#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 4.00 -0.21 2.12 2.47 -1.26 -1.70 119.74 125.15 1g1a s LYS 2 Ca 0.00 -0.09 -0.05 0.00 -1.56 0.00 0.00 55.97 54.27 1g1a s LYS 2 Cb 0.00 -3.65 -0.02 0.00 -1.46 0.00 0.00 37.83 32.70 1g1a s LYS 2 CO 0.00 -0.23 -0.01 0.42 0.16 0.00 0.00 175.35 175.69 1g1a s ILE 3 N 1.93 3.84 -0.21 5.43 1.01 -0.66 0.48 121.20 133.02 1g1a s ILE 3 Ca 0.12 -0.35 -0.17 0.00 0.00 0.00 0.00 60.65 60.26 1g1a s ILE 3 Cb -0.16 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 1g1a s ILE 3 CO 0.10 0.42 0.44 -0.22 0.00 0.00 0.00 174.94 175.68 1g1a s LEU 4 N 1.16 4.14 -0.06 2.97 0.20 0.83 -2.57 118.68 125.34 1g1a s LEU 4 Ca 0.03 0.54 0.06 0.00 0.69 0.00 0.00 54.13 55.45 1g1a s LEU 4 Cb -0.14 -2.57 -0.01 0.00 -0.43 0.00 0.00 46.19 43.03 1g1a s LEU 4 CO 0.01 -0.13 -0.24 -0.63 -0.29 0.00 0.00 176.35 175.07 1g1a s ILE 5 N 1.53 2.02 0.05 6.68 1.01 -0.66 -0.57 121.20 131.27 1g1a s ILE 5 Ca 0.20 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1g1a s ILE 5 Cb -0.15 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 1g1a s ILE 5 CO 0.09 0.56 0.11 0.42 0.00 0.00 0.00 174.94 176.11 1g1a s THR 6 N -0.05 4.77 -1.03 2.92 -4.23 -0.46 -0.47 115.64 117.08 1g1a s THR 6 Ca -0.07 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 1g1a s THR 6 Cb -0.14 -3.28 0.00 0.00 1.34 0.00 0.00 72.50 70.42 1g1a s THR 6 CO 0.05 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 1g1a n GLY 7 N 0.59 0.73 0.19 3.99 0.00 -0.48 -2.43 105.19 107.78 1g1a n GLY 7 Ca -0.09 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.16 -0.02 0.00 -1.77 -1.72 103.07 97.40 1g1a h GLY 8 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1g1a h GLY 8 CO 0.31 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.85 1g1a n ALA 9 N -1.84 2.42 -2.46 3.60 0.00 -1.26 -2.07 120.51 118.89 1g1a n ALA 9 Ca -0.01 -1.01 -0.21 0.00 0.00 0.00 0.00 53.44 52.21 1g1a n ALA 9 Cb 0.09 -0.95 0.12 0.00 0.00 0.00 0.00 19.45 18.72 1g1a n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g1a n GLY 10 N 1.46 0.28 0.06 0.00 0.00 -0.65 -0.93 105.19 105.42 1g1a n GLY 10 Ca 0.20 -1.97 -0.02 0.00 0.00 0.00 0.00 46.02 44.23 1g1a n GLY 10 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1g1a h PHE 11 N -0.79 -0.19 -0.17 1.61 3.57 -1.84 0.48 116.94 119.61 1g1a h PHE 11 Ca -0.32 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.12 1g1a h PHE 11 Cb 1.13 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.95 1g1a h PHE 11 CO 0.00 -0.07 -0.14 0.82 -2.23 0.00 0.00 178.31 176.69 1g1a h ILE 12 N -0.08 1.33 -0.59 1.41 2.04 -1.93 -3.16 117.51 116.53 1g1a h ILE 12 Ca 0.00 -1.27 0.12 0.00 1.00 0.00 0.00 64.86 64.71 1g1a h ILE 12 Cb 0.09 1.79 -0.09 0.00 -0.74 0.00 0.00 36.82 37.86 1g1a h ILE 12 CO -0.04 0.38 0.07 1.23 0.00 0.00 0.00 178.15 179.79 1g1a h GLY 13 N 0.05 0.70 1.69 5.37 0.00 -1.70 0.13 103.07 109.32 1g1a h GLY 13 Ca 0.03 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 1g1a h GLY 13 CO 0.04 -0.15 0.08 1.48 0.00 0.00 0.00 176.54 177.99 1g1a h SER 14 N 0.19 0.36 -0.18 0.19 4.64 0.54 -1.37 113.55 117.92 1g1a h SER 14 Ca 0.31 -0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.49 1g1a h SER 14 Cb 0.48 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 1g1a h SER 14 CO -0.45 0.36 -0.22 0.00 -0.87 0.00 0.00 176.83 175.66 1g1a h ALA 15 N 1.69 1.01 -0.15 5.18 0.00 -0.97 -1.17 119.26 124.86 1g1a h ALA 15 Ca 0.10 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1g1a h ALA 15 Cb 0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1g1a h ALA 15 CO -0.01 0.59 -0.02 0.28 0.00 0.00 0.00 179.25 180.09 1g1a h VAL 16 N 0.55 1.28 0.11 0.00 2.07 -0.44 -1.45 116.25 118.37 1g1a h VAL 16 Ca 0.08 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 1g1a h VAL 16 Cb 0.67 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1g1a h VAL 16 CO 0.05 0.28 -0.05 0.58 0.02 0.00 0.00 177.57 178.44 1g1a h VAL 17 N -0.02 0.92 -0.95 2.57 2.07 -1.16 -1.32 116.25 118.36 1g1a h VAL 17 Ca 0.04 -0.10 0.08 0.00 0.82 0.00 0.00 66.70 67.55 1g1a h VAL 17 Cb 0.44 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 1g1a h VAL 17 CO 0.01 0.02 0.60 0.03 0.02 0.00 0.00 177.57 178.25 1g1a h ARG 18 N -0.19 1.01 -0.45 1.57 3.08 -1.22 -1.77 114.38 116.41 1g1a h ARG 18 Ca -0.01 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1g1a h ARG 18 Cb 0.15 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1g1a h ARG 18 CO 0.02 0.67 0.11 1.25 -1.07 0.00 0.00 179.97 180.95 1g1a h HIS 19 N 1.04 0.76 -0.72 3.04 2.76 -0.81 -0.54 115.15 120.68 1g1a h HIS 19 Ca 0.44 -0.09 -0.07 0.00 -2.20 0.00 0.00 60.37 58.44 1g1a h HIS 19 Cb 0.28 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 1g1a h HIS 19 CO -0.02 0.70 0.18 0.82 -1.30 0.00 0.00 177.93 178.31 1g1a h ILE 20 N 0.60 1.26 -0.06 6.26 2.04 -0.71 0.31 117.51 127.21 1g1a h ILE 20 Ca 0.14 -0.98 -0.24 0.00 1.00 0.00 0.00 64.86 64.79 1g1a h ILE 20 Cb 0.32 0.52 0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1g1a h ILE 20 CO 0.00 0.38 -0.90 0.40 0.00 0.00 0.00 178.15 178.03 1g1a h ILE 21 N 1.09 1.31 0.07 -0.67 1.08 -1.22 -2.57 117.51 116.59 1g1a h ILE 21 Ca 0.23 -2.18 -0.26 0.00 -0.39 0.00 0.00 64.86 62.27 1g1a h ILE 21 Cb 0.37 2.22 -0.01 0.00 -3.07 0.00 0.00 36.82 36.33 1g1a h ILE 21 CO 0.00 0.67 -1.22 0.11 -0.69 0.00 0.00 178.15 177.02 1g1a h LYS 22 N 0.40 0.15 0.00 2.37 1.57 -1.06 -3.40 116.57 116.60 1g1a h LYS 22 Ca -0.08 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1g1a h LYS 22 Cb 1.53 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.93 1g1a h LYS 22 CO 0.17 1.07 -0.14 0.09 -0.57 0.00 0.00 179.45 180.08 1g1a n ASN 23 N -3.42 1.70 -3.87 0.86 3.02 0.09 -5.08 115.26 108.57 1g1a n ASN 23 Ca -0.07 -2.78 -0.13 0.00 -0.03 0.00 0.00 54.58 51.57 1g1a n ASN 23 Cb 1.00 -0.36 -0.08 0.00 -0.61 0.00 0.00 39.78 39.72 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 -2.08 0.00 -0.75 3.41 -4.23 -0.97 -4.97 115.64 106.06 1g1a s THR 24 Ca 0.23 -1.81 0.24 0.00 -1.18 0.00 0.00 61.69 59.17 1g1a s THR 24 Cb 0.20 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.56 1g1a s THR 24 CO 0.02 0.00 1.24 0.00 -0.54 0.00 0.00 174.62 175.34 1g1a n GLN 25 N -0.40 0.19 -1.30 3.99 1.13 -1.26 -4.77 117.38 114.96 1g1a n GLN 25 Ca 0.02 0.03 -0.31 0.00 -1.94 0.00 0.00 57.00 54.79 1g1a n GLN 25 Cb 0.64 -1.59 0.09 0.00 0.11 0.00 0.00 30.24 29.48 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 -3.72 4.51 0.30 1.08 1.01 -1.26 -4.66 116.67 113.92 1g1a s ASP 26 Ca 0.07 1.87 0.09 0.00 0.71 0.00 0.00 52.55 55.29 1g1a s ASP 26 Cb 0.15 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.51 1g1a s ASP 26 CO 0.75 -2.03 0.03 0.42 0.21 0.00 0.00 175.17 174.54 1g1a s THR 27 N -2.81 3.10 -0.08 -1.27 -4.23 -0.69 -4.71 115.64 104.95 1g1a s THR 27 Ca 0.62 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 59.19 1g1a s THR 27 Cb -0.18 -2.85 0.02 0.00 1.34 0.00 0.00 72.50 70.84 1g1a s THR 27 CO 0.54 -0.28 0.20 0.54 -0.54 0.00 0.00 174.62 175.08 1g1a s VAL 28 N -2.41 -0.01 -0.28 2.29 0.11 0.28 -1.66 120.40 118.73 1g1a s VAL 28 Ca 0.34 0.04 -0.03 0.00 -2.93 0.00 0.00 61.98 59.39 1g1a s VAL 28 Cb -0.04 -0.29 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 1g1a s VAL 28 CO 0.20 0.02 0.00 0.54 -3.33 0.00 0.00 175.10 172.53 1g1a s VAL 29 N 0.38 3.26 -0.33 2.04 0.11 -1.06 -0.45 120.40 124.34 1g1a s VAL 29 Ca -0.02 -1.01 -0.14 0.00 -2.93 0.00 0.00 61.98 57.88 1g1a s VAL 29 Cb -0.04 -2.72 -0.02 0.00 -1.53 0.00 0.00 36.38 32.08 1g1a s VAL 29 CO -0.02 0.08 0.31 0.21 -3.33 0.00 0.00 175.10 172.35 1g1a s ASN 30 N 1.36 6.13 -0.32 3.54 3.04 0.16 -1.65 114.94 127.21 1g1a s ASN 30 Ca -0.00 -0.26 -0.11 0.00 0.04 0.00 0.00 52.86 52.53 1g1a s ASN 30 Cb -0.18 -2.17 -0.02 0.00 -1.54 0.00 0.00 41.25 37.34 1g1a s ASN 30 CO -0.01 -0.28 0.19 -0.63 -3.04 0.00 0.00 177.10 173.33 1g1a s ILE 31 N 1.90 4.97 -0.09 -5.21 1.01 0.38 -0.43 121.20 123.73 1g1a s ILE 31 Ca 0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.44 1g1a s ILE 31 Cb -0.17 -3.51 0.04 0.00 0.01 0.00 0.00 42.46 38.82 1g1a s ILE 31 CO 0.11 0.07 0.23 -0.62 0.00 0.00 0.00 174.94 174.73 1g1a s ASP 32 N 1.68 -0.24 0.00 3.58 -1.08 -0.87 -1.38 116.67 118.35 1g1a s ASP 32 Ca 0.06 0.48 0.29 0.00 -0.52 0.00 0.00 52.55 52.86 1g1a s ASP 32 Cb -0.17 0.42 1.22 0.00 -1.46 0.00 0.00 42.92 42.93 1g1a s ASP 32 CO 0.09 -0.13 1.84 2.29 0.52 0.00 0.00 175.17 179.78 1g1a n LYS 33 N 3.70 1.31 -3.36 4.34 2.85 -0.74 -2.59 118.16 123.66 1g1a n LYS 33 Ca -0.20 -0.61 -0.14 0.00 -1.05 0.00 0.00 58.31 56.30 1g1a n LYS 33 Cb 0.55 -1.49 0.02 0.00 -0.65 0.00 0.00 35.03 33.47 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 -0.31 -4.83 0.00 -5.58 4.77 -1.26 -4.87 117.00 104.92 1g1a n LEU 34 Ca 0.19 -0.56 -0.19 0.00 -0.03 0.00 0.00 56.01 55.42 1g1a n LEU 34 Cb 0.29 -2.79 0.13 0.00 -2.33 0.00 0.00 43.42 38.73 1g1a n LEU 34 CO 0.19 -0.28 0.57 0.35 -1.33 0.00 0.00 177.39 176.88 1g1a n THR 35 N -2.72 0.00 0.25 -5.08 -2.24 -1.26 -4.77 114.28 98.45 1g1a n THR 35 Ca -0.09 -0.62 0.15 0.00 -2.27 0.00 0.00 64.05 61.22 1g1a n THR 35 Cb 0.58 -1.66 0.69 0.00 -2.10 0.00 0.00 70.33 67.83 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 -1.53 0.00 0.00 4.78 -0.00 -2.04 0.03 116.97 118.21 1g1a h TYR 36 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.45 1g1a h TYR 36 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.50 1g1a h TYR 36 CO 0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 178.16 177.53 1g1a h ALA 37 N 1.18 0.68 -2.23 0.10 0.00 -1.97 -3.47 119.26 113.55 1g1a h ALA 37 Ca 0.07 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.53 1g1a h ALA 37 Cb 1.04 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1g1a h ALA 37 CO -0.00 0.00 0.32 0.20 0.00 0.00 0.00 179.25 179.77 1g1a s GLY 38 N -4.27 2.54 -0.27 0.00 0.00 -0.00 -4.62 107.32 100.69 1g1a s GLY 38 Ca 0.03 0.41 -0.01 0.00 0.00 0.00 0.00 44.72 45.14 1g1a s GLY 38 CO 0.74 0.74 0.29 0.21 0.00 0.00 0.00 173.10 175.08 1g1a s ASN 39 N -1.97 1.56 0.63 1.64 3.84 -0.10 -4.80 114.94 115.73 1g1a s ASN 39 Ca 0.57 -0.61 0.40 0.00 0.21 0.00 0.00 52.86 53.42 1g1a s ASN 39 Cb -0.13 0.52 2.14 0.00 -0.55 0.00 0.00 41.25 43.23 1g1a s ASN 39 CO 0.17 -0.37 2.29 -0.07 -2.79 0.00 0.00 177.10 176.32 1g1a h LEU 40 N 8.27 0.00 -1.54 3.21 3.38 -1.83 -1.22 115.31 125.59 1g1a h LEU 40 Ca -0.14 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1g1a h LEU 40 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1g1a h LEU 40 CO 0.32 0.01 -0.20 -0.33 0.09 0.00 0.00 178.44 178.34 1g1a h GLU 41 N 0.00 0.00 0.00 1.13 5.08 -1.88 -1.42 114.58 117.50 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 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1g1a h GLU 41 CO 0.00 0.20 0.00 0.43 -1.00 0.00 0.00 179.01 178.64 1g1a n SER 42 N -3.60 0.00 -0.21 1.42 7.64 -0.46 -2.23 113.62 116.18 1g1a n SER 42 Ca -0.01 0.39 0.02 0.00 1.01 0.00 0.00 58.87 60.28 1g1a n SER 42 Cb 0.33 -0.45 0.03 0.00 -1.01 0.00 0.00 64.21 63.11 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 -1.45 1.65 -0.27 -3.43 4.77 -0.57 -4.82 117.00 112.88 1g1a n LEU 43 Ca 0.06 -1.25 0.08 0.00 -0.03 0.00 0.00 56.01 54.87 1g1a n LEU 43 Cb 0.20 -0.03 0.21 0.00 -2.33 0.00 0.00 43.42 41.48 1g1a n LEU 43 CO 0.17 0.38 0.90 0.77 -1.33 0.00 0.00 177.39 178.27 1g1a h SER 44 N 0.93 -0.11 -0.35 -1.43 4.64 -1.08 -0.87 113.55 115.27 1g1a h SER 44 Ca 0.00 0.18 -0.19 0.00 -0.47 0.00 0.00 61.79 61.31 1g1a h SER 44 Cb 0.30 0.27 -0.11 0.00 -0.31 0.00 0.00 62.40 62.56 1g1a h SER 44 CO 0.00 -0.13 0.25 -0.90 -0.87 0.00 0.00 176.83 175.18 1g1a n ASP 45 N -5.25 3.97 0.00 4.97 5.68 -1.26 -3.59 116.55 121.08 1g1a n ASP 45 Ca 0.17 -2.64 0.00 0.00 -0.50 0.00 0.00 54.79 51.82 1g1a n ASP 45 Cb 0.55 -0.73 0.00 0.00 -1.14 0.00 0.00 41.12 39.79 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 0.11 0.00 0.18 2.12 0.13 -0.45 -4.92 119.36 116.52 1g1a n ILE 46 Ca 0.21 0.00 0.04 0.00 -1.10 0.00 0.00 62.75 61.90 1g1a n ILE 46 Cb 0.82 0.01 0.21 0.00 -0.84 0.00 0.00 39.64 39.85 