32 118.94 115.75 1g1a s TRP 233 Ca 0.11 0.71 -0.03 0.00 0.02 0.00 0.00 56.10 56.90 1g1a s TRP 233 Cb -0.18 -2.71 -0.01 0.00 -1.15 0.00 0.00 33.47 29.41 1g1a s TRP 233 CO 0.12 -0.21 -0.06 -1.17 0.02 0.00 0.00 176.95 175.65 1g1a s LEU 234 N 2.05 2.92 0.17 2.99 2.96 0.11 -4.03 118.68 125.85 1g1a s LEU 234 Ca 0.23 -0.34 -0.31 0.00 -0.22 0.00 0.00 54.13 53.49 1g1a s LEU 234 Cb -0.16 -1.72 -0.09 0.00 0.50 0.00 0.00 46.19 44.72 1g1a s LEU 234 CO 0.09 0.04 1.41 -0.47 -1.32 0.00 0.00 176.35 176.10 1g1a s TYR 235 N 1.12 3.18 0.24 5.38 5.04 -1.26 -2.03 117.35 129.01 1g1a s TYR 235 Ca 0.01 0.97 -0.05 0.00 -2.44 0.00 0.00 57.07 55.57 1g1a s TYR 235 Cb -0.15 -3.73 0.42 0.00 0.35 0.00 0.00 41.96 38.86 1g1a s TYR 235 CO -0.01 -2.49 1.74 -0.24 -1.34 0.00 0.00 175.55 173.21 1g1a h VAL 236 N 3.97 0.70 0.00 3.14 3.04 -1.34 0.40 116.25 126.16 1g1a h VAL 236 Ca -0.43 -0.16 -0.01 0.00 -1.01 0.00 0.00 66.70 65.08 1g1a h VAL 236 Cb 1.21 0.18 -0.00 0.00 -2.01 0.00 0.00 31.29 30.67 1g1a h VAL 236 CO 0.84 0.09 -0.06 -0.33 -1.01 0.00 0.00 177.57 177.10 1g1a h GLU 237 N 0.48 0.00 0.01 4.17 5.08 -1.91 0.51 114.58 122.91 1g1a h GLU 237 Ca 0.40 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.56 1g1a h GLU 237 Cb 0.56 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.83 1g1a h GLU 237 CO -0.37 0.06 -0.78 -0.44 -1.00 0.00 0.00 179.01 176.48 1g1a h ASP 238 N 0.00 0.68 -0.22 1.42 3.32 -1.34 -2.39 116.42 117.89 1g1a h ASP 238 Ca -0.00 -0.76 0.01 0.00 0.02 0.00 0.00 57.03 56.30 1g1a h ASP 238 Cb 0.10 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1g1a h ASP 238 CO 0.01 1.35 0.11 -0.74 -1.72 0.00 0.00 179.24 178.25 1g1a h HIS 239 N 0.08 0.21 -0.49 4.55 2.76 -0.57 -1.11 115.15 120.58 1g1a h HIS 239 Ca -0.10 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.17 1g1a h HIS 239 Cb 1.47 -0.06 -0.08 0.00 1.55 0.00 0.00 27.41 30.29 1g1a h HIS 239 CO 0.13 0.12 -0.01 0.00 -1.30 0.00 0.00 177.93 176.88 1g1a h ALA 240 N 1.11 0.46 -0.79 5.26 0.00 -0.95 0.30 119.26 124.64 1g1a h ALA 240 Ca 0.09 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1g1a h ALA 240 Cb 0.01 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1g1a h ALA 240 CO -0.05 -0.39 0.36 0.00 0.00 0.00 0.00 179.25 179.16 1g1a h ARG 241 N 0.11 1.15 -0.70 0.00 3.08 -0.92 -2.66 114.38 114.44 1g1a h ARG 241 Ca 0.25 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 1g1a h ARG 241 Cb 0.37 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 1g1a h ARG 241 CO -0.42 0.90 0.15 0.00 -1.07 0.00 0.00 179.97 179.54 1g1a h ALA 242 N 1.25 0.93 -0.46 0.04 0.00 0.22 -2.32 119.26 118.91 1g1a h ALA 242 Ca 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1g1a h ALA 242 Cb 0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1g1a h ALA 242 CO -0.03 0.67 0.23 -0.07 0.00 0.00 0.00 179.25 180.05 1g1a h LEU 243 N 1.07 0.60 -0.85 0.00 3.38 -0.84 0.22 115.31 118.90 1g1a h LEU 243 Ca 0.22 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1g1a h LEU 243 Cb 0.40 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1g1a h LEU 243 CO 0.01 0.55 -0.19 -0.74 0.09 0.00 0.00 178.44 178.16 1g1a h HIS 244 N 0.61 0.72 -0.12 1.13 2.76 -1.39 -1.02 115.15 117.84 1g1a h HIS 244 Ca 0.16 -0.15 -0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1g1a h HIS 244 Cb 0.10 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.88 1g1a h HIS 244 CO -0.01 0.79 0.07 1.98 -1.30 0.00 0.00 177.93 179.47 1g1a h MET 245 N 0.58 0.17 -0.19 5.26 -1.53 -1.02 -2.37 114.93 115.82 1g1a h MET 245 Ca 0.09 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.34 1g1a h MET 245 Cb 0.65 -0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.65 1g1a h MET 245 CO 0.05 0.15 0.12 0.28 0.14 0.00 0.00 176.91 177.65 1g1a h VAL 246 N 0.13 1.05 -0.51 -5.77 2.07 -0.62 0.21 116.25 112.81 1g1a h VAL 246 Ca 0.04 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1g1a h VAL 246 Cb 0.02 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1g1a h VAL 246 CO -0.01 0.05 0.16 1.62 0.02 0.00 0.00 177.57 179.41 1g1a h VAL 247 N 0.25 1.20 0.02 2.57 3.04 -1.15 1.32 116.25 123.51 1g1a h VAL 247 Ca 0.07 -0.69 -0.26 0.00 -1.01 0.00 0.00 66.70 64.81 1g1a h VAL 