#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n2l s PRO 20 N 0.00 1.35 0.62 -0.14 0.04 -1.26 -5.04 135.00 130.58 1n2l s PRO 20 Ca 0.00 0.99 -0.13 0.00 0.04 0.00 0.00 61.00 61.91 1n2l s PRO 20 Cb 0.00 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 1n2l s PRO 20 CO 0.00 -2.22 1.04 -1.25 0.04 0.00 0.00 177.00 174.61 1n2l s PRO 21 N -4.87 3.38 -0.59 0.56 0.04 -1.26 -4.92 135.00 127.34 1n2l s PRO 21 Ca 0.63 0.93 -0.25 0.00 0.04 0.00 0.00 61.00 62.35 1n2l s PRO 21 Cb -0.19 -2.05 0.04 0.00 0.04 0.00 0.00 34.50 32.35 1n2l s PRO 21 CO 0.57 -0.74 1.01 -0.80 0.04 0.00 0.00 177.00 177.08 1n2l s ASN 22 N -3.65 6.30 -0.00 6.66 0.01 0.29 -4.82 114.94 119.73 1n2l s ASN 22 Ca 0.58 -0.44 -0.27 0.00 -0.71 0.00 0.00 52.86 52.02 1n2l s ASN 22 Cb -0.13 -2.46 -0.04 0.00 0.41 0.00 0.00 41.25 39.04 1n2l s ASN 22 CO 0.48 -1.36 0.83 -0.63 -1.51 0.00 0.00 177.10 174.92 1n2l s ILE 23 N 4.25 4.87 -0.28 0.60 1.01 -1.10 -0.09 121.20 130.47 1n2l s ILE 23 Ca 0.30 1.75 -0.00 0.00 0.00 0.00 0.00 60.65 62.71 1n2l s ILE 23 Cb -0.12 -4.18 0.09 0.00 0.01 0.00 0.00 42.46 38.25 1n2l s ILE 23 CO 0.18 0.25 0.05 -0.69 0.00 0.00 0.00 174.94 174.72 1n2l s VAL 24 N 0.62 1.18 -0.46 2.92 1.01 0.24 -1.74 120.40 124.17 1n2l s VAL 24 Ca 0.44 -1.38 -0.13 0.00 0.00 0.00 0.00 61.98 60.91 1n2l s VAL 24 Cb -0.20 -1.75 0.08 0.00 0.00 0.00 0.00 36.38 34.51 1n2l s VAL 24 CO 0.24 -0.47 0.35 -0.22 0.00 0.00 0.00 175.10 175.00 1n2l s LEU 25 N 1.50 5.51 -0.04 3.92 2.96 0.20 -1.35 118.68 131.38 1n2l s LEU 25 Ca 0.05 -1.46 -0.19 0.00 -0.22 0.00 0.00 54.13 52.31 1n2l s LEU 25 Cb -0.18 -2.11 -0.05 0.00 0.50 0.00 0.00 46.19 44.36 1n2l s LEU 25 CO -0.16 -0.63 0.54 -0.63 -1.32 0.00 0.00 176.35 174.15 1n2l s ILE 26 N 1.55 5.02 -0.42 6.68 1.01 0.03 -1.26 121.20 133.80 1n2l s ILE 26 Ca 0.04 1.11 0.02 0.00 0.00 0.00 0.00 60.65 61.82 1n2l s ILE 26 Cb -0.24 -3.87 0.13 0.00 0.01 0.00 0.00 42.46 38.48 1n2l s ILE 26 CO 0.04 0.40 0.22 0.12 0.00 0.00 0.00 174.94 175.72 1n2l s PHE 27 N 0.02 1.94 0.92 3.97 5.36 0.24 -2.85 117.98 127.58 1n2l s PHE 27 Ca 0.29 -2.35 -0.10 0.00 -0.96 0.00 0.00 56.93 53.80 1n2l s PHE 27 Cb -0.17 -1.86 0.14 0.00 -0.34 0.00 0.00 43.02 40.80 1n2l s PHE 27 CO 0.14 -0.79 1.12 0.00 -1.46 0.00 0.00 175.22 174.23 1n2l s ALA 28 N 0.49 1.40 -0.18 11.12 0.00 0.36 -2.66 121.76 132.29 1n2l s ALA 28 Ca 0.17 0.42 -0.00 0.00 0.00 0.00 0.00 51.96 52.55 1n2l s ALA 28 Cb -0.24 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1n2l s ALA 28 CO -0.01 -2.69 -0.14 0.34 0.00 0.00 0.00 175.76 173.25 1n2l s ASP 29 N -2.82 3.63 -1.26 0.00 -1.08 -0.93 -2.02 116.67 112.19 1n2l s ASP 29 Ca 0.66 -0.51 -0.01 0.00 -0.52 0.00 0.00 52.55 52.16 1n2l s ASP 29 Cb -0.22 -1.58 0.00 0.00 -1.46 0.00 0.00 42.92 39.67 1n2l s ASP 29 CO 0.58 0.03 0.93 0.47 0.52 0.00 0.00 175.17 177.70 1n2l n ASP 30 N 4.40 -2.26 -4.74 -0.34 9.92 -1.26 -2.92 116.55 119.35 1n2l n ASP 30 Ca -0.19 -0.68 -0.36 0.00 -0.53 0.00 0.00 54.79 53.03 1n2l n ASP 30 Cb 0.51 -4.76 -0.08 0.00 -0.64 0.00 0.00 41.12 36.15 1n2l n ASP 30 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1n2l s LEU 31 N -6.57 3.90 0.56 0.64 2.96 -1.20 -4.54 118.68 114.43 1n2l s LEU 31 Ca 0.08 0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1n2l s LEU 31 Cb -0.04 -1.93 0.02 0.00 0.50 0.00 0.00 46.19 44.74 1n2l s LEU 31 CO 0.76 0.35 0.83 -0.83 -1.32 0.00 0.00 176.35 176.14 1n2l s GLY 32 N -0.69 1.64 0.35 7.98 0.00 -1.26 -4.31 107.32 111.04 1n2l s GLY 32 Ca 0.12 -0.93 0.08 0.00 0.00 0.00 0.00 44.72 43.99 1n2l s GLY 32 CO 0.02 -0.66 1.84 -1.82 0.00 0.00 0.00 173.10 172.48 1n2l h TYR 33 N -0.03 0.28 -0.72 1.90 3.20 -1.72 -3.03 116.97 116.85 1n2l h TYR 33 Ca -0.45 -0.04 -0.42 0.00 3.14 0.00 0.00 58.73 60.96 1n2l h TYR 33 Cb 1.27 -0.07 -0.24 0.00 1.54 0.00 0.00 36.73 39.23 1n2l h TYR 33 CO 0.43 0.46 0.27 0.41 -1.64 0.00 0.00 178.16 178.09 1n2l n GLY 34 N -0.64 5.08 0.13 1.82 0.00 0.27 -4.62 105.19 107.23 1n2l n GLY 34 Ca -0.01 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.29 1n2l n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n2l n ASP 35 N -1.06 1.99 -4.74 1.61 8.00 -1.14 -4.03 116.55 117.17 1n2l n ASP 35 Ca 0.49 0.25 -0.36 0.00 0.71 0.00 0.00 54.79 55.88 1n2l n ASP 35 Cb 1.19 -0.83 0.06 0.00 -0.02 0.00 0.00 41.12 41.52 1n2l n ASP 35 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1n2l s LEU 36 N -7.33 3.55 0.25 0.64 1.43 -1.26 -4.57 118.68 111.39 1n2l s LEU 36 Ca -0.29 2.45 -0.03 0.00 -1.03 0.00 0.00 54.13 55.22 1n2l s LEU 36 Cb 0.08 -4.60 0.29 