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 0.00 0.14 0.00 9.51 3.41 -0.51 -2.13 113.62 124.05 1g1a n SER 47 Ca 0.00 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.27 1g1a n SER 47 Cb 0.00 -0.58 0.04 0.00 -0.26 0.00 0.00 64.21 63.41 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 -1.68 0.06 -1.75 4.33 1.02 -1.26 -4.95 120.64 116.41 1g1a n GLU 48 Ca 0.01 -0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.73 1g1a n GLU 48 Cb 0.06 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 29.96 1g1a n GLU 48 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1g1a n SER 49 N -1.59 3.67 0.03 1.62 2.88 -0.90 -4.85 113.62 114.47 1g1a n SER 49 Ca 0.04 1.20 0.10 0.00 -1.33 0.00 0.00 58.87 58.88 1g1a n SER 49 Cb 0.35 -1.59 0.42 0.00 -0.75 0.00 0.00 64.21 62.65 1g1a n SER 49 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1g1a n ASN 50 N 1.07 0.20 -0.75 -3.46 0.23 -1.26 -1.88 115.26 109.40 1g1a n ASN 50 Ca 0.04 0.54 0.08 0.00 -0.53 0.00 0.00 54.58 54.71 1g1a n ASN 50 Cb 0.38 -0.59 0.24 0.00 -2.08 0.00 0.00 39.78 37.73 1g1a n ASN 50 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1g1a n ARG 51 N -1.71 1.96 -4.87 -3.83 1.74 -1.26 -4.84 116.66 103.85 1g1a n ARG 51 Ca 0.04 -1.48 -0.27 0.00 -0.77 0.00 0.00 57.85 55.38 1g1a n ARG 51 Cb 0.24 -1.36 -0.16 0.00 -1.02 0.00 0.00 32.46 30.16 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 -1.52 1.79 -0.01 -1.55 5.04 -0.79 -0.56 117.35 119.75 1g1a s TYR 52 Ca 0.30 -0.54 0.01 0.00 -2.44 0.00 0.00 57.07 54.40 1g1a s TYR 52 Cb 0.16 -1.21 0.00 0.00 0.35 0.00 0.00 41.96 41.26 1g1a s TYR 52 CO 0.22 -0.19 -0.04 -0.80 -1.34 0.00 0.00 175.55 173.39 1g1a s ASN 53 N 0.10 0.62 -0.11 4.32 -0.87 0.40 -4.82 114.94 114.57 1g1a s ASN 53 Ca -0.06 -0.09 -0.01 0.00 -1.57 0.00 0.00 52.86 51.14 1g1a s ASN 53 Cb -0.12 -0.13 -0.02 0.00 -0.02 0.00 0.00 41.25 40.95 1g1a s ASN 53 CO 0.03 0.03 -0.08 0.12 -2.57 0.00 0.00 177.10 174.63 1g1a s PHE 54 N 0.14 2.91 -0.20 2.20 5.36 -1.26 0.39 117.98 127.52 1g1a s PHE 54 Ca -0.01 -0.28 -0.00 0.00 -0.96 0.00 0.00 56.93 55.68 1g1a s PHE 54 Cb -0.05 -1.82 0.05 0.00 -0.34 0.00 0.00 43.02 40.86 1g1a s PHE 54 CO -0.00 0.05 -0.05 -1.21 -1.46 0.00 0.00 175.22 172.55 1g1a s GLU 55 N -0.10 1.48 -1.01 10.12 0.41 0.42 -4.94 118.70 125.09 1g1a s GLU 55 Ca 0.00 -0.74 -0.23 0.00 -0.41 0.00 0.00 54.97 53.59 1g1a s GLU 55 Cb -0.13 -2.32 0.02 0.00 -1.78 0.00 0.00 34.13 29.92 1g1a s GLU 55 CO 0.03 -0.53 1.60 -1.58 -0.49 0.00 0.00 175.26 174.29 1g1a s HIS 56 N 1.53 2.35 0.09 1.61 5.65 -1.26 -2.05 115.29 123.22 1g1a s HIS 56 Ca -0.03 -0.49 -0.10 0.00 0.25 0.00 0.00 55.06 54.70 1g1a s HIS 56 Cb -0.17 -4.53 0.01 0.00 -1.18 0.00 0.00 32.58 26.71 1g1a s HIS 56 CO -0.07 -1.87 0.24 0.00 -0.65 0.00 0.00 174.74 172.38 1g1a s ALA 57 N 6.33 -0.39 -0.17 1.58 0.00 -1.07 -4.92 121.76 123.12 1g1a s ALA 57 Ca 0.53 -0.48 -0.13 0.00 0.00 0.00 0.00 51.96 51.89 1g1a s ALA 57 Cb -0.01 0.52 -0.05 0.00 0.00 0.00 0.00 23.12 23.58 1g1a s ALA 57 CO -0.06 -0.53 0.25 0.34 0.00 0.00 0.00 175.76 175.75 1g1a s ASP 58 N -2.82 6.37 0.66 0.00 -1.08 -1.26 -1.79 116.67 116.75 1g1a s ASP 58 Ca 0.04 0.43 0.41 0.00 -0.52 0.00 0.00 52.55 52.91 1g1a s ASP 58 Cb 0.04 -2.15 2.25 0.00 -1.46 0.00 0.00 42.92 41.60 1g1a s ASP 58 CO -0.11 0.12 2.30 0.16 0.52 0.00 0.00 175.17 178.16 1g1a h ILE 59 N 4.68 0.07 0.00 4.11 3.07 -1.95 -0.06 117.51 127.43 1g1a h ILE 59 Ca -0.41 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.00 1g1a h ILE 59 Cb 1.16 0.95 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 1g1a h ILE 59 CO 0.76 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.86 1g1a s ASP 61 N -4.92 6.74 0.26 0.00 -1.08 -0.04 -4.87 116.67 112.76 1g1a s ASP 61 Ca 0.07 -2.17 -0.02 0.00 -0.52 0.00 0.00 52.55 49.91 1g1a s ASP 61 Cb 0.10 -2.58 0.49 0.00 -1.46 0.00 0.00 42.92 39.47 1g1a s ASP 61 CO 0.55 -1.27 1.78 0.28 0.52 0.00 0.00 175.17 177.03 1g1a h SER 62 N 8.20 0.59 0.15 -0.34 0.02 -1.85 -0.21 113.55 120.12 1g1a h SER 62 Ca 0.38 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.40 1g1a h SER 62 Cb 0.91 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.42 1g1a h SER 62 CO 1.45 0.29 -0.07 0.00 -1.14 0.00 0.00 176.83 177.35 1g1a h ALA 63 N 1.52 -0.20 0.15 3.77 0.00 -1.97 0.17 119.26 122.69 1g1a h ALA 63 Ca 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1g1a h ALA 63 Cb 0.55 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1g1a h ALA 63 CO -0.32 -0.61 -0.07 0.93 0.00 0.00 0.00 179.25 179.18 1g1a h GLU 64 N -0.22 -0.19 -0.72 0.00 4.39 -1.82 -1.47 114.58 114.55 1g1a h GLU 64 Ca -0.02 0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1g1a h GLU 64 Cb 0.17 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 1g1a h GLU 64 CO 0.03 -0.07 0.48 0.82 -1.16 0.00 0.00 179.01 179.11 1g1a h ILE 65 N -0.27 1.02 -0.34 3.13 1.08 -0.97 -0.98 117.51 120.18 1g1a h ILE 65 Ca -0.02 -0.26 -0.05 0.00 -0.39 0.00 0.00 64.86 64.14 1g1a h ILE 65 Cb 0.21 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 34.15 1g1a h ILE 65 CO 0.03 0.14 0.00 0.74 -0.69 0.00 0.00 178.15 178.37 1g1a h THR 66 N 0.75 1.26 -0.18 -0.27 2.02 -0.32 -1.66 112.91 114.51 1g1a h THR 66 Ca 0.31 -0.96 0.04 0.00 0.77 0.00 0.00 66.41 66.57 1g1a h THR 66 Cb 0.26 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1g1a h THR 66 CO -0.10 0.32 -0.05 -0.09 0.37 0.00 0.00 175.52 175.97 1g1a h ARG 67 N 0.40 -0.00 -0.74 6.66 2.43 -0.35 -1.68 114.38 121.11 1g1a h ARG 67 Ca 0.10 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1g1a h ARG 67 Cb 0.45 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 1g1a h ARG 67 CO 0.02 -0.00 0.42 0.82 -1.51 0.00 0.00 179.97 179.72 1g1a h ILE 68 N -0.00 0.96 -0.30 1.20 2.04 -0.96 0.12 117.51 120.57 1g1a h ILE 68 Ca 0.09 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1g1a h ILE 68 Cb 0.13 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1g1a h ILE 68 CO -0.19 0.14 0.08 -0.26 0.00 0.00 0.00 178.15 177.92 1g1a h PHE 69 N 0.76 0.49 -0.90 1.37 -1.00 -1.03 -1.02 116.94 115.61 1g1a h PHE 69 Ca 0.34 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 61.06 1g1a h PHE 69 Cb 0.23 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 39.61 1g1a h PHE 69 CO -0.07 0.52 0.54 0.93 -1.61 0.00 0.00 178.31 178.62 1g1a h GLU 70 N 0.32 1.22 -0.20 1.51 5.08 -0.66 0.25 114.58 122.10 1g1a h GLU 70 Ca 0.09 -0.11 -0.20 0.00 -1.00 0.00 0.00 59.36 58.14 1g1a h GLU 70 Cb 0.27 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1g1a h GLU 70 CO -0.00 0.86 -0.66 0.37 -1.00 0.00 0.00 179.01 178.58 1g1a h GLN 71 N 1.24 0.77 -0.00 2.33 4.15 -0.56 -3.32 115.11 119.70 1g1a h GLN 71 Ca 0.32 -0.55 0.00 0.00 0.77 0.00 0.00 58.65 59.19 1g1a h GLN 71 Cb -0.04 0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.74 1g1a h GLN 71 CO -0.06 1.18 -0.89 0.66 -1.93 0.00 0.00 178.83 177.79 1g1a n TYR 72 N -3.96 0.00 -3.76 3.99 4.02 -0.41 -5.01 117.16 112.04 1g1a n TYR 72 Ca -0.05 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.56 1g1a n TYR 72 Cb 0.68 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.99 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 -1.27 -1.04 -1.75 -0.72 6.02 0.87 -4.84 117.38 114.65 1g1a n GLN 73 Ca 0.05 0.45 -0.40 0.00 -0.01 0.00 0.00 57.00 57.09 1g1a n GLN 73 Cb 0.35 -1.94 0.02 0.00 1.02 0.00 0.00 30.24 29.69 1g1a n GLN 73 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1g1a n PRO 74 N -3.02 2.09 0.10 -1.09 -0.02 -1.26 -4.92 135.00 126.89 1g1a n PRO 74 Ca -0.23 0.75 0.12 0.00 -2.02 0.00 0.00 63.50 62.11 1g1a n PRO 74 Cb 0.57 -2.59 0.03 0.00 -0.02 0.00 0.00 33.50 31.49 1g1a n PRO 74 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1g1a h ASP 75 N 2.08 0.00 -4.96 2.55 3.32 -0.29 -3.48 116.42 115.64 1g1a h ASP 75 Ca -0.50 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 56.53 1g1a h ASP 75 Cb 1.28 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.72 1g1a h ASP 75 CO 0.60 0.02 0.27 0.00 -1.72 0.00 0.00 179.24 178.41 1g1a s ALA 76 N -3.33 -1.58 -0.03 3.45 0.00 -1.07 -3.63 121.76 115.57 1g1a s ALA 76 Ca 0.01 0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.43 1g1a s ALA 76 Cb 0.10 0.79 -0.00 0.00 0.00 0.00 0.00 23.12 24.01 1g1a s ALA 76 CO 0.78 -0.81 -0.16 0.08 0.00 0.00 0.00 175.76 175.64 1g1a s VAL 77 N -3.65 1.32 -0.27 0.00 1.01 -0.03 -0.12 120.40 118.65 1g1a s VAL 77 Ca 0.04 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1g1a s VAL 77 Cb -0.02 -1.13 0.07 0.00 0.00 0.00 0.00 36.38 35.31 1g1a s VAL 77 CO -0.08 0.38 -0.03 -0.04 0.00 0.00 0.00 175.10 175.33 1g1a s MET 78 N -0.03 1.65 -0.52 2.72 -1.94 0.27 -0.17 119.30 121.28 1g1a s MET 78 Ca -0.02 -1.31 -0.19 0.00 -1.71 0.00 0.00 55.69 52.47 1g1a s MET 78 Cb -0.10 -2.76 0.07 0.00 2.01 0.00 0.00 34.83 34.05 1g1a s MET 78 CO 0.01 -0.71 0.62 -1.58 -0.01 0.00 0.00 175.02 173.35 1g1a s HIS 79 N 1.22 3.05 -0.13 -0.03 2.46 0.02 -1.36 115.29 120.52 1g1a s HIS 79 Ca -0.01 -0.66 0.03 0.00 0.47 0.00 0.00 55.06 54.89 1g1a s HIS 79 Cb -0.19 -3.61 -0.03 0.00 -0.13 0.00 0.00 32.58 28.61 1g1a s HIS 79 CO -0.08 -1.07 0.12 1.28 -2.47 0.00 0.00 174.74 172.52 1g1a n LEU 80 N 6.13 0.13 -4.70 8.88 4.32 -1.02 -1.86 117.00 128.89 1g1a n LEU 80 Ca -0.08 -0.48 -0.42 0.00 -0.02 0.00 0.00 56.01 55.02 1g1a n LEU 80 Cb 0.45 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.22 1g1a n LEU 80 CO 0.54 0.03 1.37 0.00 -1.22 0.00 0.00 177.39 178.12 1g1a s ALA 81 N -1.32 3.74 0.02 -1.18 0.00 -1.07 -4.74 121.76 117.20 1g1a s ALA 81 Ca 0.01 1.34 -0.28 0.00 0.00 0.00 0.00 51.96 53.04 1g1a s ALA 81 Cb 0.02 -3.71 0.09 0.00 0.00 0.00 0.00 23.12 19.52 1g1a s ALA 81 CO 0.12 -1.10 0.75 0.00 0.00 0.00 0.00 175.76 175.53 1g1a s ALA 82 N 2.40 -1.75 -0.24 0.00 0.00 -1.26 -4.85 121.76 116.06 1g1a s ALA 82 Ca 0.76 1.00 -0.06 0.00 0.00 0.00 0.00 51.96 53.65 1g1a s ALA 82 Cb -0.43 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1g1a s ALA 82 CO 0.34 -0.58 0.04 -2.00 0.00 0.00 0.00 175.76 173.56 1g1a s GLU 83 N -2.53 3.61 0.00 0.00 2.56 -1.26 -4.97 118.70 116.10 1g1a s GLU 83 Ca -0.02 -0.50 0.20 0.00 0.00 0.00 0.00 54.97 54.65 1g1a s GLU 83 Cb -0.01 -3.24 0.05 0.00 2.00 0.00 0.00 34.13 32.93 1g1a s GLU 83 CO -0.04 -0.16 1.03 -1.13 -0.56 0.00 0.00 175.26 174.41 1g1a n SER 84 N 4.80 2.13 -4.67 -1.70 3.41 -1.26 -4.77 113.62 111.56 1g1a n SER 84 Ca -0.17 -1.56 -0.38 0.00 -0.26 0.00 0.00 58.87 56.50 1g1a n SER 84 Cb 0.51 0.32 -0.08 0.00 -0.26 0.00 0.00 64.21 64.71 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 3.36 -0.57 7.33 5.65 -1.26 -5.01 115.29 122.74 1g1a s HIS 85 Ca 0.19 0.53 -0.21 0.00 0.25 0.00 0.00 55.06 55.81 1g1a s HIS 85 Cb 0.16 -2.48 0.06 0.00 -1.18 0.00 0.00 32.58 29.15 1g1a s HIS 85 CO 0.42 -0.00 0.81 0.08 -0.65 0.00 0.00 174.74 175.39 1g1a s VAL 86 N 1.29 4.60 0.59 0.89 1.01 -1.26 -4.46 120.40 123.05 1g1a s VAL 86 Ca 0.17 -0.35 0.08 0.00 0.00 0.00 0.00 61.98 61.87 1g1a s VAL 86 Cb -0.14 -4.49 0.08 0.00 0.00 0.00 0.00 36.38 31.82 1g1a s VAL 86 CO 0.07 -1.11 0.66 1.51 0.00 0.00 0.00 175.10 176.23 1g1a s ASP 87 N 3.15 4.84 0.10 3.32 -4.77 -1.26 -5.11 116.67 116.94 1g1a s ASP 87 Ca 0.20 -1.08 0.06 0.00 -3.30 0.00 0.00 52.55 48.42 1g1a s ASP 87 Cb -0.18 0.51 -0.03 0.00 -1.09 0.00 0.00 42.92 42.13 1g1a s ASP 87 CO 0.12 -1.33 -0.14 -0.13 0.70 0.00 0.00 175.17 174.39 1g1a s ARG 88 N -4.55 0.94 -0.13 2.11 0.52 -1.26 -4.79 118.95 111.79 1g1a s ARG 88 Ca 0.50 -1.13 0.02 0.00 -0.52 0.00 0.00 55.73 54.60 1g1a s ARG 88 Cb -0.04 -0.88 -0.00 0.00 0.52 0.00 0.00 34.95 34.55 1g1a s ARG 88 CO 0.32 0.18 -0.19 0.45 0.02 0.00 0.00 175.30 176.08 1g1a s SER 89 N -2.16 3.44 0.00 0.23 0.15 -1.26 -4.92 113.70 109.17 1g1a s SER 89 Ca 0.05 -0.49 0.31 0.00 0.70 0.00 0.00 55.95 56.51 1g1a s SER 89 Cb -0.07 -1.50 1.62 0.00 -1.71 0.00 0.00 66.02 64.37 1g1a s SER 89 CO 0.03 0.13 2.07 -0.38 1.20 0.00 0.00 173.24 176.29 1g1a n ILE 90 N 3.73 0.00 -3.36 6.45 5.41 -1.26 -4.22 119.36 126.11 1g1a n ILE 90 Ca -0.19 -0.08 -0.22 0.00 1.00 0.00 0.00 62.75 63.26 1g1a n ILE 90 Cb 0.52 -0.18 -0.09 0.00 -0.71 0.00 0.00 39.64 39.18 1g1a n ILE 90 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1g1a s THR 91 N -2.02 -0.07 0.00 1.39 2.01 -1.26 -5.13 115.64 110.56 1g1a s THR 91 Ca 0.44 -1.60 0.00 0.00 0.31 0.00 0.00 61.69 60.84 1g1a s THR 91 Cb 0.22 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.83 1g1a s THR 91 CO 0.36 -0.83 0.00 0.61 -0.69 0.00 0.00 174.62 174.07 1g1a n GLY 92 N 3.77 1.14 3.76 4.40 0.00 -1.26 -4.85 105.19 112.15 1g1a n GLY 92 Ca 0.16 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 1g1a n GLY 92 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1g1a s PRO 93 N 0.00 4.21 0.79 1.61 0.04 -1.26 -4.37 135.00 136.01 1g1a s PRO 93 Ca 0.00 2.43 -0.11 0.00 0.04 0.00 0.00 61.00 63.36 1g1a s PRO 93 Cb 0.00 -3.05 0.06 0.00 0.04 0.00 0.00 34.50 31.56 1g1a s PRO 93 CO 0.00 -0.46 1.09 0.00 0.04 0.00 0.00 177.00 177.66 1g1a s ALA 94 N -0.47 2.18 0.19 8.56 0.00 -1.26 -4.79 121.76 126.17 1g1a s ALA 94 Ca 0.57 0.09 -0.12 0.00 0.00 0.00 0.00 51.96 52.50 1g1a s ALA 94 Cb -0.44 -3.21 0.19 0.00 0.00 0.00 0.00 23.12 19.66 1g1a s ALA 94 CO 0.51 -1.78 1.76 0.00 0.00 0.00 0.00 175.76 176.25 1g1a h ALA 95 N -1.14 0.69 -0.36 0.00 0.00 -1.91 -1.66 119.26 114.88 1g1a h ALA 95 Ca -0.45 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1g1a h ALA 95 Cb 1.