247 Cb -0.03 0.64 -0.04 0.00 -2.01 0.00 0.00 31.29 29.85 1g1a h VAL 247 CO -0.02 0.26 -1.41 0.71 -1.01 0.00 0.00 177.57 176.11 1g1a h THR 248 N 0.74 1.23 -0.00 3.17 1.35 -1.25 -3.39 112.91 114.75 1g1a h THR 248 Ca 0.17 -3.00 0.00 0.00 -0.55 0.00 0.00 66.41 63.04 1g1a h THR 248 Cb 0.21 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1g1a h THR 248 CO -0.01 0.73 -0.01 -0.62 -0.25 0.00 0.00 175.52 175.36 1g1a n GLU 249 N -3.22 2.49 -1.92 4.72 -0.58 0.72 -5.05 120.64 117.79 1g1a n GLU 249 Ca -0.10 -0.29 -0.36 0.00 -0.42 0.00 0.00 57.16 55.99 1g1a n GLU 249 Cb 1.01 -0.79 0.04 0.00 -0.57 0.00 0.00 31.44 31.13 1g1a n GLU 249 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1g1a s GLY 250 N -0.47 2.71 -0.21 0.62 0.00 0.45 -4.98 107.32 105.45 1g1a s GLY 250 Ca 0.00 1.02 -0.11 0.00 0.00 0.00 0.00 44.72 45.63 1g1a s GLY 250 CO 0.01 1.41 0.19 1.25 0.00 0.00 0.00 173.10 175.96 1g1a s LYS 251 N -3.40 4.15 0.19 2.90 2.20 -1.26 -4.96 119.74 119.56 1g1a s LYS 251 Ca 0.78 -0.16 -0.32 0.00 -0.36 0.00 0.00 55.97 55.90 1g1a s LYS 251 Cb -0.31 -3.48 -0.15 0.00 -1.51 0.00 0.00 37.83 32.38 1g1a s LYS 251 CO 0.35 0.17 1.24 0.00 -0.36 0.00 0.00 175.35 176.75 1g1a n ALA 252 N 3.91 -0.18 -0.62 3.13 0.00 -1.26 -1.50 120.51 123.99 1g1a n ALA 252 Ca -0.14 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1g1a n ALA 252 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1g1a n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g1a n GLY 253 N 2.07 0.80 3.96 0.00 0.00 0.06 -4.97 105.19 107.11 1g1a n GLY 253 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1g1a n GLY 253 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g1a s GLU 254 N -0.38 3.46 0.00 1.61 0.41 -0.56 -5.01 118.70 118.22 1g1a s GLU 254 Ca 0.00 -0.60 0.07 0.00 -0.41 0.00 0.00 54.97 54.03 1g1a s GLU 254 Cb 0.00 -2.81 -0.02 0.00 -1.78 0.00 0.00 34.13 29.52 1g1a s GLU 254 CO 0.00 0.34 -0.21 0.99 -0.49 0.00 0.00 175.26 175.89 1g1a s THR 255 N -2.08 1.63 -0.03 3.63 2.01 -1.26 -2.46 115.64 117.08 1g1a s THR 255 Ca 0.36 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1g1a s THR 255 Cb -0.09 -1.37 0.03 0.00 0.01 0.00 0.00 72.50 71.07 1g1a s THR 255 CO 0.31 0.39 0.00 -0.31 -0.69 0.00 0.00 174.62 174.33 1g1a s TYR 256 N -0.57 0.31 0.07 4.92 2.02 -0.26 -4.96 117.35 118.89 1g1a s TYR 256 Ca 0.08 0.01 -0.17 0.00 -0.37 0.00 0.00 57.07 56.62 1g1a s TYR 256 Cb -0.08 -0.43 -0.06 0.00 -0.40 0.00 0.00 41.96 40.99 1g1a s TYR 256 CO -0.00 -0.14 0.52 -0.80 -1.57 0.00 0.00 175.55 173.56 1g1a s ASN 257 N 1.12 6.95 -0.07 2.29 0.01 -1.26 -1.44 114.94 122.54 1g1a s ASN 257 Ca -0.08 1.14 0.02 0.00 -0.71 0.00 0.00 52.86 53.23 1g1a s ASN 257 Cb -0.13 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.22 1g1a s ASN 257 CO -0.02 0.25 -0.12 -0.63 -1.51 0.00 0.00 177.10 175.07 1g1a s ILE 258 N -1.19 1.13 0.22 0.60 1.01 0.11 -4.63 121.20 118.45 1g1a s ILE 258 Ca 0.30 -0.47 -0.11 0.00 0.00 0.00 0.00 60.65 60.37 1g1a s ILE 258 Cb -0.18 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.24 1g1a s ILE 258 CO 0.18 0.36 0.40 -0.83 0.00 0.00 0.00 174.94 175.04 1g1a s GLY 259 N 0.71 0.60 -0.02 6.18 0.00 -1.26 -2.17 107.32 111.35 1g1a s GLY 259 Ca -0.14 -0.94 0.08 0.00 0.00 0.00 0.00 44.72 43.72 1g1a s GLY 259 CO 0.03 -0.74 1.16 0.61 0.00 0.00 0.00 173.10 174.16 1g1a n GLY 260 N -0.33 0.65 3.53 0.20 0.00 -1.26 -4.70 105.19 103.28 1g1a n GLY 260 Ca -0.03 -0.31 -0.19 0.00 0.00 0.00 0.00 46.02 45.49 1g1a n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1g1a n HIS 261 N 0.30 -2.21 -3.81 1.61 8.25 -1.26 -4.81 115.22 113.29 1g1a n HIS 261 Ca 0.10 0.93 -0.09 0.00 -0.26 0.00 0.00 57.72 58.39 1g1a n HIS 261 Cb 0.31 -4.89 0.02 0.00 1.12 0.00 0.00 29.99 26.55 1g1a n HIS 261 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1g1a s ASN 262 N -4.20 0.04 -0.22 0.41 2.20 -1.26 -5.01 114.94 106.90 1g1a s ASN 262 Ca 0.09 -1.16 -0.11 0.00 -0.94 0.00 0.00 52.86 50.74 1g1a s ASN 262 Cb -0.04 0.85 0.07 0.00 -2.00 0.00 0.00 41.25 40.13 1g1a s ASN 262 CO 0.75 -1.69 0.51 -0.70 -2.94 0.00 0.00 177.10 173.04 1g1a s GLU 263 N -2.31 0.49 -0.02 3.55 2.12 -1.26 -4.43 118.70 116.84 1g1a s GLU 263 Ca 0.16 1.00 -0.04 0.00 