0.00 0.03 0.00 0.00 46.19 41.98 1n2l s LEU 36 CO 0.64 -1.87 1.74 1.23 0.23 0.00 0.00 176.35 178.32 1n2l h GLY 37 N 0.50 0.92 1.18 -3.19 0.00 -1.84 -1.99 103.07 98.64 1n2l h GLY 37 Ca -0.50 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 46.21 1n2l h GLY 37 CO 0.53 0.57 0.00 0.00 0.00 0.00 0.00 176.54 177.65 1n2l n TYR 39 N -1.09 0.00 0.00 0.00 4.02 -0.76 -5.01 117.16 114.32 1n2l n TYR 39 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 1n2l n TYR 39 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 1n2l n TYR 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n2l n GLY 40 N 0.83 1.27 3.72 2.72 0.00 -1.02 -4.77 105.19 107.94 1n2l n GLY 40 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1n2l n GLY 40 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1n2l s HIS 41 N -2.00 3.70 0.21 1.61 5.04 -1.14 -4.98 115.29 117.72 1n2l s HIS 41 Ca 0.00 1.62 -0.10 0.00 -1.54 0.00 0.00 55.06 55.04 1n2l s HIS 41 Cb 0.00 -3.01 0.15 0.00 0.04 0.00 0.00 32.58 29.77 1n2l s HIS 41 CO 0.00 0.11 1.86 -1.35 -2.34 0.00 0.00 174.74 173.02 1n2l h PRO 42 N 6.26 1.01 0.00 2.88 0.11 -1.93 -3.37 132.00 136.96 1n2l h PRO 42 Ca -0.42 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1n2l h PRO 42 Cb 1.21 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1n2l h PRO 42 CO 0.73 0.69 -1.63 -1.13 -0.21 0.00 0.00 178.00 176.46 1n2l n SER 43 N -4.53 2.40 -4.63 -2.05 3.41 -1.26 -5.03 113.62 101.94 1n2l n SER 43 Ca 0.07 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.23 1n2l n SER 43 Cb 0.04 1.12 -0.02 0.00 -0.26 0.00 0.00 64.21 65.09 1n2l n SER 43 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1n2l n SER 44 N -2.16 1.99 -4.15 4.04 7.64 -1.26 -4.43 113.62 115.29 1n2l n SER 44 Ca -0.10 1.16 -0.37 0.00 1.01 0.00 0.00 58.87 60.58 1n2l n SER 44 Cb 0.58 -1.34 -0.12 0.00 -1.01 0.00 0.00 64.21 62.33 1n2l n SER 44 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1n2l s THR 45 N -0.51 3.38 -0.43 0.44 2.01 -1.26 -4.60 115.64 114.67 1n2l s THR 45 Ca 0.65 -1.87 0.10 0.00 0.31 0.00 0.00 61.69 60.88 1n2l s THR 45 Cb -0.70 -3.23 0.32 0.00 0.01 0.00 0.00 72.50 68.89 1n2l s THR 45 CO 0.55 -0.59 0.72 0.35 -0.69 0.00 0.00 174.62 174.96 1n2l n THR 46 N 4.65 0.39 0.10 -0.82 -2.24 -1.26 -4.24 114.28 110.86 1n2l n THR 46 Ca -0.05 -4.66 -0.14 0.00 -2.27 0.00 0.00 64.05 56.93 1n2l n THR 46 Cb 0.42 -0.94 -0.07 0.00 -2.10 0.00 0.00 70.33 67.63 1n2l n THR 46 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1n2l h PRO 47 N 3.30 -0.61 -0.77 -0.78 0.11 -1.94 -1.58 132.00 129.74 1n2l h PRO 47 Ca 0.10 0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.30 1n2l h PRO 47 Cb 0.86 0.14 -0.05 0.00 0.11 0.00 0.00 31.00 32.05 1n2l h PRO 47 CO 0.56 -0.40 0.48 -0.91 -0.21 0.00 0.00 178.00 177.52 1n2l h ASN 48 N -0.63 0.78 0.09 -2.05 2.35 -1.95 -2.00 115.58 112.18 1n2l h ASN 48 Ca 0.03 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.67 1n2l h ASN 48 Cb 0.67 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 1n2l h ASN 48 CO -0.26 0.53 -0.39 -0.07 -1.65 0.00 0.00 177.43 175.59 1n2l h LEU 49 N 0.92 0.42 -0.69 1.61 3.38 -1.78 -1.47 115.31 117.70 1n2l h LEU 49 Ca 0.32 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1n2l h LEU 49 Cb 0.07 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1n2l h LEU 49 CO -0.13 0.77 -0.03 0.44 0.09 0.00 0.00 178.44 179.58 1n2l h ASP 50 N 0.33 0.97 -0.08 -0.43 3.32 -0.82 -0.68 116.42 119.03 1n2l h ASP 50 Ca 0.03 -0.28 -0.14 0.00 0.02 0.00 0.00 57.03 56.67 1n2l h ASP 50 Cb 0.84 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1n2l h ASP 50 CO 0.07 1.04 -0.42 1.56 -1.72 0.00 0.00 179.24 179.77 1n2l h GLN 51 N 0.90 0.62 -0.52 3.56 4.20 -1.20 0.15 115.11 122.81 1n2l h GLN 51 Ca 0.16 -0.32 -0.06 0.00 0.06 0.00 0.00 58.65 58.48 1n2l h GLN 51 Cb 0.56 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 1n2l h GLN 51 CO 0.03 0.92 0.07 1.25 -0.67 0.00 0.00 178.83 180.43 1n2l h LEU 52 N 0.50 0.80 -0.11 1.46 5.85 -0.95 -0.85 115.31 122.01 1n2l h LEU 52 Ca 0.04 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 1n2l h LEU 52 Cb 0.93 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 1n2l h LEU 52 CO 0.08 0.82 -0.48 0.00 -0.34 0.00 0.00 178.44 178.52 1n2l h ALA 53 N 1.28 0.71 0.00 1.25 0.00 -0.80 -2.67 119.26 119.03 1n2l h ALA 53 Ca 0.16 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1n2l h ALA 53 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1n2l h ALA 53 CO 0.01 0.61 -0.45 0.00 0.00 0.00 0.00 179.25 179.42 1n2l h ALA 54 N 1.52 0.72 -0.37 0.00 0.00 -0.22 -3.28 119.26 117.63 1n2l h ALA 54 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1n2l h ALA 54 Cb 1.