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1g1a h ALA 95 CO 0.54 -0.15 0.18 0.27 0.00 0.00 0.00 179.25 180.10 1g1a h PHE 96 N 0.44 0.48 0.01 0.00 -0.00 -1.86 0.20 116.94 116.22 1g1a h PHE 96 Ca 0.25 -0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 58.22 1g1a h PHE 96 Cb 0.24 -0.16 0.00 0.00 -0.00 0.00 0.00 35.95 36.03 1g1a h PHE 96 CO -0.13 0.36 -0.00 0.82 -0.00 0.00 0.00 178.31 179.35 1g1a h ILE 97 N 0.50 1.36 -0.03 0.88 1.08 -1.77 -1.15 117.51 118.38 1g1a h ILE 97 Ca 0.13 -1.11 0.03 0.00 -0.39 0.00 0.00 64.86 63.52 1g1a h ILE 97 Cb 0.04 2.11 -0.04 0.00 -3.07 0.00 0.00 36.82 35.87 1g1a h ILE 97 CO -0.02 0.29 -0.17 -0.33 -0.69 0.00 0.00 178.15 177.23 1g1a h GLU 98 N -0.49 -0.25 0.06 2.37 4.39 -0.68 -1.63 114.58 118.35 1g1a h GLU 98 Ca -0.00 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 1g1a h GLU 98 Cb 0.48 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1g1a h GLU 98 CO 0.00 -0.17 -0.03 1.15 -1.16 0.00 0.00 179.01 178.81 1g1a h THR 99 N -0.26 1.28 -0.25 1.13 2.02 -0.69 0.34 112.91 116.48 1g1a h THR 99 Ca 0.06 -1.37 -0.12 0.00 0.77 0.00 0.00 66.41 65.76 1g1a h THR 99 Cb 0.34 2.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1g1a h THR 99 CO -0.18 0.33 -0.30 0.78 0.37 0.00 0.00 175.52 176.52 1g1a h ASN 100 N -0.71 0.70 0.00 4.18 2.35 -1.28 -3.08 115.58 117.74 1g1a h ASN 100 Ca -0.01 -0.49 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1g1a h ASN 100 Cb 0.60 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1g1a h ASN 100 CO 0.01 1.05 -0.12 -0.38 -1.65 0.00 0.00 177.43 176.35 1g1a n ILE 101 N -4.29 0.24 -0.25 2.81 5.41 -0.64 -3.70 119.36 118.94 1g1a n ILE 101 Ca -0.05 0.45 0.02 0.00 1.00 0.00 0.00 62.75 64.17 1g1a n ILE 101 Cb 0.48 -1.64 0.15 0.00 -0.71 0.00 0.00 39.64 37.91 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 -0.16 0.84 -0.85 1.39 2.07 -1.41 -1.19 116.25 116.94 1g1a h VAL 102 Ca 0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1g1a h VAL 102 Cb 0.12 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.02 1g1a h VAL 102 CO 0.00 0.11 0.54 1.23 0.02 0.00 0.00 177.57 179.48 1g1a h GLY 103 N 0.61 1.21 1.05 2.17 0.00 -0.22 0.27 103.07 108.17 1g1a h GLY 103 Ca 0.36 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 1g1a h GLY 103 CO -0.28 0.46 -0.15 -0.84 0.00 0.00 0.00 176.54 175.73 1g1a h THR 104 N 1.16 1.27 -0.13 4.70 2.02 -1.37 -0.32 112.91 120.25 1g1a h THR 104 Ca 0.31 -1.29 0.01 0.00 0.77 0.00 0.00 66.41 66.21 1g1a h THR 104 Cb -0.10 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1g1a h THR 104 CO -0.06 0.44 0.04 0.22 0.37 0.00 0.00 175.52 176.53 1g1a h TYR 105 N 0.75 0.08 -0.45 3.16 3.20 -0.47 0.13 116.97 123.38 1g1a h TYR 105 Ca 0.11 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1g1a h TYR 105 Cb 0.71 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 1g1a h TYR 105 CO 0.05 0.04 0.27 0.00 -1.64 0.00 0.00 178.16 176.88 1g1a h ALA 106 N 1.08 0.57 -0.43 1.82 0.00 -0.27 -1.36 119.26 120.67 1g1a h ALA 106 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1g1a h ALA 106 Cb 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1g1a h ALA 106 CO -0.05 -0.05 0.21 1.25 0.00 0.00 0.00 179.25 180.61 1g1a h LEU 107 N 0.54 0.56 -0.81 0.00 5.85 -0.74 -2.21 115.31 118.49 1g1a h LEU 107 Ca 0.18 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1g1a h LEU 107 Cb 0.01 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 40.83 1g1a h LEU 107 CO -0.08 0.52 0.48 -0.07 -0.34 0.00 0.00 178.44 178.95 1g1a h LEU 108 N 0.55 0.71 -0.54 2.25 3.38 -0.35 -0.69 115.31 120.62 1g1a h LEU 108 Ca 0.15 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1g1a h LEU 108 Cb 0.11 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1g1a h LEU 108 CO -0.02 0.43 -0.11 -0.33 0.09 0.00 0.00 178.44 178.51 1g1a h GLU 109 N 0.84 1.03 -0.27 1.13 4.39 -0.78 0.70 114.58 121.61 1g1a h GLU 109 Ca 0.38 -0.38 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1g1a h GLU 109 Cb 0.28 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1g1a h GLU 109 CO -0.21 1.07 0.03 0.28 -1.16 0.00 0.00 179.01 179.02 1g1a h VAL 110 N 0.90 1.24 -0.23 3.13 2.07 -1.03 -2.64 116.25 119.69 1g1a h VAL 110 Ca 0.14 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1g1a h VAL 110 Cb 0.68 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1g1a h VAL 110 CO 0.05 0.26 -0.00 0.00 0.02 0.00 0.00 177.57 177.90 1g1a h ALA 111 N 0.86 1.57 -0.04 1.67 0.00 -0.98 -1.52 119.26 120.81 1g1a h ALA 111 Ca 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1g1a h ALA 111 Cb 0.36 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1g1a h ALA 111 CO 0.01 0.32 0.00 -0.09 0.00 0.00 0.00 179.25 179.48 1g1a h ARG 112 N 0.34 0.07 -0.25 0.00 2.43 -0.63 -0.31 114.38 116.02 1g1a h ARG 112 Ca 0.08 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1g1a h ARG 112 Cb 0.23 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1g1a h ARG 112 CO 0.01 0.35 0.16 0.87 -1.51 0.00 0.00 179.97 179.84 1g1a h LYS 113 N -0.23 0.34 -0.00 0.20 1.57 -1.27 -0.99 116.57 116.19 1g1a h LYS 113 Ca 0.01 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1g1a h LYS 113 Cb 0.32 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1g1a h LYS 113 CO 0.00 0.26 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.05 1g1a h TYR 114 N 0.33 -0.45 -0.42 -1.35 3.20 -1.23 -2.67 116.97 114.37 1g1a h TYR 114 Ca 0.09 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.99 1g1a h TYR 114 Cb -0.00 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 1g1a h TYR 114 CO -0.05 -0.25 0.25 2.35 -1.64 0.00 0.00 178.16 178.82 1g1a h TRP 115 N -0.28 0.48 0.00 -3.82 7.01 -0.85 -2.38 115.95 116.11 1g1a h TRP 115 Ca 0.05 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.07 1g1a h TRP 115 Cb 0.35 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.26 1g1a h TRP 115 CO -0.22 0.28 0.00 0.66 -2.79 0.00 0.00 178.44 176.37 1g1a h SER 116 N 0.52 0.00 -0.51 2.65 4.64 -1.03 -2.36 113.55 117.46 1g1a h SER 116 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1g1a h SER 116 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1g1a h SER 116 CO -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.89 1g1a n ALA 117 N -1.89 3.62 -1.00 5.18 0.00 -0.90 -4.88 120.51 120.64 1g1a n ALA 117 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 53.44 51.45 1g1a n ALA 117 Cb 0.19 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1g1a n ALA 117 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1g1a n LEU 118 N 0.39 0.00 0.00 0.00 4.77 -0.89 -5.05 117.00 116.21 1g1a n LEU 118 Ca 0.26 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1g1a n LEU 118 Cb 1.11 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.20 1g1a n LEU 118 CO 0.28 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1g1a n GLY 119 N 3.28 0.94 0.00 -0.72 0.00 -1.26 -4.95 105.19 102.47 1g1a n GLY 119 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1g1a n GLY 119 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1g1a n GLU 120 N 0.00 0.00 0.09 1.61 1.02 -1.26 -0.65 120.64 121.45 1g1a n GLU 120 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 1g1a n GLU 120 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1g1a n GLU 120 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1g1a h ASP 121 N 0.00 -0.20 0.00 1.62 1.82 -1.99 -1.81 116.42 115.86 1g1a h ASP 121 Ca 0.00 0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1g1a h ASP 121 Cb 0.00 0.05 -0.00 0.00 0.68 0.00 0.00 39.33 40.06 1g1a h ASP 121 CO 0.00 -0.14 -0.00 0.50 -1.61 0.00 0.00 179.24 177.99 1g1a h LYS 122 N -0.23 0.00 0.00 0.28 3.64 -1.28 -1.69 116.57 117.28 1g1a h LYS 122 Ca -0.02 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 1g1a h LYS 122 Cb 0.18 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1g1a h LYS 122 CO 0.04 0.00 -0.68 -0.22 -2.27 0.00 0.00 179.45 176.32 1g1a h LYS 123 N 0.00 0.00 0.00 1.90 3.64 -1.16 -2.31 116.57 118.64 1g1a h LYS 123 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1g1a h LYS 123 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1g1a h LYS 123 CO 0.00 0.68 -0.40 -0.91 -2.27 0.00 0.00 179.45 176.55 1g1a h ASN 124 N 0.00 0.00 0.41 4.20 2.35 -0.41 -3.31 115.58 118.82 1g1a h ASN 124 Ca -0.01 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1g1a h ASN 124 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1g1a h ASN 124 CO 0.09 0.04 -1.39 0.59 -1.65 0.00 0.00 177.43 175.11 1g1a n ASN 125 N -2.46 0.47 -4.68 5.81 3.02 -1.06 -4.97 115.26 111.39 1g1a n ASN 125 Ca 0.03 -0.01 -0.39 0.00 -0.03 0.00 0.00 54.58 54.17 1g1a n ASN 125 Cb 0.48 1.16 0.03 0.00 -0.61 0.00 0.00 39.78 40.84 1g1a n ASN 125 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1g1a n PHE 126 N -2.26 1.74 -3.80 3.10 7.35 -0.88 -4.96 117.46 117.76 1g1a n PHE 126 Ca -0.01 0.47 -0.13 0.00 -0.76 0.00 0.00 57.45 57.03 1g1a n PHE 126 Cb 0.51 -2.30 -0.13 0.00 0.35 0.00 0.00 39.48 37.92 1g1a n PHE 126 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1g1a s ARG 127 N -2.52 0.13 -0.37 -4.13 1.81 -1.24 -4.68 118.95 107.94 1g1a s ARG 127 Ca 0.68 0.24 -0.01 0.00 -1.72 0.00 0.00 55.73 54.92 1g1a s ARG 127 Cb -0.46 -0.01 0.10 0.00 -0.45 0.00 0.00 34.95 34.12 1g1a s ARG 127 CO 0.52 -0.07 0.13 0.12 -0.68 0.00 0.00 175.30 175.33 1g1a s PHE 128 N 0.42 3.57 -0.37 -0.53 2.19 0.78 -0.85 117.98 123.19 1g1a s PHE 128 Ca -0.03 -2.45 -0.16 0.00 0.33 0.00 0.00 56.93 54.61 1g1a s PHE 128 Cb -0.04 -2.93 -0.00 0.00 -1.31 0.00 0.00 43.02 38.73 1g1a s PHE 128 CO -0.02 -0.94 0.42 -1.58 1.83 0.00 0.00 175.22 174.94 1g1a s HIS 129 N 1.10 3.19 -0.24 10.12 5.65 0.76 -0.57 115.29 135.30 1g1a s HIS 129 Ca 0.06 -0.07 -0.13 0.00 0.25 0.00 0.00 55.06 55.17 1g1a s HIS 129 Cb -0.21 -2.80 -0.04 0.00 -1.18 0.00 0.00 32.58 28.34 1g1a s HIS 129 CO -0.05 -0.54 0.28 -1.58 -0.65 0.00 0.00 174.74 172.21 1g1a s HIS 130 N 2.15 3.30 -0.14 3.88 2.46 0.61 -0.80 115.29 126.75 1g1a s HIS 130 Ca 0.14 0.36 -0.16 0.00 0.47 0.00 0.00 55.06 55.87 1g1a s HIS 130 Cb -0.16 -2.43 -0.04 0.00 -0.13 0.00 0.00 32.58 29.81 1g1a s HIS 130 CO 0.13 -0.06 0.38 0.42 -2.47 0.00 0.00 174.74 173.14 1g1a s ILE 131 N 1.48 5.25 0.27 0.89 1.09 -0.77 -1.86 121.20 127.54 1g1a s ILE 131 Ca 0.12 0.74 0.05 0.00 -1.10 0.00 0.00 60.65 60.47 1g1a s ILE 131 Cb -0.15 -3.72 -0.02 0.00 -1.06 0.00 0.00 42.46 37.51 1g1a s ILE 131 CO 0.08 0.36 0.18 -0.24 -0.10 0.00 0.00 174.94 175.22 1g1a n SER 132 N 3.60 -0.07 -4.62 3.58 2.88 0.73 -4.85 113.62 114.87 1g1a n SER 132 Ca -0.10 -2.65 -0.27 0.00 -1.33 0.00 0.00 58.87 54.53 1g1a n SER 132 Cb 0.52 1.13 -0.09 0.00 -0.75 0.00 0.00 64.21 65.02 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 -2.93 3.46 -0.84 