0.36 0.00 0.00 54.97 56.45 1g1a s GLU 263 Cb -0.05 0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.48 1g1a s GLU 263 CO 0.12 -0.17 0.09 0.15 -0.54 0.00 0.00 175.26 174.91 1g1a s LYS 264 N 1.74 0.21 0.31 4.30 -0.14 -0.51 -4.95 119.74 120.69 1g1a s LYS 264 Ca -0.08 -0.06 -0.16 0.00 -1.36 0.00 0.00 55.97 54.30 1g1a s LYS 264 Cb -0.08 0.09 -0.09 0.00 -1.68 0.00 0.00 37.83 36.07 1g1a s LYS 264 CO -0.15 -0.04 0.75 0.15 -0.76 0.00 0.00 175.35 175.29 1g1a s LYS 265 N -0.42 4.08 0.17 1.68 1.02 -1.26 -1.75 119.74 123.26 1g1a s LYS 265 Ca -0.05 0.74 -0.16 0.00 0.02 0.00 0.00 55.97 56.52 1g1a s LYS 265 Cb -0.03 -2.52 0.11 0.00 -0.52 0.00 0.00 37.83 34.86 1g1a s LYS 265 CO 0.00 0.20 1.68 -0.91 -0.92 0.00 0.00 175.35 175.40 1g1a h ASN 266 N 2.51 -0.31 -0.95 2.83 -0.26 -1.02 -0.07 115.58 118.31 1g1a h ASN 266 Ca -0.48 0.11 0.19 0.00 -0.56 0.00 0.00 56.30 55.57 1g1a h ASN 266 Cb 1.18 0.23 -0.11 0.00 -1.06 0.00 0.00 38.32 38.56 1g1a h ASN 266 CO 0.65 -0.11 0.54 0.25 -1.06 0.00 0.00 177.43 177.70 1g1a h LEU 267 N 0.03 0.65 -1.10 1.61 6.46 -1.81 0.33 115.31 121.48 1g1a h LEU 267 Ca 0.20 0.11 -0.07 0.00 -0.12 0.00 0.00 57.88 58.00 1g1a h LEU 267 Cb 0.30 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.22 1g1a h LEU 267 CO -0.40 0.20 -0.11 0.44 -0.62 0.00 0.00 178.44 177.95 1g1a h ASP 268 N 0.65 0.49 -0.30 1.25 3.32 -1.31 -1.88 116.42 118.65 1g1a h ASP 268 Ca 0.56 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.42 1g1a h ASP 268 Cb 0.91 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1g1a h ASP 268 CO -0.41 0.64 -0.08 0.58 -1.72 0.00 0.00 179.24 178.24 1g1a h VAL 269 N 0.48 1.28 -0.45 -1.35 2.07 0.25 -0.86 116.25 117.67 1g1a h VAL 269 Ca 0.09 -1.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 1g1a h VAL 269 Cb 0.48 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1g1a h VAL 269 CO 0.03 0.36 0.15 0.58 0.02 0.00 0.00 177.57 178.70 1g1a h VAL 270 N 0.35 1.22 -0.63 2.57 2.07 -1.07 -2.11 116.25 118.65 1g1a h VAL 270 Ca 0.07 -0.72 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 1g1a h VAL 270 Cb 0.57 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1g1a h VAL 270 CO 0.03 0.26 0.02 -0.26 0.02 0.00 0.00 177.57 177.65 1g1a h PHE 271 N 0.59 1.18 -0.82 1.57 -1.00 -1.29 -1.92 116.94 115.24 1g1a h PHE 271 Ca 0.15 -0.20 0.02 0.00 2.81 0.00 0.00 57.97 60.75 1g1a h PHE 271 Cb 0.26 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 39.46 1g1a h PHE 271 CO 0.01 1.03 0.54 1.15 -1.61 0.00 0.00 178.31 179.43 1g1a h THR 272 N 1.00 1.18 -0.52 -1.55 2.02 -0.94 0.32 112.91 114.42 1g1a h THR 272 Ca 0.18 -0.37 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 1g1a h THR 272 Cb 0.54 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 1g1a h THR 272 CO 0.03 0.20 0.17 0.40 0.37 0.00 0.00 175.52 176.69 1g1a h ILE 273 N 1.08 1.23 -0.61 3.11 2.04 -1.17 -1.49 117.51 121.71 1g1a h ILE 273 Ca 0.31 -0.76 -0.05 0.00 1.00 0.00 0.00 64.86 65.37 1g1a h ILE 273 Cb -0.07 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1g1a h ILE 273 CO -0.08 0.28 0.18 0.00 0.00 0.00 0.00 178.15 178.53 1g1a h ASP 275 N 0.90 0.78 -0.33 0.00 3.32 -0.52 -1.34 116.42 119.23 1g1a h ASP 275 Ca 0.20 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.88 1g1a h ASP 275 Cb 0.27 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1g1a h ASP 275 CO -0.01 0.99 -0.11 -0.07 -1.72 0.00 0.00 179.24 178.33 1g1a h LEU 276 N 0.67 0.67 -1.97 1.55 3.38 -0.98 -1.66 115.31 116.96 1g1a h LEU 276 Ca 0.09 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1g1a h LEU 276 Cb 0.75 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1g1a h LEU 276 CO 0.06 0.89 -0.03 -0.07 0.09 0.00 0.00 178.44 179.39 1g1a h LEU 277 N 0.43 0.00 0.10 1.67 3.38 -1.03 0.17 115.31 120.02 1g1a h LEU 277 Ca 0.08 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.78 1g1a h LEU 277 Cb 0.