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1n2l h ALA 54 CO 0.06 0.56 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1n2l n GLY 55 N 1.17 3.52 3.67 0.00 0.00 -0.37 -4.83 105.19 108.35 1n2l n GLY 55 Ca 0.02 -0.89 -0.04 0.00 0.00 0.00 0.00 46.02 45.11 1n2l n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n2l s GLY 56 N -1.49 -0.31 0.42 -0.02 0.00 -1.01 -4.62 107.32 100.28 1n2l s GLY 56 Ca 0.42 0.46 -0.23 0.00 0.00 0.00 0.00 44.72 45.36 1n2l s GLY 56 CO 0.13 0.12 0.66 1.04 0.00 0.00 0.00 173.10 175.04 1n2l n LEU 57 N -0.40 0.59 -3.62 0.66 4.77 -0.50 -4.14 117.00 114.36 1n2l n LEU 57 Ca -0.07 0.94 -0.29 0.00 -0.03 0.00 0.00 56.01 56.57 1n2l n LEU 57 Cb 0.61 -1.17 -0.16 0.00 -2.33 0.00 0.00 43.42 40.38 1n2l n LEU 57 CO 0.13 -2.55 -0.33 -0.60 -1.33 0.00 0.00 177.39 172.70 1n2l s ARG 58 N -1.68 0.35 0.27 3.23 3.52 -0.95 -0.92 118.95 122.79 1n2l s ARG 58 Ca 0.63 -0.57 -0.29 0.00 -0.13 0.00 0.00 55.73 55.37 1n2l s ARG 58 Cb -0.60 -1.59 -0.09 0.00 -1.56 0.00 0.00 34.95 31.11 1n2l s ARG 58 CO 0.58 -0.91 1.15 -0.06 -0.81 0.00 0.00 175.30 175.25 1n2l s PHE 59 N 1.96 3.46 -0.14 5.12 0.40 -1.06 -2.65 117.98 125.06 1n2l s PHE 59 Ca 0.07 1.60 0.14 0.00 -0.60 0.00 0.00 56.93 58.14 1n2l s PHE 59 Cb -0.16 -3.38 -0.21 0.00 0.51 0.00 0.00 43.02 39.77 1n2l s PHE 59 CO -0.26 -0.90 0.37 0.25 0.70 0.00 0.00 175.22 175.38 1n2l n THR 60 N 1.33 0.00 -3.44 0.64 -2.24 -0.96 -4.30 114.28 105.30 1n2l n THR 60 Ca -0.00 -0.30 -0.26 0.00 -2.27 0.00 0.00 64.05 61.22 1n2l n THR 60 Cb 0.44 0.33 -0.09 0.00 -2.10 0.00 0.00 70.33 68.91 1n2l n THR 60 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1n2l n ASP 61 N -1.88 1.58 -4.27 3.42 9.92 -1.26 -5.04 116.55 119.03 1n2l n ASP 61 Ca -0.02 -2.93 -0.33 0.00 -0.53 0.00 0.00 54.79 50.99 1n2l n ASP 61 Cb 0.35 -0.65 -0.16 0.00 -0.64 0.00 0.00 41.12 40.02 1n2l n ASP 61 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1n2l s PHE 62 N -1.31 2.72 0.40 1.24 2.19 -1.26 -2.72 117.98 119.24 1n2l s PHE 62 Ca 0.34 -0.98 0.06 0.00 0.33 0.00 0.00 56.93 56.68 1n2l s PHE 62 Cb 0.09 -1.83 -0.07 0.00 -1.31 0.00 0.00 43.02 39.90 1n2l s PHE 62 CO -0.12 -0.41 0.02 0.71 1.83 0.00 0.00 175.22 177.25 1n2l s TYR 63 N 0.59 2.41 -0.02 10.12 1.51 0.39 -1.46 117.35 130.89 1n2l s TYR 63 Ca -0.10 -0.73 0.03 0.00 -1.01 0.00 0.00 57.07 55.26 1n2l s TYR 63 Cb -0.16 -1.69 -0.00 0.00 -0.11 0.00 0.00 41.96 39.99 1n2l s TYR 63 CO 0.03 0.37 -0.09 0.14 -1.11 0.00 0.00 175.55 174.89 1n2l s VAL 64 N -2.81 0.75 0.25 0.71 -7.23 -0.56 -1.29 120.40 110.22 1n2l s VAL 64 Ca 0.34 -0.37 -0.04 0.00 -1.81 0.00 0.00 61.98 60.10 1n2l s VAL 64 Cb 0.09 -0.65 0.22 0.00 0.56 0.00 0.00 36.38 36.60 1n2l s VAL 64 CO 0.17 0.23 1.82 1.55 -0.31 0.00 0.00 175.10 178.55 1n2l h PRO 65 N 6.17 0.81 -5.35 4.82 0.13 -1.89 -3.44 132.00 133.26 1n2l h PRO 65 Ca -0.32 -0.05 -0.43 0.00 -0.87 0.00 0.00 66.00 64.33 1n2l h PRO 65 Cb 1.17 -0.18 -0.23 0.00 0.13 0.00 0.00 31.00 31.89 1n2l h PRO 65 CO 0.49 0.54 -0.78 0.08 -0.23 0.00 0.00 178.00 178.09 1n2l s VAL 66 N -6.03 1.12 -0.38 1.56 1.01 -1.26 -2.58 120.40 113.83 1n2l s VAL 66 Ca -0.12 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 60.63 1n2l s VAL 66 Cb 0.19 -1.06 0.12 0.00 0.00 0.00 0.00 36.38 35.63 1n2l s VAL 66 CO 0.78 -0.14 2.49 -0.24 0.00 0.00 0.00 175.10 177.99 1n2l n SER 67 N 1.49 6.44 0.00 3.32 2.88 -1.26 -4.41 113.62 122.09 1n2l n SER 67 Ca -0.20 -3.13 0.00 0.00 -1.33 0.00 0.00 58.87 54.21 1n2l n SER 67 Cb 0.54 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 1n2l n SER 67 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1n2l n LEU 68 N 0.69 0.00 0.00 2.46 4.77 -1.26 -1.60 117.00 122.06 1n2l n LEU 68 Ca 0.41 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1n2l n LEU 68 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1n2l n LEU 68 CO 0.35 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.82 1n2l n THR 70 N 0.00 0.00 -0.25 -5.08 -1.04 -1.26 -1.99 114.28 104.66 1n2l n THR 70 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 1n2l n THR 70 Cb 0.00 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 68.58 1n2l n THR 70 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1n2l h PRO 71 N 0.00 0.88 -0.07 -2.82 0.13 -1.84 0.26 132.00 128.54 1n2l h PRO 71 Ca 0.00 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 65.10 1n2l h PRO 71 Cb 0.00 