2.46 -1.32 -1.26 -2.27 115.64 112.93 1g1a s THR 133 Ca 0.26 -1.52 0.20 0.00 -1.21 0.00 0.00 61.69 59.42 1g1a s THR 133 Cb 0.01 -2.72 0.18 0.00 -1.51 0.00 0.00 72.50 68.46 1g1a s THR 133 CO 0.18 -0.10 1.62 -0.90 -2.21 0.00 0.00 174.62 173.22 1g1a n ASP 134 N -0.00 0.23 0.32 8.08 5.75 0.06 -3.05 116.55 127.93 1g1a n ASP 134 Ca -0.10 0.55 0.20 0.00 -0.01 0.00 0.00 54.79 55.43 1g1a n ASP 134 Cb 0.55 -0.60 1.05 0.00 -1.03 0.00 0.00 41.12 41.09 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 0.00 0.11 5.08 -1.90 -2.36 114.58 115.51 1g1a h GLU 135 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1g1a h GLU 135 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1g1a h GLU 135 CO 0.00 0.01 -0.03 -0.39 -1.00 0.00 0.00 179.01 177.60 1g1a h VAL 136 N 0.00 0.38 0.00 3.13 -1.51 -1.82 -2.30 116.25 114.13 1g1a h VAL 136 Ca -0.00 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.31 1g1a h VAL 136 Cb 0.12 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 30.39 1g1a h VAL 136 CO 0.00 0.03 0.00 -1.22 -1.23 0.00 0.00 177.57 175.15 1g1a n TYR 137 N -3.57 0.00 -0.01 5.19 0.53 -0.89 -0.40 117.16 118.02 1g1a n TYR 137 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.85 1g1a n TYR 137 Cb 0.13 -0.39 0.00 0.00 -1.03 0.00 0.00 39.34 38.05 1g1a n TYR 137 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1g1a n GLY 138 N 0.98 0.70 3.25 2.72 0.00 -0.87 -4.12 105.19 107.84 1g1a n GLY 138 Ca 0.09 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 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 1.62 0.22 1.61 2.15 -1.26 -4.90 116.67 112.11 1g1a s ASP 139 Ca 0.00 -1.06 0.11 0.00 0.43 0.00 0.00 52.55 52.03 1g1a s ASP 139 Cb 0.00 0.03 -0.05 0.00 -0.30 0.00 0.00 42.92 42.60 1g1a s ASP 139 CO 0.00 -0.41 -0.18 -0.76 -0.17 0.00 0.00 175.17 173.65 1g1a s LEU 140 N -3.17 2.65 0.16 -1.34 1.43 -1.01 -5.03 118.68 112.37 1g1a s LEU 140 Ca 0.18 -0.83 -0.34 0.00 -1.03 0.00 0.00 54.13 52.11 1g1a s LEU 140 Cb 0.04 -1.30 -0.14 0.00 0.03 0.00 0.00 46.19 44.81 1g1a s LEU 140 CO 0.01 0.09 1.49 -2.65 0.23 0.00 0.00 176.35 175.52 1g1a n PRO 141 N -0.12 1.91 -2.70 1.29 -0.02 -1.26 -4.22 135.00 129.88 1g1a n PRO 141 Ca -0.10 0.69 -0.32 0.00 -2.02 0.00 0.00 63.50 61.75 1g1a n PRO 141 Cb 0.57 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.59 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 0.65 3.39 0.28 6.00 2.46 -1.26 -4.88 115.29 121.93 1g1a s HIS 142 Ca 0.78 1.45 0.02 0.00 0.47 0.00 0.00 55.06 57.77 1g1a s HIS 142 Cb -0.73 -2.74 0.59 0.00 -0.13 0.00 0.00 32.58 29.56 1g1a s HIS 142 CO 0.42 -0.18 1.81 -1.35 -2.47 0.00 0.00 174.74 172.96 1g1a h PRO 143 N 1.50 0.84 0.00 2.88 0.11 -1.94 -1.43 132.00 133.96 1g1a h PRO 143 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1g1a h PRO 143 Cb 1.18 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1g1a h PRO 143 CO 0.62 0.56 0.00 -0.40 -0.21 0.00 0.00 178.00 178.57 1g1a n ASP 144 N -4.70 0.00 -0.11 -2.05 5.68 -1.26 -3.21 116.55 110.90 1g1a n ASP 144 Ca 0.19 -0.29 -0.16 0.00 -0.50 0.00 0.00 54.79 54.04 1g1a n ASP 144 Cb 0.42 -0.18 -0.11 0.00 -1.14 0.00 0.00 41.12 40.10 1g1a n ASP 144 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1g1a n GLU 145 N -1.18 0.61 -2.89 0.11 1.02 -0.57 -4.71 120.64 113.03 1g1a n GLU 145 Ca 0.13 0.12 -0.44 0.00 -0.02 0.00 0.00 57.16 56.96 1g1a n GLU 145 Cb 0.15 -1.46 -0.02 0.00 -0.02 0.00 0.00 31.44 30.09 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 -2.46 4.72 0.54 2.62 1.01 -1.03 -5.00 120.40 120.79 1g1a s VAL 146 Ca -0.30 -1.79 -0.20 0.00 0.00 0.00 0.00 61.98 59.69 1g1a s VAL 146 Cb 0.08 -4.85 -0.07 0.00 0.00 0.00 0.00 36.38 31.54 1g1a s VAL 146 CO 0.55 -1.59 0.91 1.21 0.00 0.00 0.00 175.10 176.18 1g1a n GLU 147 N 6.57 0.99 -0.55 2.72 4.07 -1.26 -4.62 120.64 128.56 1g1a n GLU 147 Ca 0.29 0.37 0.06 0.00 -0.06 0.00 0.00 57.16 57.82 1g1a n GLU 147 Cb 0.48 -2.05 -0.02 0.00 -0.06 0.00 0.00 31.44 29.79 1g1a n GLU 147 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1g1a n ASN 148 N -0.13 -2.82 -3.82 4.31 5.03 -1.26 -3.93 115.26 112.64 1g1a n ASN 148 Ca 0.12 0.22 -0.30 0.00 0.87 0.00 0.00 54.58 55.49 1g1a n ASN 148 Cb 0.45 -1.94 -0.10 0.00 -1.02 0.00 0.00 39.78 37.17 1g1a n ASN 148 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1g1a n SER 149 N -4.37 0.65 0.00 6.41 7.64 -1.26 -4.53 113.62 118.16 1g1a n SER 149 Ca -0.00 -2.17 0.00 0.00 1.01 0.00 0.00 58.87 57.71 1g1a n SER 149 Cb 0.56 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1g1a n SER 149 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1g1a n VAL 150 N 6.84 0.00 0.00 0.44 0.31 -1.25 -5.10 118.33 119.57 1g1a n VAL 150 Ca 0.37 0.38 0.00 0.00 -0.01 0.00 0.00 64.34 65.08 1g1a n VAL 150 Cb 0.41 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 1g1a n VAL 150 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1g1a n THR 151 N -1.83 0.00 -4.02 2.52 -1.04 -1.26 -5.14 114.28 103.50 1g1a n THR 151 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.72 1g1a n THR 151 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 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 0.00 3.96 0.74 -4.42 1.43 -1.26 -5.09 118.68 114.05 1g1a s LEU 152 Ca 0.00 0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 1g1a s LEU 152 Cb 0.00 -2.60 0.03 0.00 0.03 0.00 0.00 46.19 43.65 1g1a s LEU 152 CO 0.00 0.13 1.13 -2.65 0.23 0.00 0.00 176.35 175.18 1g1a n PRO 153 N 0.06 0.53 -4.29 1.29 -0.02 -1.26 -5.07 135.00 126.24 1g1a n PRO 153 Ca -0.08 0.24 -0.16 0.00 -2.02 0.00 0.00 63.50 61.49 1g1a n PRO 153 Cb 0.53 -2.37 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 1g1a n PRO 153 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1g1a s LEU 154 N -4.32 2.38 -0.12 2.45 1.43 -1.26 -4.91 118.68 114.33 1g1a s LEU 154 Ca 0.76 -1.10 -0.30 0.00 -1.03 0.00 0.00 54.13 52.46 1g1a s LEU 154 Cb -0.33 -0.32 -0.02 0.00 0.03 0.00 0.00 46.19 45.55 1g1a s LEU 154 CO 0.48 -0.41 1.13 -0.36 0.23 0.00 0.00 176.35 177.42 1g1a s PHE 155 N -3.36 3.25 0.41 0.29 2.99 -0.14 -4.84 117.98 116.59 1g1a s PHE 155 Ca 0.22 1.33 0.07 0.00 0.00 0.00 0.00 56.93 58.55 1g1a s PHE 155 Cb 0.04 -3.34 -0.08 0.00 0.00 0.00 0.00 43.02 39.64 1g1a s PHE 155 CO 0.04 -0.92 0.01 0.95 -0.00 0.00 0.00 175.22 175.31 1g1a s THR 156 N 2.56 1.91 -0.28 0.64 -4.23 -1.26 -1.38 115.64 113.59 1g1a s THR 156 Ca 0.51 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.24 1g1a s THR 156 Cb -0.21 -2.95 0.22 0.00 1.34 0.00 0.00 72.50 70.90 1g1a s THR 156 CO 0.17 0.00 1.66 -0.62 -0.54 0.00 0.00 174.62 175.28 1g1a n GLU 157 N -0.96 0.15 -0.42 3.99 4.71 -1.26 -1.80 120.64 125.05 1g1a n GLU 157 Ca -0.05 0.59 0.08 0.00 -0.01 0.00 0.00 57.16 57.76 1g1a n GLU 157 Cb 0.67 -1.93 0.26 0.00 -1.01 0.00 0.00 31.44 29.43 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 -2.23 1.79 -2.53 2.62 -2.24 -1.26 -4.98 114.28 105.45 1g1a n THR 158 Ca -0.01 -1.41 -0.40 0.00 -2.27 0.00 0.00 64.05 59.96 1g1a n THR 158 Cb 0.08 0.08 -0.05 0.00 -2.10 0.00 0.00 70.33 68.34 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 -2.00 3.59 0.26 4.28 2.01 -0.75 -4.98 115.64 118.06 1g1a s THR 159 Ca 0.39 1.60 -0.30 0.00 0.31 0.00 0.00 61.69 63.69 1g1a s THR 159 Cb 0.27 -4.02 -0.10 0.00 0.01 0.00 0.00 72.50 68.66 1g1a s THR 159 CO 0.15 0.38 1.47 0.00 -0.69 0.00 0.00 174.62 175.93 1g1a s ALA 160 N -1.17 3.65 0.32 7.40 0.00 -1.26 -4.96 121.76 125.74 1g1a s ALA 160 Ca 0.44 1.39 -0.29 0.00 0.00 0.00 0.00 51.96 53.50 1g1a s ALA 160 Cb -0.31 -3.58 -0.10 0.00 0.00 0.00 0.00 23.12 19.13 1g1a s ALA 160 CO 0.39 -0.80 1.33 0.71 0.00 0.00 0.00 175.76 177.39 1g1a s TYR 161 N -0.06 3.01 -0.45 0.00 1.51 -1.26 -4.64 117.35 115.46 1g1a s TYR 161 Ca 0.60 1.35 0.06 0.00 -1.01 0.00 0.00 57.07 58.07 1g1a s TYR 161 Cb -0.43 -3.72 0.31 0.00 -0.11 0.00 0.00 41.96 38.01 1g1a s TYR 161 CO 0.45 -2.03 1.12 0.00 -1.11 0.00 0.00 175.55 173.98 1g1a n ALA 162 N 0.97 -1.21 -1.65 3.71 0.00 0.47 -4.94 120.51 117.86 1g1a n ALA 162 Ca 0.01 -1.31 -0.47 0.00 0.00 0.00 0.00 53.44 51.68 1g1a n ALA 162 Cb 0.41 -1.45 -0.04 0.00 0.00 0.00 0.00 19.45 18.37 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 0.61 1.83 -0.01 0.00 -0.02 -1.22 -3.26 135.00 132.94 1g1a n PRO 163 Ca 0.05 0.65 0.04 0.00 -2.02 0.00 0.00 63.50 62.23 1g1a n PRO 163 Cb 0.70 -2.32 0.04 0.00 -0.02 0.00 0.00 33.50 31.90 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 2.52 1.75 -4.33 2.55 3.41 -1.26 -4.84 113.62 113.42 1g1a n SER 164 Ca 0.14 -1.38 -0.18 0.00 -0.26 0.00 0.00 58.87 57.20 1g1a n SER 164 Cb 0.28 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.12 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 -0.72 2.22 0.24 4.04 1.04 -1.26 -5.02 113.70 114.24 1g1a s SER 165 Ca 0.10 -1.10 -0.05 0.00 0.48 0.00 0.00 55.95 55.38 1g1a s SER 165 Cb 0.07 -0.07 0.33 0.00 0.10 0.00 0.00 66.02 66.45 1g1a s SER 165 CO 0.11 -0.33 1.86 -0.65 0.98 0.00 0.00 173.24 175.21 1g1a h PRO 166 N 2.54 1.00 0.39 4.02 0.11 -1.99 0.64 132.00 138.71 1g1a h PRO 166 Ca -0.38 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1g1a h PRO 166 Cb 1.22 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1g1a h PRO 166 CO 0.64 0.66 -0.19 -0.92 -0.21 0.00 0.00 178.00 177.98 1g1a h TYR 167 N 1.03 -0.48 -0.39 0.65 3.20 -1.96 0.47 116.97 119.49 1g1a h TYR 167 Ca 0.38 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.21 1g1a h TYR 167 Cb 0.13 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 1g1a h TYR 167 CO -0.03 -0.27 0.16 0.66 -1.64 0.00 0.00 178.16 177.04 1g1a h SER 168 N -0.57 0.49 -0.65 -2.11 4.64 -1.88 -1.24 113.55 112.24 1g1a h SER 168 Ca -0.05 -0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 1g1a h SER 168 Cb 0.43 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 1g1a h SER 168 CO 0.09 0.45 0.25 0.00 -0.87 0.00 0.00 176.83 176.75 1g1a h ALA 169 N 1.63 0.85 -0.65 5.18 0.00 -0.47 0.86 119.26 126.65 1g1a h ALA 169 Ca 0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1g1a h ALA 169 Cb 0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1g1a h ALA 169 CO -0.01 0.48 0.12 0.66 0.00 0.00 0.00 179.25 180.49 1g1a h SER 170 N 0.92 1.01 -0.43 0.00 4.64 -0.03 -2.01 113.55 117.65 1g1a h SER 170 Ca 0.22 -0.23 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1g1a h SER 170 Cb 0.22 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1g1a h SER 170 CO -0.02 0.99 -0.26 0.11 -0.87 0.00 0.00 176.83 176.79 1g1a h LYS 171 N 1.00 0.95 -0.65 4.77 1.79 -0.86 -2.20 116.57 121.37 1g1a h LYS 171 Ca 0.20 -0.42 0.01 0.00 -2.18 0.00 0.00 60.65 58.26 1g1a h LYS 171 Cb 0.40 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.00 1g1a h LYS 171 CO 0.01 1.09 0.43 0.00 -1.08 0.00 0.00 179.45 179.90 1g1a h ALA 172 N 0.89 1.56 -0.36 3.86 0.00 -0.64 -1.48 119.26 123.09 1g1a h ALA 172 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1g1a h ALA 172 Cb 0.83 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1g1a h ALA 172 CO 0.07 0.40 -0.13 0.77 0.00 0.00 0.00 179.25 180.36 1g1a h SER 173 N 0.86 0.74 -0.38 0.00 0.02 -1.06 -1.95 113.55 111.77 1g1a h SER 173 Ca 0.25 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 1g1a h SER 173 Cb -0.06 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1g1a h SER 173 CO -0.06 0.96 0.18 0.77 -1.14 0.00 0.00 176.83 177.54 1g1a h SER 174 N 0.51 0.54 -0.12 3.07 4.64 -0.86 -0.83 113.55 120.50 1g1a h SER 174 Ca 0.08 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1g1a h SER 174 Cb 0.66 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 1g1a h SER 174 CO 0.04 0.49 0.06 0.44 -0.87 0.00 0.00 176.83 177.00 1g1a h ASP 175 N 0.60 0.15 -0.95 4.97 5.19 -0.97 -1.21 116.42 124.20 1g1a h ASP 175 Ca 0.15 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1g1a h ASP 175 Cb 0.11 -0.04 -0.05 0.00 0.18 0.00 0.00 39.33 39.54 1g1a h ASP 175 CO -0.02 0.20 0.58 0.45 -3.12 0.00 0.00 179.24 177.34 1g1a h HIS 176 N 0.09 1.25 -0.34 4.55 3.86 -0.69 -1.84 115.15 122.03 1g1a h HIS 176 Ca 0.04 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1g1a h HIS 