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1g1a h LEU 277 CO 0.04 0.03 -1.32 0.44 0.09 0.00 0.00 178.44 177.71 1g1a h ASP 278 N 0.00 0.32 0.41 -0.43 3.32 -0.76 -3.36 116.42 115.92 1g1a h ASP 278 Ca -0.00 -0.38 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 1g1a h ASP 278 Cb 0.35 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1g1a h ASP 278 CO 0.00 1.31 -0.20 -0.08 -1.72 0.00 0.00 179.24 178.55 1g1a h GLU 279 N 0.06 -0.53 -6.70 3.56 4.81 -0.29 -3.34 114.58 112.14 1g1a h GLU 279 Ca -0.16 0.04 -0.50 0.00 -0.13 0.00 0.00 59.36 58.60 1g1a h GLU 279 Cb 1.96 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 31.45 1g1a h GLU 279 CO 0.17 -0.24 0.04 0.42 -0.73 0.00 0.00 179.01 178.67 1g1a s ILE 280 N -4.08 4.82 -1.27 2.32 1.01 0.46 -4.46 121.20 120.01 1g1a s ILE 280 Ca -0.12 0.59 -0.08 0.00 0.00 0.00 0.00 60.65 61.04 1g1a s ILE 280 Cb 0.01 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.79 1g1a s ILE 280 CO 0.42 -0.34 0.64 0.52 0.00 0.00 0.00 174.94 176.18 1g1a n VAL 281 N -0.84 -4.63 -1.26 2.92 0.31 -1.26 -4.38 118.33 109.18 1g1a n VAL 281 Ca 0.02 -0.70 -0.32 0.00 -0.01 0.00 0.00 64.34 63.33 1g1a n VAL 281 Cb 0.54 -3.68 0.10 0.00 -0.91 0.00 0.00 33.84 29.89 1g1a n VAL 281 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1g1a s PRO 282 N -6.13 2.07 0.08 5.55 0.02 -1.25 -4.69 135.00 130.65 1g1a s PRO 282 Ca 0.19 1.39 0.00 0.00 0.02 0.00 0.00 61.00 62.60 1g1a s PRO 282 Cb -0.06 -1.86 -0.00 0.00 0.02 0.00 0.00 34.50 32.59 1g1a s PRO 282 CO 0.85 -1.81 0.10 0.36 -0.33 0.00 0.00 177.00 176.18 1g1a n LYS 283 N -3.33 0.15 0.30 5.54 2.85 -1.26 -5.04 118.16 117.37 1g1a n LYS 283 Ca 0.11 -0.73 0.18 0.00 -1.05 0.00 0.00 58.31 56.81 1g1a n LYS 283 Cb 0.52 0.66 1.00 0.00 -0.65 0.00 0.00 35.03 36.56 1g1a n LYS 283 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1g1a h ALA 284 N 1.47 1.40 -2.59 0.58 0.00 -2.04 -3.44 119.26 114.65 1g1a h ALA 284 Ca -0.06 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 1g1a h ALA 284 Cb 0.29 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.95 1g1a h ALA 284 CO 0.09 -0.04 -0.50 0.99 0.00 0.00 0.00 179.25 179.79 1g1a s THR 285 N -4.48 0.04 0.24 0.00 2.01 -1.26 -5.14 115.64 107.06 1g1a s THR 285 Ca -0.05 -1.77 -0.29 0.00 0.31 0.00 0.00 61.69 59.89 1g1a s THR 285 Cb 0.14 -2.19 -0.09 0.00 0.01 0.00 0.00 72.50 70.37 1g1a s THR 285 CO 0.50 -0.19 0.93 -0.55 -0.69 0.00 0.00 174.62 174.61 1g1a s SER 286 N -3.07 7.59 0.61 3.53 0.15 -1.26 -4.91 113.70 116.34 1g1a s SER 286 Ca 0.28 1.91 0.32 0.00 0.70 0.00 0.00 55.95 59.16 1g1a s SER 286 Cb 0.05 -2.60 1.89 0.00 -1.71 0.00 0.00 66.02 63.65 1g1a s SER 286 CO 0.06 0.13 2.23 1.88 1.20 0.00 0.00 173.24 178.75 1g1a h TYR 287 N 4.04 0.00 -0.82 3.44 0.05 -1.94 -1.88 116.97 119.85 1g1a h TYR 287 Ca -0.45 0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.48 1g1a h TYR 287 Cb 1.20 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.88 1g1a h TYR 287 CO 0.61 0.00 0.54 0.00 -1.05 0.00 0.00 178.16 178.26 1g1a h ARG 288 N 0.00 0.48 0.00 4.88 3.08 -1.91 -2.07 114.38 118.85 1g1a h ARG 288 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1g1a h ARG 288 Cb 0.14 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1g1a h ARG 288 CO -0.00 0.32 0.00 0.39 -1.07 0.00 0.00 179.97 179.61 1g1a n GLU 289 N -4.51 0.14 0.00 0.04 -0.58 -0.71 -0.22 120.64 114.80 1g1a n GLU 289 Ca 0.16 0.60 0.13 0.00 -0.42 0.00 0.00 57.16 57.63 1g1a n GLU 289 Cb 0.53 -1.92 0.32 0.00 -0.57 0.00 0.00 31.44 29.81 1g1a n GLU 289 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1g1a n GLN 290 N -2.20 1.22 -1.98 3.49 6.02 -0.78 -4.91 117.38 118.24 1g1a n GLN 290 Ca -0.01 -0.81 -0.41 0.00 -0.01 0.00 0.00 57.00 55.75 1g1a n GLN 290 Cb 0.06 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.81 1g1a n GLN 290 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1g1a s ILE 291 N -2.34 2.55 -0.10 5.09 1.01 0.69 -1.38 121.20 126.74 1g1a s ILE 291 Ca 0.27 0.48 -0.10 0.00 0.00 0.00 0.00 60.65 61.30 1g1a s ILE 291 Cb 0.20 -3.31 0.03 0.00 0.01 0.00 0.00 42.46 39.38 1g1a s ILE 291 CO 0.47 0.08 0.27 0.42 0.00 0.00 0.00 174.94 176.18 1g1a s THR 292 N -0.22 0.00 0.05 2.92 -4.23 -0.18 -4.84 115.64 109.15 1g1a s THR 292 Ca 0.58 -0.04 -0.20 0.00 -1.18 0.00 0.00 61.69 60.85 1g1a s THR 292 Cb -0.43 -0.40 -0.06 0.00 1.34 0.00 0.00 72.50 72.95 1g1a s THR 292 CO 0.46 -0.02 0.57 -0.31 -0.54 0.00 0.00 174.62 174.78 1g1a s TYR 293 N 0.03 3.77 0.14 3.99 1.51 -1.26 -1.93 117.35 123.61 