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 30.91 1n2l h PRO 71 CO 0.00 0.58 -0.05 1.03 -0.23 0.00 0.00 178.00 179.33 1n2l h SER 72 N 0.90 -0.17 -0.51 1.44 0.87 -1.61 -0.58 113.55 113.89 1n2l h SER 72 Ca 0.28 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.83 1n2l h SER 72 Cb -0.02 0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 1n2l h SER 72 CO -0.09 -0.07 0.15 0.03 -0.53 0.00 0.00 176.83 176.31 1n2l h ARG 73 N -0.06 0.86 -0.35 2.24 3.08 -1.72 -1.45 114.38 116.98 1n2l h ARG 73 Ca 0.05 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 1n2l h ARG 73 Cb 0.13 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1n2l h ARG 73 CO -0.11 0.77 0.22 0.00 -1.07 0.00 0.00 179.97 179.77 1n2l h ALA 74 N 1.33 0.45 -0.15 0.04 0.00 -0.41 -2.39 119.26 118.12 1n2l h ALA 74 Ca 0.18 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1n2l h ALA 74 Cb 0.29 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1n2l h ALA 74 CO -0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 179.25 178.94 1n2l h ALA 75 N 1.10 1.31 0.03 0.00 0.00 -0.75 -1.28 119.26 119.66 1n2l h ALA 75 Ca 0.13 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1n2l h ALA 75 Cb -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1n2l h ALA 75 CO -0.02 0.47 -0.01 1.25 0.00 0.00 0.00 179.25 180.93 1n2l h LEU 76 N 0.25 -0.03 -0.05 0.00 5.85 -0.80 0.95 115.31 121.48 1n2l h LEU 76 Ca 0.04 -0.15 -0.19 0.00 0.84 0.00 0.00 57.88 58.42 1n2l h LEU 76 Cb 0.57 0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.62 1n2l h LEU 76 CO 0.04 0.13 -0.69 -0.07 -0.34 0.00 0.00 178.44 177.51 1n2l h LEU 77 N -0.20 0.69 0.00 2.25 3.38 -1.35 -3.34 115.31 116.74 1n2l h LEU 77 Ca -0.00 -0.71 -0.06 0.00 0.09 0.00 0.00 57.88 57.20 1n2l h LEU 77 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1n2l h LEU 77 CO 0.01 1.30 -0.77 0.71 0.09 0.00 0.00 178.44 179.77 1n2l h THR 78 N 0.15 0.30 -0.00 0.22 1.35 -1.32 0.87 112.91 114.47 1n2l h THR 78 Ca -0.07 -1.50 -0.00 0.00 -0.55 0.00 0.00 66.41 64.29 1n2l h THR 78 Cb 1.36 1.93 -0.00 0.00 -1.73 0.00 0.00 68.15 69.72 1n2l h THR 78 CO 0.14 0.17 -0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1n2l n GLY 79 N 1.22 0.36 3.52 5.82 0.00 0.33 -4.90 105.19 111.54 1n2l n GLY 79 Ca -0.01 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1n2l n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n2l s ARG 80 N -0.59 1.84 0.08 1.61 0.52 -1.25 -2.22 118.95 118.95 1n2l s ARG 80 Ca 0.00 -1.70 -0.31 0.00 -0.52 0.00 0.00 55.73 53.20 1n2l s ARG 80 Cb 0.00 -1.86 -0.08 0.00 0.52 0.00 0.00 34.95 33.53 1n2l s ARG 80 CO 0.00 0.31 1.52 -0.51 0.02 0.00 0.00 175.30 176.64 1n2l s LEU 81 N -3.56 4.36 0.39 2.53 1.43 -1.26 -4.19 118.68 118.38 1n2l s LEU 81 Ca 0.31 2.39 0.23 0.00 -1.03 0.00 0.00 54.13 56.02 1n2l s LEU 81 Cb -0.05 -3.57 1.27 0.00 0.03 0.00 0.00 46.19 43.87 1n2l s LEU 81 CO 0.16 -0.78 1.65 -0.65 0.23 0.00 0.00 176.35 176.96 1n2l h PRO 82 N 7.54 0.18 0.00 1.29 0.11 -1.93 0.10 132.00 139.29 1n2l h PRO 82 Ca -0.41 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1n2l h PRO 82 Cb 1.20 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1n2l h PRO 82 CO 0.90 0.12 -0.02 -0.39 -0.21 0.00 0.00 178.00 178.40 1n2l h VAL 83 N 0.18 0.09 -0.08 3.15 -1.51 -1.91 -2.15 116.25 114.04 1n2l h VAL 83 Ca 0.77 -0.33 -0.04 0.00 -1.23 0.00 0.00 66.70 65.88 1n2l h VAL 83 Cb 2.13 1.29 -0.00 0.00 -2.13 0.00 0.00 31.29 32.58 1n2l h VAL 83 CO -0.51 0.02 -0.10 0.03 -1.23 0.00 0.00 177.57 175.79 1n2l h ARG 84 N 0.00 0.20 -0.23 5.19 3.08 -1.02 0.41 114.38 122.00 1n2l h ARG 84 Ca -0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1n2l h ARG 84 Cb 0.29 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1n2l h ARG 84 CO 0.00 0.66 0.00 0.00 -1.07 0.00 0.00 179.97 179.56 1n2l n MET 85 N -4.67 1.63 -1.51 0.04 0.00 -1.15 -2.86 117.12 108.60 1n2l n MET 85 Ca -0.07 -0.97 -0.08 0.00 0.00 0.00 0.00 57.70 56.57 1n2l n MET 85 Cb 0.33 -1.27 -0.03 0.00 0.00 0.00 0.00 33.22 32.26 1n2l n MET 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1n2l n GLY 86 N 0.99 0.73 2.31 3.17 0.00 -1.14 -4.75 105.19 106.51 1n2l n GLY 86 Ca 0.11 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 1n2l n GLY 86 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n2l n MET 87 N -2.48 3.71 -3.68 1.61 2.81 -0.82 -0.23 117.12 118.04 1n2l n MET 87 Ca -0.09 -2.27 -0.09 0.00 -1.81 0.00 0.00 57.70 53.44 1n2l n MET 87 Cb 0.36 -2.73 -0.02 0.00 -0.71 0.00 0.00 33.22 30.12 1n2l n MET 87 