176 Cb 0.08 -0.41 -0.02 0.00 1.06 0.00 0.00 27.41 28.12 1g1a h HIS 176 CO -0.04 0.82 0.15 -0.07 0.86 0.00 0.00 177.93 179.65 1g1a h LEU 177 N 1.31 0.45 -0.70 2.43 3.38 -0.86 -1.10 115.31 120.23 1g1a h LEU 177 Ca 0.34 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1g1a h LEU 177 Cb -0.07 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 1g1a h LEU 177 CO -0.07 0.47 0.37 0.58 0.09 0.00 0.00 178.44 179.88 1g1a h VAL 178 N 0.41 0.90 -0.27 1.22 2.07 -0.75 -1.53 116.25 118.31 1g1a h VAL 178 Ca 0.12 -0.22 -0.19 0.00 0.82 0.00 0.00 66.70 67.22 1g1a h VAL 178 Cb 0.14 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1g1a h VAL 178 CO -0.01 0.12 -0.58 0.03 0.02 0.00 0.00 177.57 177.14 1g1a h ARG 179 N 0.65 0.85 -0.50 1.57 3.08 -1.16 -3.08 114.38 115.79 1g1a h ARG 179 Ca 0.33 -0.56 -0.03 0.00 0.07 0.00 0.00 59.98 59.79 1g1a h ARG 179 Cb 0.28 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1g1a h ARG 179 CO -0.23 1.19 0.18 0.00 -1.07 0.00 0.00 179.97 180.04 1g1a h ALA 180 N 0.68 1.37 -0.13 0.04 0.00 -0.79 -1.57 119.26 118.87 1g1a h ALA 180 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1g1a h ALA 180 Cb 1.19 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1g1a h ALA 180 CO 0.13 0.46 -0.22 -1.49 0.00 0.00 0.00 179.25 178.13 1g1a h TRP 181 N 0.72 0.23 0.48 0.00 6.55 -1.25 0.35 115.95 123.04 1g1a h TRP 181 Ca 0.17 -0.04 -0.02 0.00 0.95 0.00 0.00 58.89 59.95 1g1a h TRP 181 Cb 0.18 -0.06 0.00 0.00 -0.86 0.00 0.00 29.16 28.42 1g1a h TRP 181 CO 0.01 0.43 -0.23 -0.09 -1.05 0.00 0.00 178.44 177.51 1g1a h ARG 182 N 0.20 -0.62 0.00 0.49 9.65 -1.28 0.24 114.38 123.06 1g1a h ARG 182 Ca 0.04 0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 58.93 1g1a h ARG 182 Cb 0.51 0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 29.22 1g1a h ARG 182 CO 0.03 -0.34 -0.15 -0.09 2.80 0.00 0.00 179.97 182.22 1g1a h ARG 183 N -1.08 0.00 0.10 0.20 9.65 -1.09 0.52 114.38 122.68 1g1a h ARG 183 Ca -0.07 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.45 1g1a h ARG 183 Cb 0.57 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.12 1g1a h ARG 183 CO 0.11 0.15 -2.05 2.41 2.80 0.00 0.00 179.97 183.38 1g1a n THR 184 N -4.18 1.73 0.29 0.20 -1.04 0.12 -4.56 114.28 106.85 1g1a n THR 184 Ca -0.02 -0.62 0.03 0.00 -2.04 0.00 0.00 64.05 61.40 1g1a n THR 184 Cb 0.22 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.04 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 -3.48 0.00 -0.99 -1.42 4.01 0.05 -4.99 117.16 110.34 1g1a n TYR 185 Ca -0.34 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 1g1a n TYR 185 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 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 0.71 0.44 3.74 2.72 0.00 0.18 -4.98 105.19 108.00 1g1a n GLY 186 Ca 0.03 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 1g1a n GLY 186 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g1a s LEU 187 N 0.00 4.38 -0.45 0.99 2.96 -1.15 -4.87 118.68 120.55 1g1a s LEU 187 Ca 0.00 2.63 -0.29 0.00 -0.22 0.00 0.00 54.13 56.26 1g1a s LEU 187 Cb 0.00 -3.62 -0.30 0.00 0.50 0.00 0.00 46.19 42.77 1g1a s LEU 187 CO 0.00 -0.71 1.79 -2.65 -1.32 0.00 0.00 176.35 173.46 1g1a n PRO 188 N 2.63 0.26 -4.10 0.98 -0.02 -1.26 -4.17 135.00 129.32 1g1a n PRO 188 Ca 0.08 -1.36 -0.24 0.00 -2.02 0.00 0.00 63.50 59.95 1g1a n PRO 188 Cb 0.40 -3.01 -0.05 0.00 -0.02 0.00 0.00 33.50 30.82 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 9.96 4.47 0.03 3.45 -4.23 -1.26 -0.16 115.64 127.90 1g1a s THR 189 Ca 0.71 -1.23 0.02 0.00 -1.18 0.00 0.00 61.69 60.01 1g1a s THR 189 Cb 0.09 -3.35 -0.02 0.00 1.34 0.00 0.00 72.50 70.56 1g1a s THR 189 CO 0.27 -0.22 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.43 1g1a s ILE 190 N -1.93 0.49 -0.05 2.99 1.01 0.27 -0.35 121.20 123.62 1g1a s ILE 190 Ca 0.32 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 60.20 1g1a s ILE 190 Cb -0.09 -0.51 0.01 0.00 0.01 0.00 0.00 42.46 41.88 1g1a s ILE 190 CO 0.24 -0.22 -0.11 -0.69 0.00 0.00 0.00 174.94 174.16 1g1a s VAL 191 N -0.97 0.99 -0.01 2.92 1.01 -1.00 -0.28 120.40 123.06 1g1a s VAL 191 Ca -0.06 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1g1a s VAL 191 Cb -0.07 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1g1a s VAL 191 CO 0.00 0.31 -0.21 0.42 0.00 0.00 0.00 175.10 175.63 1g1a s THR 192 N 0.45 1.62 -0.13 3.92 -4.23 -0.78 -1.26 115.64 115.23 1g1a s THR 192 Ca -0.09 -0.89 0.02 0.00 -1.18 0.00 0.00 61.69 59.54 1g1a s THR 192 Cb -0.13 -1.35 0.02 0.00 1.34 0.00 0.00 72.50 72.38 1g1a s THR 192 CO 0.02 0.44 -0.17 0.20 -0.54 0.00 0.00 174.62 174.57 1g1a s ASN 193 N -0.52 2.72 0.35 3.99 -0.87 -0.72 -0.19 114.94 119.69 1g1a s ASN 193 Ca 0.08 -0.50 0.08 0.00 -1.57 0.00 0.00 52.86 50.94 1g1a s ASN 193 Cb -0.08 -1.23 -0.07 0.00 -0.02 0.00 0.00 41.25 39.85 1g1a s ASN 193 CO -0.01 0.02 -0.04 0.00 -2.57 0.00 0.00 177.10 174.50 1g1a n SER 195 N -0.79 0.27 -4.68 0.00 3.41 -0.86 -0.76 113.62 110.21 1g1a n SER 195 Ca -0.05 -1.25 -0.46 0.00 -0.26 0.00 0.00 58.87 56.85 1g1a n SER 195 Cb 0.65 -0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.37 1g1a n SER 195 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1g1a n ASN 196 N -3.04 3.64 -4.88 4.04 4.13 -0.96 -4.72 115.26 113.47 1g1a n ASN 196 Ca 0.04 0.98 -0.31 0.00 1.68 0.00 0.00 54.58 56.97 1g1a n ASN 196 Cb 0.15 -1.44 -0.05 0.00 -1.54 0.00 0.00 39.78 36.90 1g1a n ASN 196 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1g1a s ASN 197 N 3.43 6.57 0.15 6.41 0.02 -1.26 0.08 114.94 130.35 1g1a s ASN 197 Ca 0.88 0.84 -0.13 0.00 -1.02 0.00 0.00 52.86 53.43 1g1a s ASN 197 Cb -0.60 -2.19 0.01 0.00 0.02 0.00 0.00 41.25 38.49 1g1a s ASN 197 CO 0.45 -0.08 0.36 -0.72 0.02 0.00 0.00 177.10 177.13 1g1a s TYR 198 N -1.85 0.10 -4.21 2.20 1.13 -0.88 -4.89 117.35 108.95 1g1a s TYR 198 Ca 0.46 -0.46 0.00 0.00 -1.41 0.00 0.00 57.07 55.66 1g1a s TYR 198 Cb -0.11 0.13 0.00 0.00 -1.10 0.00 0.00 41.96 40.88 1g1a s TYR 198 CO 0.23 -0.74 0.00 0.41 -2.51 0.00 0.00 175.55 172.94 1g1a n GLY 199 N -0.23 0.88 3.70 5.49 0.00 -1.26 -0.82 105.19 112.95 1g1a n GLY 199 Ca -0.11 -1.97 -0.38 0.00 0.00 0.00 0.00 46.02 43.57 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 1.23 -1.23 1.61 -0.02 -1.26 -3.26 135.00 132.07 1g1a n PRO 200 Ca 0.00 0.47 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 1g1a n PRO 200 Cb 0.00 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.02 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 -1.56 0.00 -2.80 6.00 4.02 -1.26 -5.00 117.16 116.56 1g1a n TYR 201 Ca 0.13 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.61 1g1a n TYR 201 Cb 0.46 -1.78 -0.03 0.00 -0.02 0.00 0.00 39.34 37.98 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 -2.13 3.57 0.47 -0.72 2.46 -1.20 -4.70 115.29 113.04 1g1a s HIS 202 Ca 0.00 1.52 -0.22 0.00 0.47 0.00 0.00 55.06 56.83 1g1a s HIS 202 Cb 0.00 -3.06 -0.10 0.00 -0.13 0.00 0.00 32.58 29.29 1g1a s HIS 202 CO 0.00 -0.07 0.79 1.19 -2.47 0.00 0.00 174.74 174.17 1g1a n PHE 203 N 4.33 0.32 -0.20 3.88 3.01 -1.26 -4.88 117.46 122.67 1g1a n PHE 203 Ca 0.05 0.53 0.24 0.00 1.01 0.00 0.00 57.45 59.28 1g1a n PHE 203 Cb 0.50 -2.10 0.64 0.00 -0.01 0.00 0.00 39.48 38.51 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 0.94 0.16 -0.00 -1.08 0.11 -1.94 -2.04 132.00 128.14 1g1a h PRO 204 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1g1a h PRO 204 Cb 1.37 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1g1a h PRO 204 CO 0.53 0.10 -0.14 0.39 -0.21 0.00 0.00 178.00 178.67 1g1a n GLU 205 N -4.38 0.48 -1.59 1.05 4.71 -1.26 -2.91 120.64 116.74 1g1a n GLU 205 Ca 0.19 -0.16 -0.33 0.00 -0.01 0.00 0.00 57.16 56.85 1g1a n GLU 205 Cb 0.84 -1.50 0.06 0.00 -1.01 0.00 0.00 31.44 29.84 1g1a n GLU 205 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1g1a s LYS 206 N -2.63 2.56 0.01 3.49 -0.14 -0.77 -4.72 119.74 117.55 1g1a s LYS 206 Ca 0.24 1.40 -0.02 0.00 -1.36 0.00 0.00 55.97 56.23 1g1a s LYS 206 Cb 0.20 -1.92 -0.01 0.00 -1.68 0.00 0.00 37.83 34.42 1g1a s LYS 206 CO 0.51 -1.44 1.04 1.25 -0.76 0.00 0.00 175.35 175.95 1g1a h LEU 207 N -0.27 -0.14 -0.48 3.17 5.85 -1.90 0.33 115.31 121.86 1g1a h LEU 207 Ca -0.46 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1g1a h LEU 207 Cb 1.25 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 1g1a h LEU 207 CO 0.53 -0.02 0.28 0.40 -0.34 0.00 0.00 178.44 179.29 1g1a h ILE 208 N -0.01 1.16 -0.79 4.05 2.04 -1.96 -1.79 117.51 120.20 1g1a h ILE 208 Ca 0.01 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1g1a h ILE 208 Cb 0.04 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 1g1a h ILE 208 CO -0.05 0.16 0.39 -0.65 0.00 0.00 0.00 178.15 178.00 1g1a h PRO 209 N 0.64 1.14 -0.84 2.37 0.11 -1.81 -2.23 132.00 131.38 1g1a h PRO 209 Ca 0.17 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1g1a h PRO 209 Cb 0.01 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 30.87 1g1a h PRO 209 CO -0.03 0.87 0.51 1.25 -0.21 0.00 0.00 178.00 180.39 1g1a h LEU 210 N 1.12 1.00 -0.37 2.35 5.85 0.04 -0.08 115.31 125.23 1g1a h LEU 210 Ca 0.27 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 1g1a h LEU 210 Cb 0.10 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1g1a h LEU 210 CO -0.04 0.76 -0.03 0.58 -0.34 0.00 0.00 178.44 179.38 1g1a h VAL 211 N 1.15 1.27 -0.18 1.05 2.07 -1.03 0.07 116.25 120.65 1g1a h VAL 211 Ca 0.30 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1g1a h VAL 211 Cb -0.06 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1g1a h VAL 211 CO -0.06 0.35 0.10 0.40 0.02 0.00 0.00 177.57 178.38 1g1a h ILE 212 N 0.47 1.11 -0.12 4.57 2.04 -0.92 -0.93 117.51 123.73 1g1a h ILE 212 Ca 0.10 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.63 1g1a h ILE 212 Cb 0.51 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1g1a h ILE 212 CO 0.02 0.10 -0.08 -0.07 0.00 0.00 0.00 178.15 178.13 1g1a h LEU 213 N 0.19 0.28 -0.96 1.44 3.38 -0.98 -2.77 115.31 115.89 1g1a h LEU 213 Ca 0.06 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.63 1g1a h LEU 213 Cb 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1g1a h LEU 213 CO -0.01 0.66 0.63 0.78 0.09 0.00 0.00 178.44 180.59 1g1a h ASN 214 N -0.10 1.06 0.27 -0.43 -0.26 -0.97 -1.26 115.58 113.88 1g1a h ASN 214 Ca 0.02 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1g1a h ASN 214 Cb 0.56 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.55 1g1a h ASN 214 CO 0.02 0.73 -0.31 0.00 -1.06 0.00 0.00 177.43 176.81 1g1a h ALA 215 N 1.39 -0.63 -0.78 -0.83 0.00 -1.11 0.79 119.26 118.08 1g1a h ALA 215 Ca 0.38 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1g1a h ALA 215 Cb -0.02 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1g1a h ALA 215 CO -0.12 -0.89 0.38 -0.07 0.00 0.00 0.00 179.25 178.55 1g1a h LEU 216 N -0.63 1.01 0.00 0.00 3.38 -1.37 -0.14 115.31 117.57 1g1a h LEU 216 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1g1a h LEU 216 Cb 0.59 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1g1a h LEU 216 CO -0.09 0.85 0.00 -0.62 0.09 0.00 0.00 178.44 178.67 1g1a n GLU 217 N -4.32 0.15 -0.95 1.13 1.02 -0.49 -4.82 120.64 112.37 1g1a n GLU 217 Ca 0.08 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 1g1a n GLU 217 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 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 -0.37 0.77 3.66 0.62 0.00 -0.06 -5.02 105.19 104.78 1g1a n GLY 218 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.17 -0.56 0.47 1.61 1.02 0.19 -4.98 119.74 117.33 1g1a s LYS 219 Ca 0.00 0.03 -0.20 0.00 0.02 0.00 0.00 55.97 55.81 1g1a s LYS 219 Cb 0.00 -1.67 -0.09 0.00 -0.52 0.00 0.00 37.83 35.55 1g1a s LYS 219 CO 0.00 -3.29 1.01 -2.14 -0.92 0.00 0.00 175.35 170.02 1g1a s PRO 220 N -5.37 3.92 -0.82 -1.68 0.02 -1.26 -4.53 135.00 125.30 1g1a s PRO 220 Ca 0.70 1.30 -0.04 0.00 0.02 0.00 0.00 61.00 62.97 1g1a s PRO 220 Cb -0.11 -2.12 0.21 0.00 0.02 0.00 0.00 34.50 32.49 1g1a s PRO 220 CO 0.56 -0.32 0.69 -0.51 -0.33 0.00 