1g1a s TYR 293 Ca -0.01 1.25 -0.02 0.00 -1.01 0.00 0.00 57.07 57.28 1g1a s TYR 293 Cb -0.02 -2.53 -0.03 0.00 -0.11 0.00 0.00 41.96 39.27 1g1a s TYR 293 CO 0.01 0.52 0.10 0.14 -1.11 0.00 0.00 175.55 175.21 1g1a s VAL 294 N -0.86 0.09 0.00 0.71 -7.23 -0.55 -4.90 120.40 107.66 1g1a s VAL 294 Ca 0.29 -1.82 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1g1a s VAL 294 Cb -0.19 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.72 1g1a s VAL 294 CO 0.18 -0.41 0.00 0.00 -0.31 0.00 0.00 175.10 174.56 1g1a n ALA 295 N -0.12 -1.30 -2.70 1.32 0.00 -1.26 -1.81 120.51 114.63 1g1a n ALA 295 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1g1a n ALA 295 Cb 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.01 1g1a n ALA 295 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1g1a s ASP 296 N 0.00 5.06 -0.19 0.00 3.68 -1.26 -3.61 116.67 120.34 1g1a s ASP 296 Ca 0.00 -0.19 -0.05 0.00 2.13 0.00 0.00 52.55 54.44 1g1a s ASP 296 Cb 0.00 -1.21 -0.02 0.00 -1.45 0.00 0.00 42.92 40.24 1g1a s ASP 296 CO 0.00 0.16 -0.01 -0.13 0.13 0.00 0.00 175.17 175.32 1g1a s ARG 297 N -2.44 3.62 0.26 4.34 3.00 -1.26 -5.00 118.95 121.47 1g1a s ARG 297 Ca 0.26 -0.53 -0.27 0.00 0.00 0.00 0.00 55.73 55.20 1g1a s ARG 297 Cb -0.11 -3.04 -0.16 0.00 0.00 0.00 0.00 34.95 31.64 1g1a s ARG 297 CO 0.19 0.06 0.67 -2.30 0.00 0.00 0.00 175.30 173.91 1g1a n PRO 298 N 4.10 0.50 -3.66 3.54 -0.02 -1.26 -3.35 135.00 134.86 1g1a n PRO 298 Ca -0.17 0.18 -0.19 0.00 -2.02 0.00 0.00 63.50 61.30 1g1a n PRO 298 Cb 0.52 -1.33 0.01 0.00 -0.02 0.00 0.00 33.50 32.68 1g1a n PRO 298 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1g1a n GLY 299 N 1.73 -0.45 3.84 -1.23 0.00 -1.26 -4.91 105.19 102.91 1g1a n GLY 299 Ca 0.14 0.19 -0.34 0.00 0.00 0.00 0.00 46.02 46.02 1g1a n GLY 299 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1g1a s HIS 300 N -3.75 3.44 0.16 1.61 -3.43 -1.21 -5.05 115.29 107.05 1g1a s HIS 300 Ca 0.16 0.32 -0.33 0.00 -0.80 0.00 0.00 55.06 54.41 1g1a s HIS 300 Cb -0.09 -1.81 -0.13 0.00 -1.43 0.00 0.00 32.58 29.12 1g1a s HIS 300 CO 0.44 0.62 1.68 -0.25 -2.00 0.00 0.00 174.74 175.23 1g1a n ASP 301 N 1.26 3.58 0.08 7.38 8.00 -1.26 -4.90 116.55 130.69 1g1a n ASP 301 Ca -0.14 1.06 -0.01 0.00 0.71 0.00 0.00 54.79 56.41 1g1a n ASP 301 Cb 0.53 -1.50 -0.05 0.00 -0.02 0.00 0.00 41.12 40.08 1g1a n ASP 301 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1g1a h ARG 302 N 6.77 0.00 -2.28 -1.24 3.08 -1.91 -3.45 114.38 115.35 1g1a h ARG 302 Ca -0.45 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.58 1g1a h ARG 302 Cb 1.23 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 31.04 1g1a h ARG 302 CO 0.93 0.55 -0.18 0.50 -1.07 0.00 0.00 179.97 180.70 1g1a s ARG 303 N -2.86 0.51 -0.06 0.04 3.52 -1.26 -0.84 118.95 118.01 1g1a s ARG 303 Ca 0.01 1.13 0.06 0.00 -0.13 0.00 0.00 55.73 56.79 1g1a s ARG 303 Cb 0.08 0.31 -0.01 0.00 -1.56 0.00 0.00 34.95 33.78 1g1a s ARG 303 CO 0.79 -0.19 -0.25 0.71 -0.81 0.00 0.00 175.30 175.55 1g1a s TYR 304 N 2.09 2.46 -0.25 5.12 2.02 -0.49 -2.10 117.35 126.20 1g1a s TYR 304 Ca -0.07 -0.76 -0.13 0.00 -0.37 0.00 0.00 57.07 55.74 1g1a s TYR 304 Cb -0.09 -1.61 0.08 0.00 -0.40 0.00 0.00 41.96 39.94 1g1a s TYR 304 CO -0.16 -0.24 0.60 0.00 -1.57 0.00 0.00 175.55 174.18 1g1a s ALA 305 N -0.11 -1.64 -0.10 3.71 0.00 -1.26 -3.02 121.76 119.33 1g1a s ALA 305 Ca -0.05 2.14 -0.02 0.00 0.00 0.00 0.00 51.96 54.03 1g1a s ALA 305 Cb -0.14 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 1g1a s ALA 305 CO 0.04 -0.41 -0.01 0.42 0.00 0.00 0.00 175.76 175.80 1g1a s ILE 306 N 1.72 4.17 -0.49 0.00 1.01 -1.26 -1.22 121.20 125.13 1g1a s ILE 306 Ca -0.09 -0.29 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 1g1a s ILE 306 Cb -0.07 -2.77 0.07 0.00 0.01 0.00 0.00 42.46 39.70 1g1a s ILE 306 CO -0.18 0.57 0.52 -0.62 0.00 0.00 0.00 174.94 175.24 1g1a s ASP 307 N -0.54 6.19 -0.36 3.58 -1.08 -0.36 -4.77 116.67 119.33 1g1a s ASP 307 Ca 0.09 -1.13 0.06 0.00 -0.52 0.00 0.00 52.55 51.05 1g1a s ASP 307 Cb -0.12 -2.24 0.65 0.00 -1.46 0.00 0.00 42.92 39.75 1g1a s ASP 307 CO 0.02 -0.79 1.79 0.00 0.52 0.00 0.00 175.17 176.71 1g1a n ALA 308 N 5.72 4.91 -0.29 