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 1n2l s TYR 88 N 1.73 -0.34 0.22 2.03 -0.85 -1.26 -4.36 117.35 114.53 1n2l s TYR 88 Ca 0.68 -0.02 -0.01 0.00 -0.52 0.00 0.00 57.07 57.20 1n2l s TYR 88 Cb 0.19 0.65 -0.04 0.00 0.38 0.00 0.00 41.96 43.13 1n2l s TYR 88 CO -0.06 -1.07 0.43 -1.25 -1.52 0.00 0.00 175.55 172.07 1n2l s PRO 89 N -3.84 3.54 2.81 -3.49 0.04 -1.26 -3.42 135.00 129.37 1n2l s PRO 89 Ca 0.07 -0.28 0.00 0.00 0.04 0.00 0.00 61.00 60.83 1n2l s PRO 89 Cb -0.04 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.70 1n2l s PRO 89 CO -0.01 0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.79 1n2l n GLY 90 N -0.75 -0.03 3.74 0.56 0.00 -0.75 -4.87 105.19 103.09 1n2l n GLY 90 Ca -0.04 -0.99 -0.23 0.00 0.00 0.00 0.00 46.02 44.76 1n2l n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n2l s VAL 91 N 0.00 3.19 0.22 1.61 -7.23 -1.26 -4.69 120.40 112.24 1n2l s VAL 91 Ca 0.00 -1.67 -0.29 0.00 -1.81 0.00 0.00 61.98 58.21 1n2l s VAL 91 Cb 0.00 -3.01 -0.09 0.00 0.56 0.00 0.00 36.38 33.85 1n2l s VAL 91 CO 0.00 -0.21 0.92 -0.76 -0.31 0.00 0.00 175.10 174.74 1n2l s LEU 92 N -3.84 4.64 0.40 1.32 1.43 -1.26 -5.04 118.68 116.32 1n2l s LEU 92 Ca 0.37 1.90 0.08 0.00 -1.03 0.00 0.00 54.13 55.45 1n2l s LEU 92 Cb -0.03 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.61 1n2l s LEU 92 CO 0.23 0.16 0.43 0.68 0.23 0.00 0.00 176.35 178.08 1n2l s VAL 93 N -1.13 2.99 0.26 -1.59 -7.23 -1.26 -4.93 120.40 107.51 1n2l s VAL 93 Ca 0.40 -1.21 -0.03 0.00 -1.81 0.00 0.00 61.98 59.33 1n2l s VAL 93 Cb -0.25 -3.06 0.27 0.00 0.56 0.00 0.00 36.38 33.90 1n2l s VAL 93 CO 0.31 -0.04 1.89 1.55 -0.31 0.00 0.00 175.10 178.50 1n2l h PRO 94 N 0.92 1.17 -0.43 4.82 0.13 -1.98 -2.57 132.00 134.07 1n2l h PRO 94 Ca -0.42 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1n2l h PRO 94 Cb 1.27 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1n2l h PRO 94 CO 0.53 0.78 0.00 -1.13 -0.23 0.00 0.00 178.00 177.95 1n2l n SER 95 N -4.48 1.69 -4.76 1.44 3.41 -1.26 -4.57 113.62 105.08 1n2l n SER 95 Ca 0.15 -2.09 -0.36 0.00 -0.26 0.00 0.00 58.87 56.31 1n2l n SER 95 Cb 0.16 -0.28 0.01 0.00 -0.26 0.00 0.00 64.21 63.84 1n2l n SER 95 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1n2l s SER 96 N -0.78 5.65 -0.00 4.04 0.01 -0.97 -0.11 113.70 121.54 1n2l s SER 96 Ca 0.17 2.35 0.15 0.00 1.31 0.00 0.00 55.95 59.93 1n2l s SER 96 Cb 0.10 -2.60 -0.19 0.00 0.21 0.00 0.00 66.02 63.54 1n2l s SER 96 CO 0.09 -1.28 0.71 0.54 0.41 0.00 0.00 173.24 173.72 1n2l n ARG 97 N -1.10 0.63 -2.46 12.44 1.74 -0.66 -4.16 116.66 123.08 1n2l n ARG 97 Ca 0.11 0.24 -0.25 0.00 -0.77 0.00 0.00 57.85 57.18 1n2l n ARG 97 Cb 0.49 -1.78 0.13 0.00 -1.02 0.00 0.00 32.46 30.27 1n2l n ARG 97 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1n2l s GLY 98 N -4.97 1.76 0.00 -0.13 0.00 -1.25 -4.49 107.32 98.25 1n2l s GLY 98 Ca -0.04 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.01 1n2l s GLY 98 CO 0.82 -1.04 0.00 0.61 0.00 0.00 0.00 173.10 173.49 1n2l n GLY 99 N -3.05 -0.83 3.62 0.20 0.00 -1.26 -4.12 105.19 99.76 1n2l n GLY 99 Ca 0.16 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 1n2l n GLY 99 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n2l s LEU 100 N 0.00 3.82 0.22 0.99 2.96 0.11 -4.90 118.68 121.88 1n2l s LEU 100 Ca 0.00 2.04 -0.31 0.00 -0.22 0.00 0.00 54.13 55.64 1n2l s LEU 100 Cb 0.00 -3.52 -0.15 0.00 0.50 0.00 0.00 46.19 43.02 1n2l s LEU 100 CO 0.00 -1.56 1.16 -2.65 -1.32 0.00 0.00 176.35 171.98 1n2l n PRO 101 N 8.19 1.39 0.26 0.98 -0.02 -1.26 -4.88 135.00 139.65 1n2l n PRO 101 Ca 0.24 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 62.35 1n2l n PRO 101 Cb 0.44 -1.98 0.66 0.00 -0.02 0.00 0.00 33.50 32.60 1n2l n PRO 101 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1n2l h LEU 102 N 3.07 0.00 -1.71 2.45 3.38 -1.92 -2.27 115.31 118.31 1n2l h LEU 102 Ca -0.42 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 1n2l h LEU 102 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 1n2l h LEU 102 CO 0.68 0.12 -0.17 1.05 0.09 0.00 0.00 178.44 180.21 1n2l h GLU 103 N 0.00 0.00 -6.34 1.13 4.11 -1.99 -3.42 114.58 108.08 1n2l h GLU 103 Ca -0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.88 1n2l h GLU 103 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1n2l h GLU 103 CO 0.02 0.17 0.74 -1.21 0.07 0.00 0.00 179.01 178.80 1n2l s GLU 104 N -4.20 4.33 -0.14 1.06 0.41 -0.86 -5.00 118.70 114.30 1n2l s GLU 104 Ca -0.03 1.77 -0.22 0.00 -0.41 0.00 0.00 54.97 56.08 1n2l s GLU 104 Cb 