0.00 177.00 177.09 1g1a s LEU 221 N -3.39 5.62 0.25 -5.54 1.43 -0.18 -4.83 118.68 112.04 1g1a s LEU 221 Ca 0.66 -3.34 -0.30 0.00 -1.03 0.00 0.00 54.13 50.12 1g1a s LEU 221 Cb -0.14 -1.94 -0.09 0.00 0.03 0.00 0.00 46.19 44.05 1g1a s LEU 221 CO 0.18 -0.29 1.19 -2.16 0.23 0.00 0.00 176.35 175.51 1g1a s PRO 222 N -0.79 4.51 0.01 1.29 0.04 -1.26 -1.45 135.00 137.34 1g1a s PRO 222 Ca 0.23 1.93 0.07 0.00 0.04 0.00 0.00 61.00 63.28 1g1a s PRO 222 Cb -0.12 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 1g1a s PRO 222 CO -0.09 -0.02 -0.22 0.42 0.04 0.00 0.00 177.00 177.13 1g1a s ILE 223 N -0.62 2.44 0.00 0.56 1.09 -0.09 -4.92 121.20 119.67 1g1a s ILE 223 Ca 0.50 -1.13 0.00 0.00 -1.10 0.00 0.00 60.65 58.92 1g1a s ILE 223 Cb -0.34 -1.94 0.00 0.00 -1.06 0.00 0.00 42.46 39.12 1g1a s ILE 223 CO 0.41 0.47 0.01 -1.22 -0.10 0.00 0.00 174.94 174.51 1g1a n TYR 224 N 2.03 0.00 0.00 3.97 4.02 -1.26 -0.24 117.16 125.68 1g1a n TYR 224 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1g1a n TYR 224 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 1g1a n TYR 224 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1g1a n GLY 225 N 2.36 0.87 0.25 2.72 0.00 -1.26 -3.85 105.19 106.27 1g1a n GLY 225 Ca 0.00 -0.23 0.05 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 1.32 -1.57 1.61 5.02 -1.26 -4.80 118.16 118.48 1g1a n LYS 226 Ca 0.00 -0.49 -0.06 0.00 -2.02 0.00 0.00 58.31 55.75 1g1a n LYS 226 Cb 0.00 -1.19 -0.01 0.00 -0.02 0.00 0.00 35.03 33.80 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 0.80 0.52 0.18 0.72 0.00 -1.26 -4.81 105.19 101.35 1g1a n GLY 227 Ca 0.09 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 1g1a n GLY 227 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1g1a h ASP 228 N 0.00 -0.43 -0.84 1.61 3.32 -1.97 -2.94 116.42 115.17 1g1a h ASP 228 Ca -0.12 0.09 -0.66 0.00 0.02 0.00 0.00 57.03 56.35 1g1a h ASP 228 Cb 0.68 0.22 0.04 0.00 0.22 0.00 0.00 39.33 40.49 1g1a h ASP 228 CO 0.16 -0.18 0.06 0.00 -1.72 0.00 0.00 179.24 177.57 1g1a n GLN 229 N -5.29 0.00 -4.77 3.56 3.00 -1.26 -4.61 117.38 108.01 1g1a n GLN 229 Ca -0.02 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.64 1g1a n GLN 229 Cb 0.21 -1.25 -0.13 0.00 0.00 0.00 0.00 30.24 29.06 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 0.04 3.20 0.03 5.09 1.01 -0.15 -1.51 121.20 128.91 1g1a s ILE 230 Ca 0.76 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 60.74 1g1a s ILE 230 Cb -1.06 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 1g1a s ILE 230 CO 0.48 0.56 0.04 -0.13 0.00 0.00 0.00 174.94 175.89 1g1a s ARG 231 N -0.18 0.50 -0.40 2.79 1.81 -0.37 -1.35 118.95 121.75 1g1a s ARG 231 Ca 0.00 -0.74 -0.17 0.00 -1.72 0.00 0.00 55.73 53.10 1g1a s ARG 231 Cb -0.13 0.19 0.01 0.00 -0.45 0.00 0.00 34.95 34.57 1g1a s ARG 231 CO 0.03 -0.11 0.42 0.34 -0.68 0.00 0.00 175.30 175.30 1g1a s ASP 232 N -1.97 6.19 -0.24 0.23 -1.08 -1.19 -1.14 116.67 117.47 1g1a s ASP 232 Ca -0.07 -0.56 -0.16 0.00 -0.52 0.00 0.00 52.55 51.24 1g1a s ASP 232 Cb -0.03 -2.22 -0.03 0.00 -1.46 0.00 0.00 42.92 39.18 1g1a s ASP 232 CO -0.04 -0.52 0.43 0.26 0.52 0.00 0.00 175.17 175.82 1g1a s TRP 233 N 2.10 3.30 -0.19 -5.34 0.52 -1.26 -2.27 118.94 115.81 1g1a s TRP 233 Ca 0.12 0.56 -0.03 0.00 0.02 0.00 0.00 56.10 56.77 1g1a s TRP 233 Cb -0.17 -2.60 -0.01 0.00 -1.15 0.00 0.00 33.47 29.54 1g1a s TRP 233 CO 0.13 -0.16 -0.05 -1.17 0.02 0.00 0.00 176.95 175.72 1g1a s LEU 234 N 1.84 2.95 0.12 2.99 2.96 0.11 -4.01 118.68 125.65 1g1a s LEU 234 Ca 0.19 -0.32 -0.31 0.00 -0.22 0.00 0.00 54.13 53.46 1g1a s LEU 234 Cb -0.15 -1.73 -0.08 0.00 0.50 0.00 0.00 46.19 44.72 1g1a s LEU 234 CO 0.09 0.05 1.44 -0.47 -1.32 0.00 0.00 176.35 176.14 1g1a s TYR 235 N 1.06 3.18 0.28 5.38 5.04 -1.26 -2.06 117.35 128.97 1g1a s TYR 235 Ca 0.01 0.86 0.03 0.00 -2.44 0.00 0.00 57.07 55.52 1g1a s TYR 235 Cb -0.15 -3.75 0.64 0.00 0.35 0.00 0.00 41.96 39.06 1g1a s TYR 235 CO -0.00 -2.67 1.77 -0.24 -1.34 0.00 0.00 175.55 173.07 1g1a h VAL 236 N 4.22 0.72 -0.06 3.14 3.04 -1.34 0.63 116.25 126.60 1g1a h VAL 236 Ca -0.42 -0.24 -0.05 0.00 -1.01 0.00 0.00 66.70 64.98 1g1a h VAL 236 Cb 1.21 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.43 1g1a h VAL 236 CO 0.88 0.13 -0.18 -0.33 -1.01 0.00 0.00 177.57 177.06 1g1a h GLU 237 N 0.70 0.09 -0.21 4.17 4.39 -1.91 0.25 114.58 122.06 1g1a h GLU 237 Ca 0.53 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 60.12 1g1a h GLU 237 Cb 0.78 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1g1a h GLU 237 CO -0.38 0.27 -0.21 -0.44 -1.16 0.00 0.00 179.01 177.09 1g1a h ASP 238 N 0.08 0.55 -0.29 1.42 3.32 -1.28 -2.39 116.42 117.83 1g1a h ASP 238 Ca 0.02 -0.48 0.02 0.00 0.02 0.00 0.00 57.03 56.61 1g1a h ASP 238 Cb 0.38 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1g1a h ASP 238 CO 0.03 0.92 0.14 -0.74 -1.72 0.00 0.00 179.24 177.87 1g1a h HIS 239 N 0.20 0.27 -0.66 4.55 2.76 -0.78 -1.31 115.15 120.17 1g1a h HIS 239 Ca 0.03 0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.32 1g1a h HIS 239 Cb 0.76 -0.08 -0.08 0.00 1.55 0.00 0.00 27.41 29.57 1g1a h HIS 239 CO 0.08 0.15 0.26 0.00 -1.30 0.00 0.00 177.93 177.12 1g1a h ALA 240 N 1.15 0.88 -0.35 5.26 0.00 -0.89 0.36 119.26 125.67 1g1a h ALA 240 Ca 0.12 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1g1a h ALA 240 Cb 0.04 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1g1a h ALA 240 CO -0.08 -0.17 0.09 0.00 0.00 0.00 0.00 179.25 179.08 1g1a h ARG 241 N 0.44 0.55 -0.54 0.00 3.08 -0.88 -2.57 114.38 114.47 1g1a h ARG 241 Ca 0.34 -0.13 0.04 0.00 0.07 0.00 0.00 59.98 60.30 1g1a h ARG 241 Cb 0.44 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1g1a h ARG 241 CO -0.33 0.60 0.30 0.00 -1.07 0.00 0.00 179.97 179.47 1g1a h ALA 242 N 0.93 0.69 -0.55 0.04 0.00 -0.41 -1.43 119.26 118.52 1g1a h ALA 242 Ca 0.11 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1g1a h ALA 242 Cb 0.29 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1g1a h ALA 242 CO 0.00 -0.02 0.34 -0.07 0.00 0.00 0.00 179.25 179.50 1g1a h LEU 243 N 0.59 0.55 -0.71 0.00 3.38 -0.80 0.10 115.31 118.42 1g1a h LEU 243 Ca 0.23 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.11 1g1a h LEU 243 Cb 0.08 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1g1a h LEU 243 CO -0.13 0.39 -0.02 -0.74 0.09 0.00 0.00 178.44 178.03 1g1a h HIS 244 N 0.67 1.06 -0.14 1.13 2.76 -1.18 -0.80 115.15 118.65 1g1a h HIS 244 Ca 0.22 -0.18 0.03 0.00 -2.20 0.00 0.00 60.37 58.24 1g1a h HIS 244 Cb 0.01 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 28.66 1g1a h HIS 244 CO -0.06 0.95 -0.03 1.98 -1.30 0.00 0.00 177.93 179.48 1g1a h MET 245 N 0.89 0.01 -0.40 5.26 -1.53 -0.66 -2.04 114.93 116.46 1g1a h MET 245 Ca 0.16 -0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.42 1g1a h MET 245 Cb 0.55 -0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.57 1g1a h MET 245 CO 0.03 0.01 0.25 0.28 0.14 0.00 0.00 176.91 177.61 1g1a h VAL 246 N 0.01 1.13 0.00 -5.77 2.07 -0.43 0.25 116.25 113.50 1g1a h VAL 246 Ca 0.07 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.24 1g1a h VAL 246 Cb 0.10 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1g1a h VAL 246 CO -0.14 0.13 -0.29 1.62 0.02 0.00 0.00 177.57 178.91 1g1a h VAL 247 N 0.53 1.03 0.04 2.57 3.04 -0.99 0.81 116.25 123.28 1g1a h VAL 247 Ca 0.15 -1.07 -0.33 0.00 -1.01 0.00 0.00 66.70 64.44 1g1a h VAL 247 Cb -0.01 1.61 -0.04 0.00 -2.01 0.00 0.00 31.29 30.83 1g1a h VAL 247 CO -0.03 0.29 -1.95 0.35 -1.01 0.00 0.00 177.57 175.22 1g1a n THR 248 N -3.93 1.63 0.28 3.17 -2.24 -0.78 -4.54 114.28 107.86 1g1a n THR 248 Ca -0.02 -0.74 0.03 0.00 -2.27 0.00 0.00 64.05 61.05 1g1a n THR 248 Cb 0.36 -1.20 -0.01 0.00 -2.10 0.00 0.00 70.33 67.39 1g1a n THR 248 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1g1a n GLU 249 N -3.16 2.68 -2.06 -0.78 -0.58 0.85 -5.04 120.64 112.55 1g1a n GLU 249 Ca -0.26 -0.42 -0.37 0.00 -0.42 0.00 0.00 57.16 55.70 1g1a n GLU 249 Cb 1.06 -0.94 0.02 0.00 -0.57 0.00 0.00 31.44 31.01 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 -1.09 2.77 -0.18 0.62 0.00 0.28 -4.98 107.32 104.73 1g1a s GLY 250 Ca 0.05 1.03 -0.15 0.00 0.00 0.00 0.00 44.72 45.64 1g1a s GLY 250 CO 0.17 1.46 0.38 1.25 0.00 0.00 0.00 173.10 176.35 1g1a s LYS 251 N -3.10 4.21 0.18 2.90 2.20 -1.26 -4.96 119.74 119.91 1g1a s LYS 251 Ca 0.73 0.19 -0.33 0.00 -0.36 0.00 0.00 55.97 56.20 1g1a s LYS 251 Cb -0.31 -3.50 -0.15 0.00 -1.51 0.00 0.00 37.83 32.36 1g1a s LYS 251 CO 0.35 0.05 1.28 0.00 -0.36 0.00 0.00 175.35 176.68 1g1a n ALA 252 N 4.17 -0.09 -0.73 3.13 0.00 -1.26 -1.42 120.51 124.30 1g1a n ALA 252 Ca -0.09 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1g1a n ALA 252 Cb 0.51 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 2.20 0.70 3.95 0.00 0.00 0.52 -4.95 105.19 107.61 1g1a n GLY 253 Ca 0.14 0.00 -0.23 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 -0.27 3.39 -0.03 1.61 0.41 -0.50 -5.00 118.70 118.31 1g1a s GLU 254 Ca 0.00 -0.74 0.06 0.00 -0.41 0.00 0.00 54.97 53.89 1g1a s GLU 254 Cb 0.00 -2.89 -0.01 0.00 -1.78 0.00 0.00 34.13 29.45 1g1a s GLU 254 CO 0.00 0.46 -0.22 0.99 -0.49 0.00 0.00 175.26 175.99 1g1a s THR 255 N -1.92 1.77 -0.07 3.63 2.01 -1.26 -2.38 115.64 117.43 1g1a s THR 255 Ca 0.34 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1g1a s THR 255 Cb -0.10 -1.48 0.02 0.00 0.01 0.00 0.00 72.50 70.95 1g1a s THR 255 CO 0.28 0.50 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.35 1g1a s TYR 256 N -0.35 1.00 0.14 4.92 2.02 -0.39 -4.95 117.35 119.74 1g1a s TYR 256 Ca 0.04 -0.36 -0.19 0.00 -0.37 0.00 0.00 57.07 56.19 1g1a s TYR 256 Cb -0.10 -0.88 -0.07 0.00 -0.40 0.00 0.00 41.96 40.51 1g1a s TYR 256 CO 0.01 -0.30 0.63 -0.80 -1.57 0.00 0.00 175.55 173.52 1g1a s ASN 257 N 1.24 7.03 -0.06 2.29 0.01 -1.26 -1.76 114.94 122.43 1g1a s ASN 257 Ca -0.05 1.30 0.01 0.00 -0.71 0.00 0.00 52.86 53.40 1g1a s ASN 257 Cb -0.14 -2.37 0.02 0.00 0.41 0.00 0.00 41.25 39.17 1g1a s ASN 257 CO -0.02 0.15 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.02 1g1a s ILE 258 N -1.33 0.82 0.19 0.60 1.01 0.17 -4.63 121.20 118.03 1g1a s ILE 258 Ca 0.36 -0.26 -0.11 0.00 0.00 0.00 0.00 60.65 60.64 1g1a s ILE 258 Cb -0.18 -0.81 -0.00 0.00 0.01 0.00 0.00 42.46 41.48 1g1a s ILE 258 CO 0.20 0.30 0.38 -0.83 0.00 0.00 0.00 174.94 174.99 1g1a s GLY 259 N 1.02 0.41 -0.04 6.18 0.00 -1.26 -2.03 107.32 111.60 1g1a s GLY 259 Ca -0.09 -0.77 0.05 0.00 0.00 0.00 0.00 44.72 43.91 1g1a s GLY 259 CO -0.00 -0.68 0.99 0.61 0.00 0.00 0.00 173.10 174.02 1g1a n GLY 260 N -0.29 1.14 3.71 0.20 0.00 -1.26 -4.71 105.19 103.98 1g1a n GLY 260 Ca -0.06 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 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 0.17 -1.90 -3.83 1.61 8.25 -1.26 -4.79 115.22 113.47 1g1a n HIS 261 Ca 0.08 0.78 -0.07 0.00 -0.26 0.00 0.00 57.72 58.24 1g1a n HIS 261 Cb 0.39 -4.17 0.03 0.00 1.12 0.00 0.00 29.99 27.35 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 -4.21 0.03 -0.20 0.41 2.20 -1.26 -5.01 114.94 106.90 1g1a s ASN 262 Ca 0.08 -1.07 -0.14 0.00 -0.94 0.00 0.00 52.86 50.79 1g1a s ASN 262 Cb -0.02 0.77 0.06 0.00 -2.00 0.00 0.00 41.25 40.05 1g1a s ASN 262 CO 0.83 -1.53 0.51 -0.70 -2.94 0.00 0.00 177.10 173.26 1g1a s GLU 263 N -2.11 0.54 -0.10 3.55 2.12 -1.26 -4.42 118.70 117.02 1g1a s GLU 263 Ca 0.18 0.83 -0.12 0.00 0.36 0.00 0.00 54.97 56.22 1g1a s GLU 263 Cb -0.04 0.15 0.03 0.00 0.26 0.00 0.00 34.13 34.53 1g1a s GLU 263 CO 0.10 -0.12 0.33 0.15 -0.54 0.00 0.00 175.26 175.19 1g1a s LYS 264 N 0.92 0.45 0.38 4.30 -0.14 -0.29 -4.96 119.74 120.41 1g1a s LYS 264 Ca -0.05 0.33 -0.16 0.00 -1.36 0.00 0.00 55.97 54.72 1g1a s LYS 264 Cb -0.06 0.22 -0.09 0.00 -1.68 0.00 0.00 37.83 36.22 1g1a s LYS 264 CO -0.08 -0.08 0.83 0.15 -0.76 0.00 0.00 175.35 175.42 1g1a s LYS 265 N -0.14 4.04 0.23 1.68 1.02 -1.26 -1.24 119.74 124.07 1g1a s LYS 265 Ca -0.03 0.81 -0.07 0.00 0.02 0.00 0.00 55.97 56.71 1g1a s LYS 265 Cb -0.03 -2.32 0.34 0.00 -0.52 