3.66 0.00 -1.26 -4.58 120.51 128.68 1g1a n ALA 308 Ca -0.09 -2.41 -0.05 0.00 0.00 0.00 0.00 53.44 50.89 1g1a n ALA 308 Cb 0.44 -1.33 0.06 0.00 0.00 0.00 0.00 19.45 18.63 1g1a n ALA 308 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1g1a h GLY 309 N 2.05 1.21 0.96 0.00 0.00 -1.91 -2.96 103.07 102.42 1g1a h GLY 309 Ca 0.42 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 47.16 1g1a h GLY 309 CO 0.86 0.57 0.23 1.70 0.00 0.00 0.00 176.54 179.90 1g1a h LYS 310 N 1.11 0.45 -0.10 4.80 3.64 -1.92 0.23 116.57 124.78 1g1a h LYS 310 Ca 0.27 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 1g1a h LYS 310 Cb 0.12 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1g1a h LYS 310 CO -0.03 0.30 -0.31 0.97 -2.27 0.00 0.00 179.45 178.10 1g1a h ILE 311 N 0.47 1.26 0.40 2.00 2.10 -1.81 0.22 117.51 122.15 1g1a h ILE 311 Ca 0.14 -1.25 -0.02 0.00 1.08 0.00 0.00 64.86 64.81 1g1a h ILE 311 Cb -0.03 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 37.24 1g1a h ILE 311 CO -0.05 0.37 -0.19 -1.28 -1.08 0.00 0.00 178.15 175.92 1g1a h SER 312 N 0.17 -0.46 -0.45 2.19 0.87 -1.25 0.99 113.55 115.61 1g1a h SER 312 Ca 0.02 -0.12 0.05 0.00 -1.23 0.00 0.00 61.79 60.52 1g1a h SER 312 Cb 0.65 0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.68 1g1a h SER 312 CO 0.05 -0.09 0.18 0.03 -0.53 0.00 0.00 176.83 176.47 1g1a h ARG 313 N -0.88 0.36 0.04 2.24 3.08 -0.42 0.24 114.38 119.04 1g1a h ARG 313 Ca -0.06 -0.02 -0.30 0.00 0.07 0.00 0.00 59.98 59.67 1g1a h ARG 313 Cb 0.55 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 1g1a h ARG 313 CO 0.09 0.24 -1.67 0.93 -1.07 0.00 0.00 179.97 178.49 1g1a h GLU 314 N 0.37 0.09 0.00 0.04 5.08 -1.01 -3.40 114.58 115.76 1g1a h GLU 314 Ca 0.21 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1g1a h GLU 314 Cb 0.18 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1g1a h GLU 314 CO -0.19 0.77 -0.23 1.28 -1.00 0.00 0.00 179.01 179.64 1g1a n LEU 315 N -3.22 0.20 -1.37 1.33 4.77 0.25 -5.03 117.00 113.93 1g1a n LEU 315 Ca -0.18 -0.48 -0.08 0.00 -0.03 0.00 0.00 56.01 55.24 1g1a n LEU 315 Cb 1.04 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.15 1g1a n LEU 315 CO 0.46 0.05 0.04 0.61 -1.33 0.00 0.00 177.39 177.22 1g1a n GLY 316 N 1.14 0.36 3.69 -0.72 0.00 0.86 -4.98 105.19 105.54 1g1a n GLY 316 Ca 0.01 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1g1a n GLY 316 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1g1a s TRP 317 N -2.93 3.23 -0.02 1.61 -0.00 -1.17 -4.95 118.94 114.71 1g1a s TRP 317 Ca 0.15 0.18 -0.11 0.00 -0.00 0.00 0.00 56.10 56.33 1g1a s TRP 317 Cb -0.07 -1.87 0.02 0.00 -0.00 0.00 0.00 33.47 31.55 1g1a s TRP 317 CO 0.19 0.42 0.23 0.15 -0.00 0.00 0.00 176.95 177.94 1g1a s LYS 318 N -0.60 0.53 0.62 5.86 1.02 -1.26 -3.76 119.74 122.15 1g1a s LYS 318 Ca 0.10 -0.17 -0.18 0.00 0.02 0.00 0.00 55.97 55.74 1g1a s LYS 318 Cb -0.12 0.23 -0.02 0.00 -0.52 0.00 0.00 37.83 37.40 1g1a s LYS 318 CO 0.02 -0.13 1.23 -2.14 -0.92 0.00 0.00 175.35 173.41 1g1a s PRO 319 N -1.08 2.77 -0.06 -1.68 0.02 -1.26 -4.92 135.00 128.78 1g1a s PRO 319 Ca -0.12 1.88 0.16 0.00 0.02 0.00 0.00 61.00 62.94 1g1a s PRO 319 Cb -0.06 -1.90 -0.22 0.00 0.02 0.00 0.00 34.50 32.35 1g1a s PRO 319 CO 0.03 -1.38 0.51 1.28 -0.33 0.00 0.00 177.00 177.10 1g1a n LEU 320 N -1.81 0.54 -4.97 -5.54 4.77 -1.26 -4.94 117.00 103.79 1g1a n LEU 320 Ca 0.14 0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 56.16 1g1a n LEU 320 Cb 0.49 0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.84 1g1a n LEU 320 CO 0.45 0.33 0.29 -1.61 -1.33 0.00 0.00 177.39 175.53 1g1a s GLU 321 N -2.71 2.83 0.34 3.23 0.41 -1.26 -5.07 118.70 116.46 1g1a s GLU 321 Ca -0.06 -0.71 0.09 0.00 -0.41 0.00 0.00 54.97 53.88 1g1a s GLU 321 Cb 0.08 -2.56 -0.06 0.00 -1.78 0.00 0.00 34.13 29.80 1g1a s GLU 321 CO 0.83 -0.43 -0.09 0.95 -0.49 0.00 0.00 175.26 176.03 1g1a s THR 322 N -2.60 2.15 0.27 3.63 -4.23 -1.26 -4.95 115.64 108.65 1g1a s THR 322 Ca 0.52 -2.19 -0.02 0.00 -1.18 0.00 0.00 61.69 58.83 1g1a s THR 322 Cb -0.10 -2.64 0.26 0.00 1.34 0.00 0.00 72.50 71.36 1g1a s THR 322 CO 0.37 -0.20 1.84 0.15 -0.54 0.00 0.00 174.62 176.24 1g1a h PHE 323 N 2.04 