0.13 -3.55 -0.03 0.00 -1.78 0.00 0.00 34.13 28.90 1n2l s GLU 104 CO 0.62 -0.48 0.69 0.14 -0.49 0.00 0.00 175.26 175.74 1n2l s VAL 105 N 2.22 5.01 0.55 2.63 -7.23 -1.26 -4.97 120.40 117.35 1n2l s VAL 105 Ca 0.58 1.35 0.03 0.00 -1.81 0.00 0.00 61.98 62.14 1n2l s VAL 105 Cb -0.27 -4.01 0.05 0.00 0.56 0.00 0.00 36.38 32.71 1n2l s VAL 105 CO 0.24 0.15 0.76 0.42 -0.31 0.00 0.00 175.10 176.36 1n2l s THR 106 N 1.50 2.61 0.43 5.32 -4.23 -1.26 -4.40 115.64 115.62 1n2l s THR 106 Ca 0.33 -0.76 0.19 0.00 -1.18 0.00 0.00 61.69 60.28 1n2l s THR 106 Cb -0.17 -2.86 0.21 0.00 1.34 0.00 0.00 72.50 71.03 1n2l s THR 106 CO 0.13 0.00 2.00 1.62 -0.54 0.00 0.00 174.62 177.84 1n2l h VAL 107 N 0.12 0.95 -0.36 2.29 3.04 -1.14 -2.16 116.25 118.99 1n2l h VAL 107 Ca -0.40 -0.66 -0.15 0.00 -1.01 0.00 0.00 66.70 64.49 1n2l h VAL 107 Cb 1.29 1.37 -0.01 0.00 -2.01 0.00 0.00 31.29 31.93 1n2l h VAL 107 CO 0.48 0.18 -0.35 0.00 -1.01 0.00 0.00 177.57 176.86 1n2l h ALA 108 N 1.82 0.69 -0.36 3.17 0.00 -1.85 -2.41 119.26 120.32 1n2l h ALA 108 Ca -0.00 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 1n2l h ALA 108 Cb 0.36 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1n2l h ALA 108 CO 0.02 0.67 -0.07 0.93 0.00 0.00 0.00 179.25 180.80 1n2l h GLU 109 N 0.69 0.68 -0.68 0.00 5.08 -1.56 -0.66 114.58 118.13 1n2l h GLU 109 Ca 0.07 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1n2l h GLU 109 Cb 0.92 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 1n2l h GLU 109 CO 0.08 0.83 0.35 0.28 -1.00 0.00 0.00 179.01 179.56 1n2l h VAL 110 N 0.48 1.22 -0.06 3.13 2.07 -1.44 -2.86 116.25 118.80 1n2l h VAL 110 Ca 0.09 -0.59 -0.19 0.00 0.82 0.00 0.00 66.70 66.84 1n2l h VAL 110 Cb 0.57 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1n2l h VAL 110 CO 0.03 0.25 -0.77 -0.07 0.02 0.00 0.00 177.57 177.03 1n2l h LEU 111 N 0.94 0.45 -0.78 2.57 3.38 -1.39 -3.15 115.31 117.34 1n2l h LEU 111 Ca 0.24 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.94 1n2l h LEU 111 Cb 0.08 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1n2l h LEU 111 CO -0.03 1.07 0.48 0.00 0.09 0.00 0.00 178.44 180.04 1n2l h ALA 112 N 0.92 1.05 0.00 1.53 0.00 -0.91 -0.45 119.26 121.40 1n2l h ALA 112 Ca -0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1n2l h ALA 112 Cb 1.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1n2l h ALA 112 CO 0.13 0.23 -0.32 0.00 0.00 0.00 0.00 179.25 179.29 1n2l h ALA 113 N 1.36 1.23 0.00 0.00 0.00 -1.54 -1.66 119.26 118.65 1n2l h ALA 113 Ca 0.33 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1n2l h ALA 113 Cb 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1n2l h ALA 113 CO -0.15 0.40 0.00 -2.13 0.00 0.00 0.00 179.25 177.37 1n2l n ARG 114 N -3.81 0.93 -1.54 0.00 3.00 -0.28 -4.84 116.66 110.11 1n2l n ARG 114 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 1n2l n ARG 114 Cb 0.40 -1.32 0.00 0.00 0.00 0.00 0.00 32.46 31.54 1n2l n ARG 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1n2l n GLY 115 N 0.70 0.81 3.88 5.14 0.00 -0.63 -5.05 105.19 110.05 1n2l n GLY 115 Ca 0.14 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 1n2l n GLY 115 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n2l s TYR 116 N -2.10 3.50 -0.91 1.61 1.51 -0.59 -4.30 117.35 116.07 1n2l s TYR 116 Ca 0.00 0.72 -0.15 0.00 -1.01 0.00 0.00 57.07 56.63 1n2l s TYR 116 Cb 0.00 -2.12 0.20 0.00 -0.11 0.00 0.00 41.96 39.93 1n2l s TYR 116 CO 0.00 0.42 0.93 -1.17 -1.11 0.00 0.00 175.55 174.62 1n2l s LEU 117 N -2.45 6.19 0.55 -1.29 2.96 0.28 -4.48 118.68 120.44 1n2l s LEU 117 Ca 0.40 -2.64 -0.18 0.00 -0.22 0.00 0.00 54.13 51.48 1n2l s LEU 117 Cb -0.13 -2.27 -0.05 0.00 0.50 0.00 0.00 46.19 44.24 1n2l s LEU 117 CO 0.22 -0.68 1.09 0.42 -1.32 0.00 0.00 176.35 176.08 1n2l s THR 118 N 0.73 3.47 -0.28 3.68 -4.23 -1.26 -1.41 115.64 116.34 1n2l s THR 118 Ca 0.24 0.84 -0.22 0.00 -1.18 0.00 0.00 61.69 61.38 1n2l s THR 118 Cb -0.08 -3.33 0.11 0.00 1.34 0.00 0.00 72.50 70.54 1n2l s THR 118 CO -0.09 -0.27 0.90 -0.83 -0.54 0.00 0.00 174.62 173.79 1n2l s GLY 119 N -2.12 -0.28 0.04 3.99 0.00 0.32 -3.11 107.32 106.16 1n2l s GLY 119 Ca 0.69 2.59 0.08 0.00 0.00 0.00 0.00 44.72 48.08 1n2l s GLY 119 CO 0.28 2.07 -0.24 -0.29 0.00 0.00 0.00 173.10 174.93 1n2l s MET 120 N 0.73 1.61 -0.11 2.90 1.75 -1.04 -0.37 119.30 124.77 1n2l s MET 120 Ca -0.02 -1.03 -0.03 0.00 -1.25 0.00 0.00 55.69 53.36 1n2l s MET 120 Cb -0.05 -1.76 0.04 0.00 2.84 0.00 0.00 34.83 35.90 1n2l s MET 120 CO -0.09 0.45 0.04 0.00 -0.65 0.00 