0.00 0.00 37.83 35.30 1g1a s LYS 265 CO 0.01 0.03 1.78 -0.91 -0.92 0.00 0.00 175.35 175.35 1g1a h ASN 266 N 1.90 0.47 -0.96 2.83 4.21 -1.09 -0.10 115.58 122.83 1g1a h ASN 266 Ca -0.48 0.06 0.12 0.00 1.21 0.00 0.00 56.30 57.21 1g1a h ASN 266 Cb 1.18 -0.02 -0.08 0.00 -1.12 0.00 0.00 38.32 38.28 1g1a h ASN 266 CO 0.63 0.27 0.61 0.25 -1.29 0.00 0.00 177.43 177.90 1g1a h LEU 267 N 0.61 0.85 -0.90 1.61 6.46 -1.84 0.16 115.31 122.25 1g1a h LEU 267 Ca 0.35 0.04 -0.09 0.00 -0.12 0.00 0.00 57.88 58.07 1g1a h LEU 267 Cb 0.37 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.16 1g1a h LEU 267 CO -0.27 0.45 -0.16 0.44 -0.62 0.00 0.00 178.44 178.28 1g1a h ASP 268 N 0.91 0.62 0.06 1.25 3.32 -1.34 -1.29 116.42 119.95 1g1a h ASP 268 Ca 0.48 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 1g1a h ASP 268 Cb 0.54 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1g1a h ASP 268 CO -0.24 0.80 -0.03 0.58 -1.72 0.00 0.00 179.24 178.63 1g1a h VAL 269 N 0.57 1.06 -0.46 -1.35 2.07 -0.06 0.34 116.25 118.42 1g1a h VAL 269 Ca 0.10 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.23 1g1a h VAL 269 Cb 0.59 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1g1a h VAL 269 CO 0.04 0.10 0.26 0.58 0.02 0.00 0.00 177.57 178.57 1g1a h VAL 270 N -0.27 1.01 -0.70 2.57 2.07 -0.96 -1.66 116.25 118.32 1g1a h VAL 270 Ca -0.01 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 1g1a h VAL 270 Cb 0.23 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1g1a h VAL 270 CO 0.01 0.09 0.27 -0.26 0.02 0.00 0.00 177.57 177.71 1g1a h PHE 271 N 0.51 1.07 -0.66 1.57 -1.00 -1.12 -1.64 116.94 115.67 1g1a h PHE 271 Ca 0.19 -0.08 0.02 0.00 2.81 0.00 0.00 57.97 60.90 1g1a h PHE 271 Cb 0.06 -0.32 -0.04 0.00 3.61 0.00 0.00 35.95 39.26 1g1a h PHE 271 CO -0.08 0.83 0.43 1.15 -1.61 0.00 0.00 178.31 179.02 1g1a h THR 272 N 1.00 1.13 -0.58 -1.55 2.02 -0.44 0.52 112.91 115.00 1g1a h THR 272 Ca 0.23 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 1g1a h THR 272 Cb 0.22 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1g1a h THR 272 CO -0.02 0.16 0.12 0.40 0.37 0.00 0.00 175.52 176.55 1g1a h ILE 273 N 0.85 1.25 -0.77 3.11 2.04 -1.02 -2.12 117.51 120.85 1g1a h ILE 273 Ca 0.25 -0.94 -0.04 0.00 1.00 0.00 0.00 64.86 65.13 1g1a h ILE 273 Cb -0.05 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1g1a h ILE 273 CO -0.07 0.35 0.33 0.00 0.00 0.00 0.00 178.15 178.75 1g1a h ASP 275 N 1.11 0.70 -0.46 0.00 3.32 -0.66 -0.77 116.42 119.65 1g1a h ASP 275 Ca 0.26 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 1g1a h ASP 275 Cb 0.18 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1g1a h ASP 275 CO -0.03 0.56 -0.08 -0.07 -1.72 0.00 0.00 179.24 177.90 1g1a h LEU 276 N 0.78 0.88 -1.94 1.55 3.38 -0.94 -1.72 115.31 117.28 1g1a h LEU 276 Ca 0.21 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1g1a h LEU 276 Cb -0.00 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1g1a h LEU 276 CO -0.04 1.02 -0.02 -0.07 0.09 0.00 0.00 178.44 179.42 1g1a h LEU 277 N 0.72 0.00 0.12 1.67 3.38 -0.77 0.12 115.31 120.55 1g1a h LEU 277 Ca 0.12 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.82 1g1a h LEU 277 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1g1a h LEU 277 CO 0.04 0.02 -1.26 0.44 0.09 0.00 0.00 178.44 177.77 1g1a h ASP 278 N 0.00 0.40 0.28 -0.43 3.32 -0.59 -3.28 116.42 116.13 1g1a h ASP 278 Ca -0.00 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1g1a h ASP 278 Cb 0.35 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1g1a h ASP 278 CO 0.00 1.35 -0.14 -0.08 -1.72 0.00 0.00 179.24 178.65 1g1a h GLU 279 N 0.07 -0.37 -6.53 3.56 4.81 -0.42 -3.24 114.58 112.46 1g1a h GLU 279 Ca -0.14 0.02 -0.52 0.00 -0.13 0.00 0.00 59.36 58.60 1g1a h GLU 279 Cb 1.97 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 31.42 1g1a h GLU 279 CO 0.20 -0.02 -0.11 0.42 -0.73 0.00 0.00 179.01 178.76 1g1a s ILE 280 N -3.89 4.99 -1.67 2.32 1.01 0.31 -4.14 121.20 120.13 1g1a s ILE 280 Ca -0.12 0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.51 1g1a s ILE 280 Cb 0.01 -3.73 0.14 0.00 0.01 0.00 0.00 42.46 38.89 1g1a s ILE 280 CO 0.46 -0.33 0.67 0.52 0.00 0.00 0.00 174.94 176.25 1g1a n VAL 281 N -0.94 -1.22 -1.54 2.92 0.31 -1.26 -4.38 118.33 112.22 1g1a n VAL 281 Ca -0.01 -0.11 -0.37 0.00 -0.01 0.00 0.00 64.34 63.84 1g1a n VAL 281 Cb 0.54 -1.67 0.06 0.00 -0.91 0.00 0.00 33.84 31.86 1g1a n VAL 281 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1g1a n PRO 282 N -4.37 0.72 -3.87 5.55 -0.02 -1.22 -4.64 135.00 127.15 1g1a n PRO 282 Ca 0.00 0.29 -0.12 0.00 -2.02 0.00 0.00 63.50 61.65 1g1a n PRO 282 Cb 0.53 -2.06 -0.14 0.00 -0.02 0.00 0.00 33.50 31.81 1g1a n PRO 282 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1g1a s LYS 283 N -2.71 0.03 0.13 -0.52 2.20 -1.26 -5.05 119.74 112.56 1g1a s LYS 283 Ca 0.74 -0.03 -0.27 0.00 -0.36 0.00 0.00 55.97 56.05 1g1a s LYS 283 Cb -0.41 0.01 -0.07 0.00 -1.51 0.00 0.00 37.83 35.85 1g1a s LYS 283 CO 0.49 -0.00 1.46 0.00 -0.36 0.00 0.00 175.35 176.94 1g1a h ALA 284 N 6.04 -0.55 -2.32 3.13 0.00 -1.98 -3.38 119.26 120.21 1g1a h ALA 284 Ca -0.25 0.07 -0.51 0.00 0.00 0.00 0.00 54.91 54.22 1g1a h ALA 284 Cb 1.21 1.25 0.13 0.00 0.00 0.00 0.00 17.79 20.38 1g1a h ALA 284 CO 0.50 -0.86 0.31 0.99 0.00 0.00 0.00 179.25 180.18 1g1a s THR 285 N -5.17 3.22 0.21 0.00 2.01 -1.26 -5.04 115.64 109.61 1g1a s THR 285 Ca -0.11 0.40 -0.03 0.00 0.31 0.00 0.00 61.69 62.26 1g1a s THR 285 Cb 0.09 -2.88 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 1g1a s THR 285 CO 0.53 -0.52 0.43 -0.55 -0.69 0.00 0.00 174.62 173.82 1g1a s SER 286 N -3.39 6.44 0.00 3.53 0.15 -1.26 -4.98 113.70 114.19 1g1a s SER 286 Ca 0.61 0.55 0.15 0.00 0.70 0.00 0.00 55.95 57.96 1g1a s SER 286 Cb -0.17 -2.07 0.65 0.00 -1.71 0.00 0.00 66.02 62.72 1g1a s SER 286 CO 0.56 -0.05 1.48 -1.22 1.20 0.00 0.00 173.24 175.20 1g1a n TYR 287 N -0.50 0.00 0.07 3.44 4.01 -1.26 -2.38 117.16 120.53 1g1a n TYR 287 Ca -0.03 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.62 1g1a n TYR 287 Cb 0.53 -0.48 0.03 0.00 -0.31 0.00 0.00 39.34 39.11 1g1a n TYR 287 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1g1a h ARG 288 N 0.00 0.33 -1.62 -0.72 3.08 -1.94 -2.82 114.38 110.70 1g1a h ARG 288 Ca 0.00 -0.28 0.48 0.00 0.07 0.00 0.00 59.98 60.25 1g1a h ARG 288 Cb 0.25 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.28 1g1a h ARG 288 CO 0.00 0.94 1.14 0.93 -1.07 0.00 0.00 179.97 181.91 1g1a h GLU 289 N 0.22 0.03 0.00 0.04 4.39 -1.88 2.12 114.58 119.49 1g1a h GLU 289 Ca -0.03 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1g1a h GLU 289 Cb 1.33 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1g1a h GLU 289 CO 0.12 0.02 0.00 1.96 -1.16 0.00 0.00 179.01 179.95 1g1a h GLN 290 N 0.03 0.00 -6.78 2.33 4.20 -1.69 -3.46 115.11 109.75 1g1a h GLN 290 Ca 0.82 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 59.01 1g1a h GLN 290 Cb 3.11 0.00 0.05 0.00 0.30 0.00 0.00 27.48 30.94 1g1a h GLN 290 CO -0.12 0.00 0.70 0.42 -0.67 0.00 0.00 178.83 179.15 1g1a s ILE 291 N -3.24 2.79 0.17 2.54 1.01 0.72 -1.01 121.20 124.19 1g1a s ILE 291 Ca 0.07 0.70 -0.03 0.00 0.00 0.00 0.00 60.65 61.40 1g1a s ILE 291 Cb 0.10 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 1g1a s ILE 291 CO 0.54 0.13 0.15 0.42 0.00 0.00 0.00 174.94 176.18 1g1a s THR 292 N -0.35 0.05 -0.10 2.92 -4.23 -0.53 -4.86 115.64 108.53 1g1a s THR 292 Ca 0.55 -1.84 0.03 0.00 -1.18 0.00 0.00 61.69 59.25 1g1a s THR 292 Cb -0.40 -2.21 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 1g1a s THR 292 CO 0.45 -0.22 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.80 1g1a s TYR 293 N -4.08 2.63 0.00 3.99 1.51 -1.26 -0.92 117.35 119.22 1g1a s TYR 293 Ca 0.29 -0.84 0.00 0.00 -1.01 0.00 0.00 57.07 55.51 1g1a s TYR 293 Cb 0.06 -1.74 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 1g1a s TYR 293 CO 0.06 -0.30 0.00 1.33 -1.11 0.00 0.00 175.55 175.53 1g1a n VAL 294 N 3.40 0.00 -3.71 0.71 0.24 0.67 -4.90 118.33 114.74 1g1a n VAL 294 Ca -0.18 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 61.86 1g1a n VAL 294 Cb 0.53 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.91 1g1a n VAL 294 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1g1a s ALA 295 N -2.29 4.55 0.05 2.33 0.00 -1.25 -4.77 121.76 120.38 1g1a s ALA 295 Ca 0.00 -1.40 0.01 0.00 0.00 0.00 0.00 51.96 50.57 1g1a s ALA 295 Cb 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 1g1a s ALA 295 CO 0.00 -0.57 -0.05 0.16 0.00 0.00 0.00 175.76 175.30 1g1a s ASP 296 N -4.39 0.71 0.30 0.00 -4.77 -1.25 -4.15 116.67 103.12 1g1a s ASP 296 Ca 0.39 -0.74 -0.29 0.00 -3.30 0.00 0.00 52.55 48.61 1g1a s ASP 296 Cb -0.03 0.10 -0.10 0.00 -1.09 0.00 0.00 42.92 41.79 1g1a s ASP 296 CO 0.25 -0.37 1.43 0.00 0.70 0.00 0.00 175.17 177.17 1g1a s ARG 297 N -2.58 4.24 1.00 2.11 1.04 -1.26 -4.94 118.95 118.56 1g1a s ARG 297 Ca -0.03 2.36 -0.14 0.00 -1.04 0.00 0.00 55.73 56.89 1g1a s ARG 297 Cb -0.03 -3.06 0.09 0.00 -2.04 0.00 0.00 34.95 29.92 1g1a s ARG 297 CO -0.03 -0.40 0.49 -2.30 -0.04 0.00 0.00 175.30 173.01 1g1a n PRO 298 N 1.51 -0.81 -0.79 3.89 -0.02 -1.26 -4.26 135.00 133.25 1g1a n PRO 298 Ca 0.04 -0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1g1a n PRO 298 Cb 0.40 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 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 1.38 0.00 3.80 -1.23 0.00 -1.26 -4.88 105.19 103.00 1g1a n GLY 299 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.62 3.21 0.21 1.61 -3.43 -1.26 -5.05 115.29 109.95 1g1a s HIS 300 Ca 0.00 0.05 -0.31 0.00 -0.80 0.00 0.00 55.06 54.00 1g1a s HIS 300 Cb 0.00 -1.59 -0.11 0.00 -1.43 0.00 0.00 32.58 29.46 1g1a s HIS 300 CO 0.00 0.52 1.60 -0.51 -2.00 0.00 0.00 174.74 174.35 1g1a s ASP 301 N -2.74 6.51 0.09 7.38 1.01 -1.26 -4.91 116.67 122.74 1g1a s ASP 301 Ca 0.31 2.74 0.09 0.00 0.71 0.00 0.00 52.55 56.39 1g1a s ASP 301 Cb -0.11 -2.60 -0.20 0.00 1.01 0.00 0.00 42.92 41.01 1g1a s ASP 301 CO 0.23 -0.86 1.14 0.03 0.21 0.00 0.00 175.17 175.92 1g1a h ARG 302 N 6.30 0.00 -2.44 8.23 2.47 -1.92 -3.45 114.38 123.57 1g1a h ARG 302 Ca -0.44 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.21 1g1a h ARG 302 Cb 1.21 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 29.27 1g1a h ARG 302 CO 0.89 0.86 -0.25 0.50 0.56 0.00 0.00 179.97 182.53 1g1a s ARG 303 N -2.70 0.44 -0.05 0.04 3.52 -1.26 -0.98 118.95 117.97 1g1a s ARG 303 Ca -0.00 0.99 0.06 0.00 -0.13 0.00 0.00 55.73 56.65 1g1a s ARG 303 Cb 0.09 0.17 -0.01 0.00 -1.56 0.00 0.00 34.95 33.65 1g1a s ARG 303 CO 0.82 -0.19 -0.24 0.71 -0.81 0.00 0.00 175.30 175.59 1g1a s TYR 304 N 1.89 2.33 -0.23 5.12 2.02 -0.45 -2.40 117.35 125.63 1g1a s TYR 304 Ca -0.07 -0.63 -0.15 0.00 -0.37 0.00 0.00 57.07 55.85 1g1a s TYR 304 Cb -0.09 -1.53 0.07 0.00 -0.40 0.00 0.00 41.96 40.01 1g1a s TYR 304 CO -0.15 -0.17 0.58 0.00 -1.57 0.00 0.00 175.55 174.25 1g1a s ALA 305 N -0.26 -1.53 -0.07 3.71 0.00 -1.26 -3.19 121.76 119.16 1g1a s ALA 305 Ca -0.00 1.97 0.01 0.00 0.00 0.00 0.00 51.96 53.94 1g1a s ALA 305 Cb -0.12 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1g1a s ALA 305 CO 0.02 -0.32 -0.08 0.42 0.00 0.00 0.00 175.76 175.80 1g1a s ILE 306 N 1.22 3.61 -0.47 0.00 1.01 -1.26 -0.96 121.20 124.35 1g1a s ILE 306 Ca -0.07 -0.51 -0.16 0.00 0.00 0.00 0.00 60.65 59.91 1g1a s ILE 306 Cb -0.06 -2.47 0.07 0.00 0.01 0.00 0.00 42.46 40.01 1g1a s ILE 306 CO -0.12 0.60 0.41 -0.62 0.00 0.00 0.00 174.94 175.20 1g1a s ASP 307 N -0.79 6.15 -0.42 3.58 -1.08 -0.48 -4.78 116.67 118.85 1g1a s ASP 307 Ca 0.12 -1.25 0.04 0.00 -0.52 0.00 0.00 52.55 50.94 1g1a s ASP 307 Cb -0.11 -2.19 0.65 0.00 -1.46 0.00 0.00 42.92 39.81 1g1a s ASP 307 CO 0.01 -0.66 1.87 0.00 0.52 0.00 0.00 175.17 176.92 1g1a n ALA 308 N 5.29 5.39 -0.10 3.66 0.00 -1.26 -4.61 120.51 128.88 1g1a n ALA 308 Ca -0.12 -2.73 -0.11 0.00 0.00 0.00 0.00 53.44 50.49 1g1a n ALA 308 Cb 0.44 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 