1.09 0.36 3.99 3.57 -1.88 0.34 116.94 126.45 1g1a h PHE 323 Ca -0.42 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.10 1g1a h PHE 323 Cb 1.25 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1g1a h PHE 323 CO 0.76 0.48 -0.25 0.93 -2.23 0.00 0.00 178.31 178.00 1g1a h GLU 324 N 1.00 -0.57 -0.31 1.11 3.07 -1.99 0.14 114.58 117.03 1g1a h GLU 324 Ca 0.45 0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 59.24 1g1a h GLU 324 Cb 0.34 0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.37 1g1a h GLU 324 CO -0.23 -0.38 -0.27 0.66 -1.40 0.00 0.00 179.01 177.39 1g1a h SER 325 N -0.60 0.63 -0.29 1.42 4.64 -1.88 -2.83 113.55 114.64 1g1a h SER 325 Ca -0.03 -0.23 -0.06 0.00 -0.47 0.00 0.00 61.79 61.00 1g1a h SER 325 Cb 0.51 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1g1a h SER 325 CO 0.02 0.88 -0.05 1.23 -0.87 0.00 0.00 176.83 178.04 1g1a h GLY 326 N 1.01 0.59 1.07 -0.77 0.00 -0.76 -2.52 103.07 101.69 1g1a h GLY 326 Ca 0.07 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 1g1a h GLY 326 CO 0.06 0.43 0.37 -2.22 0.00 0.00 0.00 176.54 175.18 1g1a h ILE 327 N 0.32 1.26 -0.07 2.60 1.08 -0.71 -1.11 117.51 120.88 1g1a h ILE 327 Ca 0.08 -0.76 0.01 0.00 -0.39 0.00 0.00 64.86 63.80 1g1a h ILE 327 Cb 0.51 0.23 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 1g1a h ILE 327 CO 0.02 0.32 -0.02 -0.09 -0.69 0.00 0.00 178.15 177.69 1g1a h ARG 328 N 1.18 -0.00 -0.98 2.37 2.43 -1.46 -1.10 114.38 116.82 1g1a h ARG 328 Ca 0.28 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.50 1g1a h ARG 328 Cb 0.15 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1g1a h ARG 328 CO -0.03 -0.00 0.64 0.87 -1.51 0.00 0.00 179.97 179.94 1g1a h LYS 329 N -0.00 1.15 -0.01 0.20 1.57 -1.00 -1.31 116.57 117.17 1g1a h LYS 329 Ca 0.03 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1g1a h LYS 329 Cb 0.05 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 1g1a h LYS 329 CO -0.07 0.76 0.00 1.15 -0.57 0.00 0.00 179.45 180.72 1g1a h THR 330 N 1.18 1.09 -0.61 -0.16 2.02 -0.64 0.29 112.91 116.08 1g1a h THR 330 Ca 0.41 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 67.36 1g1a h THR 330 Cb 0.11 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 1g1a h THR 330 CO -0.15 0.07 0.36 0.58 0.37 0.00 0.00 175.52 176.75 1g1a h VAL 331 N -0.10 1.03 -0.94 3.16 2.07 -0.85 -0.69 116.25 119.93 1g1a h VAL 331 Ca 0.00 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.30 1g1a h VAL 331 Cb 0.11 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 1g1a h VAL 331 CO -0.00 0.13 0.62 -0.33 0.02 0.00 0.00 177.57 178.01 1g1a h GLU 332 N 0.69 1.22 -0.34 1.57 5.08 -0.97 -1.70 114.58 120.13 1g1a h GLU 332 Ca 0.26 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1g1a h GLU 332 Cb 0.08 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 1g1a h GLU 332 CO -0.13 0.81 0.17 2.35 -1.00 0.00 0.00 179.01 181.21 1g1a h TRP 333 N 1.26 0.49 -0.70 4.33 7.01 0.48 -1.64 115.95 127.17 1g1a h TRP 333 Ca 0.35 -0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.27 1g1a h TRP 333 Cb -0.12 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 26.76 1g1a h TRP 333 CO -0.01 0.41 0.20 1.88 -2.79 0.00 0.00 178.44 178.14 1g1a h TYR 334 N 0.42 1.13 -0.50 2.65 -1.99 -0.96 -0.69 116.97 117.04 1g1a h TYR 334 Ca 0.12 -0.11 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1g1a h TYR 334 Cb 0.10 -0.33 -0.02 0.00 2.00 0.00 0.00 36.73 38.48 1g1a h TYR 334 CO -0.02 0.90 0.21 -0.07 -0.00 0.00 0.00 178.16 179.19 1g1a h LEU 335 N 1.05 0.63 -0.92 3.88 3.38 -1.02 -2.58 115.31 119.73 1g1a h LEU 335 Ca 0.23 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1g1a h LEU 335 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1g1a h LEU 335 CO -0.01 0.56 -0.08 0.00 0.09 0.00 0.00 178.44 179.00 1g1a n ALA 336 N -2.46 2.73 -2.46 1.53 0.00 -0.64 -4.50 120.51 114.70 1g1a n ALA 336 Ca 0.04 -0.46 -0.19 0.00 0.00 0.00 0.00 53.44 52.83 1g1a n ALA 336 Cb 0.14 -1.12 0.02 0.00 0.00 0.00 0.00 19.45 18.49 1g1a n ALA 336 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1g1a n ASN 337 N 0.04 3.67 -0.36 0.00 3.02 -0.31 -4.84 115.26 116.48 1g1a n ASN 337 Ca 0.17 -3.31 0.04 0.00 -0.03 0.00 0.00 54.58 51.45 1g1a n ASN 337 Cb 0.38 -0.45 0.19 0.00 -0.61 0.00 0.00 39.78 39.29 1g1a n ASN 337 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1g1a h THR 338 N 2.93 1.01 0.07 3.41 2.02 -1.79 -2.40 112.91 118.16 1g1a h THR 338 Ca 0.18 -0.37 0.02 0.00 0.77 0.00 0.00 66.41 67.01 1g1a h THR 338 Cb 1.16 -0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1g1a h THR 338 CO 0.67 0.19 -0.23 -0.61 0.37 0.00 0.00 175.52 175.92 1g1a h GLN 339 N 1.06 -0.39 -0.45 6.66 4.15 -1.95 0.28 115.11 124.49 1g1a h GLN 339 Ca 0.45 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.93 1g1a h GLN 339 Cb 0.29 0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.03 1g1a h GLN 339 CO -0.21 -0.26 0.23 2.35 -1.93 0.00 0.00 178.83 179.01 1g1a h TRP 340 N -0.40 0.42 -0.47 3.99 7.01 -1.89 -0.79 115.95 123.82 1g1a h TRP 340 Ca 0.04 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.06 1g1a h TRP 340 Cb 0.45 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1g1a h TRP 340 CO -0.24 0.22 0.29 0.28 -2.79 0.00 0.00 178.44 176.20 1g1a h VAL 341 N 0.46 1.13 -0.28 2.65 2.07 -0.99 -2.54 116.25 118.75 1g1a h VAL 341 Ca 0.19 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 1g1a h VAL 341 Cb 0.09 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1g1a h VAL 341 CO -0.13 0.13 -0.15 0.78 0.02 0.00 0.00 177.57 178.22 1g1a h ASN 342 N 0.62 0.47 0.30 0.57 2.35 -0.00 -1.15 115.58 118.74 1g1a h ASN 342 Ca 0.17 -0.13 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 1g1a h ASN 342 Cb -0.04 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1g1a h ASN 342 CO -0.03 0.65 -0.37 0.78 -1.65 0.00 0.00 177.43 176.80 1g1a h ASN 343 N 0.45 0.11 0.04 5.81 2.35 -0.88 -0.38 115.58 123.08 1g1a h ASN 343 Ca 0.08 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1g1a h ASN 343 Cb 0.52 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1g1a h ASN 343 CO 0.03 0.47 -0.02 0.58 -1.65 0.00 0.00 177.43 176.85 1g1a h VAL 344 N 0.09 1.33 -0.63 2.81 2.07 -1.05 -1.45 116.25 119.42 1g1a h VAL 344 Ca 0.01 -1.40 0.06 0.00 0.82 0.00 0.00 66.70 66.19 1g1a h VAL 344 Cb 0.70 2.24 -0.04 0.00 -1.52 0.00 0.00 31.29 32.67 1g1a h VAL 344 CO 0.05 0.34 0.42 0.11 0.02 0.00 0.00 177.57 178.52 1g1a h LYS 345 N -0.70 0.60 0.00 1.57 1.57 -1.06 -2.03 116.57 116.52 1g1a h LYS 345 Ca -0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1g1a h LYS 345 Cb 0.61 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1g1a h LYS 345 CO 0.01 0.39 -0.47 0.66 -0.57 0.00 0.00 179.45 179.47 1g1a h SER 346 N 0.61 0.00 0.00 0.86 4.64 -1.13 -3.47 113.55 115.06 1g1a h SER 346 Ca 0.27 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1g1a h SER 346 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1g1a h SER 346 CO -0.08 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 1g1a n GLY 347 N 1.31 1.82 0.48 -0.77 0.00 -0.77 -4.91 105.19 102.35 1g1a n GLY 347 Ca 0.04 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.35 1g1a n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g1a h ALA 348 N 0.00 2.80 0.00 4.61 0.00 -1.60 -0.24 119.26 124.83 1g1a h ALA 348 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1g1a h ALA 348 Cb 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1g1a h ALA 348 CO 0.00 -1.19 -0.04 0.10 0.00 0.00 0.00 179.25 178.12 1g1a h TYR 349 N 0.00 0.00 -0.23 0.00 -0.00 -1.62 -2.86 116.97 112.26 1g1a h TYR 349 Ca 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 59.04 1g1a h TYR 349 Cb 1.87 0.00 -0.07 0.00 0.00 0.00 0.00 36.73 38.53 1g1a h TYR 349 CO 0.00 0.04 0.16 1.04 -0.00 0.00 0.00 178.16 179.39 1g1a n GLN 350 N -3.37 1.30 -0.05 0.10 6.02 -0.10 -3.36 117.38 117.92 1g1a n GLN 350 Ca -0.02 -0.70 0.06 0.00 -0.01 0.00 0.00 57.00 56.33 1g1a n GLN 350 Cb 0.16 -1.28 0.09 0.00 1.02 0.00 0.00 30.24 30.24 1g1a n GLN 350 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1g1a n SER 351 N 0.18 2.23 0.00 1.08 7.64 -1.08 -5.18 113.62 118.49 1g1a n SER 351 Ca 0.14 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.32 1g1a n SER 351 Cb 0.76 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1g1a n SER 351 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82