0.00 175.02 174.78 1n2l s ALA 121 N -0.80 0.59 0.00 4.11 0.00 -0.63 -2.54 121.76 122.49 1n2l s ALA 121 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1n2l s ALA 121 Cb -0.09 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.15 1n2l s ALA 121 CO 0.02 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.40 1n2l n GLY 122 N 5.19 0.22 3.70 0.00 0.00 0.11 -1.87 105.19 112.55 1n2l n GLY 122 Ca -0.06 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 1n2l n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n2l s LYS 123 N 0.00 4.24 -0.12 1.61 2.20 -0.36 -2.84 119.74 124.47 1n2l s LYS 123 Ca 0.00 2.23 -0.11 0.00 -0.36 0.00 0.00 55.97 57.73 1n2l s LYS 123 Cb 0.00 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1n2l s LYS 123 CO 0.00 -0.61 -0.21 1.87 -0.36 0.00 0.00 175.35 176.04 1n2l n TRP 124 N 4.71 0.15 -3.56 4.03 -0.00 -0.96 -4.76 117.44 117.05 1n2l n TRP 124 Ca 0.14 0.06 -0.26 0.00 -0.00 0.00 0.00 57.50 57.44 1n2l n TRP 124 Cb 0.41 -0.41 -0.00 0.00 -0.00 0.00 0.00 31.31 31.31 1n2l n TRP 124 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.69 179.27 1n2l n HIS 125 N -3.86 -1.84 -1.79 5.87 -0.00 -0.32 -4.85 115.22 108.43 1n2l n HIS 125 Ca -0.09 0.57 0.06 0.00 0.46 0.00 0.00 57.72 58.72 1n2l n HIS 125 Cb 0.32 -3.07 0.14 0.00 -0.12 0.00 0.00 29.99 27.26 1n2l n HIS 125 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1n2l n LEU 126 N -3.93 2.07 0.00 0.27 4.77 -1.26 -4.38 117.00 114.54 1n2l n LEU 126 Ca 0.01 -3.15 0.00 0.00 -0.03 0.00 0.00 56.01 52.83 1n2l n LEU 126 Cb 0.53 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1n2l n LEU 126 CO 0.59 1.02 0.00 0.61 -1.33 0.00 0.00 177.39 178.29 1n2l n GLY 127 N -0.68 2.15 1.13 -0.72 0.00 -1.26 0.05 105.19 105.86 1n2l n GLY 127 Ca 0.14 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1n2l n GLY 127 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n2l n VAL 128 N 1.98 0.72 -4.36 1.61 0.31 -1.26 -4.16 118.33 113.17 1n2l n VAL 128 Ca 0.00 0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 1n2l n VAL 128 Cb 0.00 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 1n2l n VAL 128 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n2l n GLY 129 N 3.14 -0.89 0.00 2.92 0.00 -1.26 -2.57 105.19 106.53 1n2l n GLY 129 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1n2l n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n2l n PRO 130 N -0.17 0.00 -0.52 1.61 -0.02 -1.26 -3.95 135.00 130.68 1n2l n PRO 130 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.41 1n2l n PRO 130 Cb 0.00 -0.23 0.12 0.00 -0.02 0.00 0.00 33.50 33.36 1n2l n PRO 130 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1n2l n GLU 131 N 0.00 1.97 -1.97 -0.52 -0.58 -1.26 -4.77 120.64 113.50 1n2l n GLU 131 Ca 0.00 -1.42 -0.01 0.00 -0.42 0.00 0.00 57.16 55.31 1n2l n GLU 131 Cb 0.00 -1.65 -0.00 0.00 -0.57 0.00 0.00 31.44 29.22 1n2l n GLU 131 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n2l n GLY 132 N -0.09 0.35 0.22 0.62 0.00 -1.23 -4.93 105.19 100.12 1n2l n GLY 132 Ca 0.23 -0.87 0.15 0.00 0.00 0.00 0.00 46.02 45.53 1n2l n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l h ALA 133 N 0.03 1.01 -0.21 4.61 0.00 -1.81 -1.35 119.26 121.53 1n2l h ALA 133 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1n2l h ALA 133 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1n2l h ALA 133 CO 0.02 -0.01 0.00 1.19 0.00 0.00 0.00 179.25 180.45 1n2l n PHE 134 N -2.52 0.27 -1.56 0.00 3.72 -1.06 -4.80 117.46 111.50 1n2l n PHE 134 Ca -0.02 -0.19 -0.32 0.00 -0.05 0.00 0.00 57.45 56.87 1n2l n PHE 134 Cb 0.05 -0.01 0.07 0.00 -0.94 0.00 0.00 39.48 38.66 1n2l n PHE 134 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1n2l s LEU 135 N -1.26 3.27 0.30 4.37 2.01 -0.51 -4.71 118.68 122.14 1n2l s LEU 135 Ca 0.26 1.98 0.01 0.00 0.01 0.00 0.00 54.13 56.39 1n2l s LEU 135 Cb 0.16 -4.55 0.73 0.00 0.01 0.00 0.00 46.19 42.54 1n2l s LEU 135 CO 0.22 -1.83 1.59 -0.65 1.01 0.00 0.00 176.35 176.69 1n2l h PRO 136 N -0.38 0.04 -0.18 1.29 0.11 -1.90 -0.66 132.00 130.32 1n2l h PRO 136 Ca -0.46 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.70 1n2l h PRO 136 Cb 1.25 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1n2l h PRO 136 CO 0.53 0.02 0.30 -1.35 -0.21 0.00 0.00 178.00 177.29 1n2l h PRO 137 N 0.04 0.00 0.00 1.05 0.11 -1.89 0.22 132.00 131.53 1n2l h PRO 137 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 1n2l h PRO 137 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1n2l h PRO 137 