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 1.29 0.55 0.57 0.00 0.00 -1.91 -3.00 103.07 100.58 1g1a h GLY 309 Ca 0.58 -0.39 0.06 0.00 0.00 0.00 0.00 47.33 47.58 1g1a h GLY 309 CO 1.03 0.36 0.17 1.70 0.00 0.00 0.00 176.54 179.80 1g1a h LYS 310 N 0.32 0.33 0.00 4.80 3.64 -1.92 0.20 116.57 123.94 1g1a h LYS 310 Ca 0.09 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1g1a h LYS 310 Cb 0.39 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1g1a h LYS 310 CO 0.01 0.22 -0.30 0.97 -2.27 0.00 0.00 179.45 178.08 1g1a h ILE 311 N 0.34 1.05 0.21 2.00 2.10 -1.82 0.86 117.51 122.26 1g1a h ILE 311 Ca 0.22 -1.09 -0.01 0.00 1.08 0.00 0.00 64.86 65.06 1g1a h ILE 311 Cb 0.22 1.61 0.00 0.00 -1.09 0.00 0.00 36.82 37.57 1g1a h ILE 311 CO -0.23 0.29 -0.10 -1.28 -1.08 0.00 0.00 178.15 175.76 1g1a h SER 312 N 0.00 -0.24 -0.22 2.19 0.87 -1.07 0.51 113.55 115.60 1g1a h SER 312 Ca -0.00 -0.29 0.02 0.00 -1.23 0.00 0.00 61.79 60.29 1g1a h SER 312 Cb 0.59 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1g1a h SER 312 CO 0.04 0.22 0.08 0.03 -0.53 0.00 0.00 176.83 176.67 1g1a h ARG 313 N -0.77 0.18 0.05 2.24 3.08 -0.47 0.11 114.38 118.80 1g1a h ARG 313 Ca -0.03 -0.01 -0.28 0.00 0.07 0.00 0.00 59.98 59.73 1g1a h ARG 313 Cb 0.51 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1g1a h ARG 313 CO 0.05 0.12 -1.50 0.93 -1.07 0.00 0.00 179.97 178.50 1g1a h GLU 314 N 0.19 0.10 -0.00 0.04 5.08 -0.91 -3.39 114.58 115.68 1g1a h GLU 314 Ca 0.09 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1g1a h GLU 314 Cb 0.06 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1g1a h GLU 314 CO -0.09 0.87 -0.04 1.28 -1.00 0.00 0.00 179.01 180.03 1g1a n LEU 315 N -3.28 0.47 -2.25 1.33 4.77 0.09 -5.03 117.00 113.10 1g1a n LEU 315 Ca -0.14 -0.69 -0.14 0.00 -0.03 0.00 0.00 56.01 55.01 1g1a n LEU 315 Cb 1.02 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.16 1g1a n LEU 315 CO 0.47 0.11 0.13 0.61 -1.33 0.00 0.00 177.39 177.38 1g1a n GLY 316 N 0.66 0.08 3.67 -0.72 0.00 0.39 -4.97 105.19 104.29 1g1a n GLY 316 Ca 0.00 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.16 3.18 -0.03 1.61 -0.00 -1.16 -4.96 118.94 114.43 1g1a s TRP 317 Ca 0.32 0.15 -0.12 0.00 -0.00 0.00 0.00 56.10 56.45 1g1a s TRP 317 Cb -0.14 -1.85 0.02 0.00 -0.00 0.00 0.00 33.47 31.50 1g1a s TRP 317 CO 0.40 0.39 0.26 0.15 -0.00 0.00 0.00 176.95 178.16 1g1a s LYS 318 N -0.61 0.55 0.32 5.86 1.02 -1.26 -3.86 119.74 121.76 1g1a s LYS 318 Ca 0.10 -0.13 -0.29 0.00 0.02 0.00 0.00 55.97 55.68 1g1a s LYS 318 Cb -0.12 0.24 -0.10 0.00 -0.52 0.00 0.00 37.83 37.33 1g1a s LYS 318 CO 0.02 -0.14 1.37 -2.14 -0.92 0.00 0.00 175.35 173.54 1g1a s PRO 319 N -1.04 4.29 0.06 -1.68 0.02 -1.26 -4.91 135.00 130.48 1g1a s PRO 319 Ca -0.11 2.30 0.07 0.00 0.02 0.00 0.00 61.00 63.27 1g1a s PRO 319 Cb -0.05 -3.06 -0.23 0.00 0.02 0.00 0.00 34.50 31.18 1g1a s PRO 319 CO 0.03 -0.30 1.07 -0.07 -0.33 0.00 0.00 177.00 177.40 1g1a h LEU 320 N 3.71 0.07-10.32 -5.54 3.38 -1.98 -3.46 115.31 101.16 1g1a h LEU 320 Ca -0.49 -0.09 -0.47 0.00 0.09 0.00 0.00 57.88 56.93 1g1a h LEU 320 Cb 1.23 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 41.98 1g1a h LEU 320 CO 0.68 1.07 -0.09 -1.61 0.09 0.00 0.00 178.44 178.58 1g1a s GLU 321 N -2.67 3.25 0.33 1.13 0.41 -1.26 -5.08 118.70 114.81 1g1a s GLU 321 Ca -0.02 -0.35 0.09 0.00 -0.41 0.00 0.00 54.97 54.28 1g1a s GLU 321 Cb 0.09 -2.56 -0.05 0.00 -1.78 0.00 0.00 34.13 29.83 1g1a s GLU 321 CO 0.83 -0.15 0.03 0.95 -0.49 0.00 0.00 175.26 176.43 1g1a s THR 322 N -2.52 2.78 0.37 3.63 -4.23 -1.26 -4.95 115.64 109.46 1g1a s THR 322 Ca 0.46 -1.93 0.08 0.00 -1.18 0.00 0.00 61.69 59.12 1g1a s THR 322 Cb -0.10 -2.82 0.31 0.00 1.34 0.00 0.00 72.50 71.23 1g1a s THR 322 CO 0.38 -0.22 1.93 0.15 -0.54 0.00 0.00 174.62 176.32 1g1a h PHE 323 N 1.78 0.75 0.21 3.99 3.57 -1.89 0.24 116.94 125.60 1g1a h PHE 323 Ca -0.43 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 1g1a h PHE 323 Cb 1.25 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.75 1g1a h PHE 323 CO 0.69 0.35 -0.10 0.93 -2.23 0.00 0.00 178.31 177.95 1g1a h GLU 324 N 0.70 -0.27 -0.42 1.11 3.07 -1.99 -1.17 114.58 115.60 1g1a h GLU 324 Ca 0.36 0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 59.16 1g1a h GLU 324 Cb 0.45 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.40 1g1a h GLU 324 CO -0.13 0.05 -0.03 0.66 -1.40 0.00 0.00 179.01 178.16 1g1a h SER 325 N -0.63 0.66 -0.32 1.42 4.64 -1.88 -2.61 113.55 114.83 1g1a h SER 325 Ca -0.03 -0.16 -0.15 0.00 -0.47 0.00 0.00 61.79 60.98 1g1a h SER 325 Cb 0.45 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1g1a h SER 325 CO 0.05 0.75 -0.37 1.23 -0.87 0.00 0.00 176.83 177.62 1g1a h GLY 326 N 0.95 0.94 1.66 -0.77 0.00 -0.96 -2.36 103.07 102.53 1g1a h GLY 326 Ca 0.13 -0.94 -0.09 0.00 0.00 0.00 0.00 47.33 46.42 1g1a h GLY 326 CO 0.02 0.85 -0.28 -2.22 0.00 0.00 0.00 176.54 174.91 1g1a h ILE 327 N 0.71 1.27 -0.17 2.60 1.08 -1.08 -1.73 117.51 120.18 1g1a h ILE 327 Ca 0.06 -1.27 -0.01 0.00 -0.39 0.00 0.00 64.86 63.25 1g1a h ILE 327 Cb 0.94 1.42 -0.01 0.00 -3.07 0.00 0.00 36.82 36.10 1g1a h ILE 327 CO 0.09 0.40 0.06 -0.09 -0.69 0.00 0.00 178.15 177.92 1g1a h ARG 328 N 0.35 0.27 -0.48 2.37 2.43 -1.33 -0.97 114.38 117.02 1g1a h ARG 328 Ca 0.05 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1g1a h ARG 328 Cb 0.67 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1g1a h ARG 328 CO 0.05 0.36 0.22 0.87 -1.51 0.00 0.00 179.97 179.97 1g1a h LYS 329 N 0.12 0.67 -0.11 0.20 1.57 -1.17 -1.58 116.57 116.26 1g1a h LYS 329 Ca 0.06 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1g1a h LYS 329 Cb 0.20 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1g1a h LYS 329 CO -0.00 0.52 -0.01 1.15 -0.57 0.00 0.00 179.45 180.54 1g1a h THR 330 N 0.67 1.27 -0.33 -0.16 2.02 -0.96 -0.52 112.91 114.91 1g1a h THR 330 Ca 0.17 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.47 1g1a h THR 330 Cb 0.08 1.64 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 1g1a h THR 330 CO -0.02 0.26 0.17 0.58 0.37 0.00 0.00 175.52 176.87 1g1a h VAL 331 N -0.09 0.99 -0.67 3.16 2.07 -0.91 -1.47 116.25 119.33 1g1a h VAL 331 Ca 0.03 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.45 1g1a h VAL 331 Cb 0.40 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1g1a h VAL 331 CO 0.01 0.06 0.44 -0.33 0.02 0.00 0.00 177.57 177.78 1g1a h GLU 332 N 0.35 0.83 -0.15 1.57 5.08 -1.19 -1.86 114.58 119.20 1g1a h GLU 332 Ca 0.14 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1g1a h GLU 332 Cb 0.04 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1g1a h GLU 332 CO -0.09 0.55 0.03 2.35 -1.00 0.00 0.00 179.01 180.85 1g1a h TRP 333 N 0.86 0.26 -0.72 4.33 7.01 -0.10 -2.05 115.95 125.55 1g1a h TRP 333 Ca 0.26 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1g1a h TRP 333 Cb -0.02 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 26.94 1g1a h TRP 333 CO -0.00 0.41 0.44 1.88 -2.79 0.00 0.00 178.44 178.38 1g1a h TYR 334 N 0.04 0.94 0.00 2.65 -1.99 -1.02 -1.22 116.97 116.37 1g1a h TYR 334 Ca 0.05 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.78 1g1a h TYR 334 Cb 0.28 -0.31 -0.00 0.00 2.00 0.00 0.00 36.73 38.70 1g1a h TYR 334 CO 0.01 0.63 -0.02 -0.07 -0.00 0.00 0.00 178.16 178.71 1g1a h LEU 335 N 0.98 0.00 -1.79 3.88 3.38 -1.24 -2.15 115.31 118.37 1g1a h LEU 335 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1g1a h LEU 335 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1g1a h LEU 335 CO -0.05 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.50 1g1a n ALA 336 N -2.53 2.47 -2.61 1.53 0.00 -0.68 -4.53 120.51 114.16 1g1a n ALA 336 Ca -0.03 -0.73 -0.13 0.00 0.00 0.00 0.00 53.44 52.55 1g1a n ALA 336 Cb 0.11 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.65 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 1.06 2.33 -0.35 0.00 3.02 -0.55 -4.87 115.26 115.89 1g1a n ASN 337 Ca 0.17 -2.91 0.04 0.00 -0.03 0.00 0.00 54.58 51.85 1g1a n ASN 337 Cb 0.52 -0.50 0.19 0.00 -0.61 0.00 0.00 39.78 39.38 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 3.14 1.00 -0.01 3.41 2.02 -1.80 -2.44 112.91 118.23 1g1a h THR 338 Ca 0.00 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 66.85 1g1a h THR 338 Cb 1.14 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1g1a h THR 338 CO 0.56 0.19 -0.09 -0.61 0.37 0.00 0.00 175.52 175.93 1g1a h GLN 339 N 1.03 -0.15 -0.45 6.66 4.15 -1.94 0.16 115.11 124.58 1g1a h GLN 339 Ca 0.44 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.90 1g1a h GLN 339 Cb 0.30 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 1g1a h GLN 339 CO -0.22 -0.10 0.24 2.35 -1.93 0.00 0.00 178.83 179.18 1g1a h TRP 340 N -0.15 0.45 -0.41 3.99 7.01 -1.88 -0.86 115.95 124.10 1g1a h TRP 340 Ca 0.04 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.07 1g1a h TRP 340 Cb 0.20 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 1g1a h TRP 340 CO -0.16 0.24 0.26 0.28 -2.79 0.00 0.00 178.44 176.27 1g1a h VAL 341 N 0.48 1.07 -0.16 2.65 2.07 -1.02 -2.34 116.25 119.02 1g1a h VAL 341 Ca 0.19 -0.18 -0.09 0.00 0.82 0.00 0.00 66.70 67.44 1g1a h VAL 341 Cb 0.06 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1g1a h VAL 341 CO -0.11 0.10 -0.30 0.78 0.02 0.00 0.00 177.57 178.05 1g1a h ASN 342 N 0.52 0.30 0.54 0.57 2.35 -0.30 -0.52 115.58 119.04 1g1a h ASN 342 Ca 0.16 -0.10 -0.08 0.00 -0.55 0.00 0.00 56.30 55.72 1g1a h ASN 342 Cb -0.03 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1g1a h ASN 342 CO -0.05 0.60 -0.39 0.78 -1.65 0.00 0.00 177.43 176.71 1g1a h ASN 343 N 0.26 0.00 0.01 5.81 2.35 -0.81 0.28 115.58 123.48 1g1a h ASN 343 Ca 0.04 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 1g1a h ASN 343 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1g1a h ASN 343 CO 0.05 0.39 -0.17 0.58 -1.65 0.00 0.00 177.43 176.63 1g1a h VAL 344 N 0.00 1.62 -0.61 2.81 2.07 -0.97 -0.94 116.25 120.24 1g1a h VAL 344 Ca -0.00 -2.05 0.02 0.00 0.82 0.00 0.00 66.70 65.49 1g1a h VAL 344 Cb 0.76 2.97 -0.03 0.00 -1.52 0.00 0.00 31.29 33.47 1g1a h VAL 344 CO 0.05 0.55 0.40 0.11 0.02 0.00 0.00 177.57 178.70 1g1a h LYS 345 N -0.68 0.75 0.00 1.57 1.57 -0.92 -2.64 116.57 116.22 1g1a h LYS 345 Ca -0.02 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1g1a h LYS 345 Cb 0.99 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1g1a h LYS 345 CO 0.03 0.49 -0.61 0.66 -0.57 0.00 0.00 179.45 179.46 1g1a h SER 346 N 0.77 0.00 0.00 0.86 4.64 -1.03 -3.48 113.55 115.32 1g1a h SER 346 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1g1a h SER 346 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1g1a h SER 346 CO -0.06 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 1g1a n GLY 347 N 1.22 2.02 0.47 -0.77 0.00 -0.93 -4.93 105.19 102.26 1g1a n GLY 347 Ca 0.00 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.30 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 2.77 0.00 4.61 0.00 -1.66 -0.13 119.26 124.85 1g1a h ALA 348 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1g1a h ALA 348 Cb 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1g1a h ALA 348 CO 0.00 -1.11 -0.01 0.10 0.00 0.00 0.00 179.25 178.24 1g1a h TYR 349 N 0.00 0.00 -0.16 0.00 -0.00 -1.52 -2.59 116.97 112.69 1g1a h TYR 349 Ca 0.41 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 59.07 1g1a h TYR 349 Cb 1.73 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 38.42 1g1a h TYR 349 CO 0.00 0.01 0.09 1.04 -0.00 0.00 0.00 178.16 179.29 1g1a n GLN 350 N -3.38 1.35 -0.08 0.10 6.02 -0.06 -3.32 117.38 118.00 1g1a n GLN 350 Ca -0.03 -0.55 0.07 0.00 -0.01 0.00 0.00 57.00 56.48 1g1a n GLN 350 Cb 0.09 -1.32 0.11 0.00 1.02 0.00 0.00 30.24 30.13 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 2.37 0.00 1.08 7.64 -0.98 -5.18 113.62 118.73 1g1a n SER 351 Ca 0.09 -2.72 0.00 0.00 1.01 0.00 0.00 58.87 57.26 1g1a n SER 351 Cb 0.64 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 1g1a n SER 351 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82