CO -0.87 0.00 -1.14 0.72 -0.21 0.00 0.00 178.00 176.50 1n2l n HIS 138 N -3.43 0.40 1.10 0.65 8.25 -0.26 -4.15 115.22 117.78 1n2l n HIS 138 Ca 0.02 0.12 0.13 0.00 -0.26 0.00 0.00 57.72 57.72 1n2l n HIS 138 Cb 0.41 -0.57 0.27 0.00 1.12 0.00 0.00 29.99 31.22 1n2l n HIS 138 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1n2l n GLN 139 N -2.17 2.09 0.00 -0.41 1.13 0.04 -4.94 117.38 113.12 1n2l n GLN 139 Ca 0.01 -1.60 0.00 0.00 -1.94 0.00 0.00 57.00 53.47 1n2l n GLN 139 Cb 0.48 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.36 1n2l n GLN 139 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1n2l n GLY 140 N 1.30 1.05 3.77 1.08 0.00 -1.06 -4.18 105.19 107.14 1n2l n GLY 140 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1n2l n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n2l s PHE 141 N -1.43 3.69 -0.09 1.61 0.08 -1.03 -4.42 117.98 116.38 1n2l s PHE 141 Ca 0.00 1.20 -0.23 0.00 0.12 0.00 0.00 56.93 58.02 1n2l s PHE 141 Cb 0.00 -2.60 -0.19 0.00 -0.57 0.00 0.00 43.02 39.66 1n2l s PHE 141 CO 0.00 0.37 0.78 0.45 -0.10 0.00 0.00 175.22 176.72 1n2l h HIS 142 N 5.57 -0.05 -2.62 0.36 3.86 -1.87 -3.36 115.15 117.03 1n2l h HIS 142 Ca -0.45 -0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.16 1n2l h HIS 142 Cb 1.20 0.02 -0.12 0.00 1.06 0.00 0.00 27.41 29.57 1n2l h HIS 142 CO 0.66 0.59 -0.68 1.03 0.86 0.00 0.00 177.93 180.39 1n2l s ARG 143 N -2.78 2.21 -0.09 2.45 0.52 -1.21 -4.95 118.95 115.09 1n2l s ARG 143 Ca -0.14 -1.32 -0.27 0.00 -0.52 0.00 0.00 55.73 53.48 1n2l s ARG 143 Cb -0.01 -2.18 0.06 0.00 0.52 0.00 0.00 34.95 33.34 1n2l s ARG 143 CO 0.55 0.41 0.62 0.12 0.02 0.00 0.00 175.30 177.02 1n2l s PHE 144 N -1.99 -0.61 -0.30 -0.53 5.36 -1.26 -2.51 117.98 116.14 1n2l s PHE 144 Ca 0.28 1.16 -0.04 0.00 -0.96 0.00 0.00 56.93 57.37 1n2l s PHE 144 Cb -0.08 0.33 0.18 0.00 -0.34 0.00 0.00 43.02 43.11 1n2l s PHE 144 CO 0.18 -0.52 0.67 -1.17 -1.46 0.00 0.00 175.22 172.92 1n2l s LEU 145 N -0.85 -1.22 0.00 6.12 2.96 -1.05 -2.29 118.68 122.34 1n2l s LEU 145 Ca -0.09 0.92 0.00 0.00 -0.22 0.00 0.00 54.13 54.74 1n2l s LEU 145 Cb -0.02 2.09 0.00 0.00 0.50 0.00 0.00 46.19 48.76 1n2l s LEU 145 CO 0.07 -0.23 0.00 0.61 -1.32 0.00 0.00 176.35 175.48 1n2l n GLY 146 N 5.42 1.10 3.72 7.98 0.00 -0.90 0.09 105.19 122.60 1n2l n GLY 146 Ca -0.04 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.43 1n2l n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n2l s ILE 147 N -2.00 4.81 -1.02 -0.61 1.01 -1.13 -1.97 121.20 120.29 1n2l s ILE 147 Ca 0.00 1.89 0.01 0.00 0.00 0.00 0.00 60.65 62.55 1n2l s ILE 147 Cb 0.00 -4.24 0.01 0.00 0.01 0.00 0.00 42.46 38.24 1n2l s ILE 147 CO 0.00 0.24 1.03 -0.81 0.00 0.00 0.00 174.94 175.40 1n2l n PRO 148 N 3.49 0.00 -3.46 2.79 -0.04 -1.26 -2.27 135.00 134.24 1n2l n PRO 148 Ca 0.03 0.47 -0.06 0.00 -0.04 0.00 0.00 63.50 63.90 1n2l n PRO 148 Cb 0.51 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.49 1n2l n PRO 148 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1n2l n TYR 149 N -1.49 -1.88 -1.59 0.54 0.18 -1.26 -1.18 117.16 110.48 1n2l n TYR 149 Ca 0.00 -1.45 -0.51 0.00 1.88 0.00 0.00 57.90 57.82 1n2l n TYR 149 Cb 0.01 0.72 -0.06 0.00 -0.38 0.00 0.00 39.34 39.64 1n2l n TYR 149 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 1n2l n SER 150 N -1.38 1.70 0.00 9.48 7.64 -1.26 -4.74 113.62 125.06 1n2l n SER 150 Ca -0.06 1.12 0.04 0.00 1.01 0.00 0.00 58.87 60.99 1n2l n SER 150 Cb 0.51 -1.21 0.25 0.00 -1.01 0.00 0.00 64.21 62.75 1n2l n SER 150 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n2l n HIS 151 N 2.42 0.00 1.04 1.43 1.44 -1.26 -1.57 115.22 118.72 1n2l n HIS 151 Ca 0.18 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 1n2l n HIS 151 Cb 0.21 -0.13 0.05 0.00 0.12 0.00 0.00 29.99 30.24 1n2l n HIS 151 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 1n2l n ASP 152 N -1.13 1.92 -2.47 4.39 5.75 -1.26 -4.54 116.55 119.21 1n2l n ASP 152 Ca 0.06 -1.44 -0.23 0.00 -0.01 0.00 0.00 54.79 53.17 1n2l n ASP 152 Cb 0.05 0.42 -0.10 0.00 -1.03 0.00 0.00 41.12 40.46 1n2l n ASP 152 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1n2l n GLN 153 N -0.08 2.61 -3.65 0.11 6.02 -0.61 -1.56 117.38 120.23 1n2l n GLN 153 Ca 0.10 -1.76 -0.03 0.00 -0.01 0.00 0.00 57.00 55.29 1n2l n GLN 153 Cb 0.46 -2.22 -0.07 0.00 1.02 0.00 0.00 30.24 29.43 1n2l n GLN 153 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1n2l s GLY 154 N 1.45 0.26 0.05 1.08 0.00 -1.24 -4.74 107.32 104.18 1n2l s GLY 154 Ca 0.64 3.32 -0.37 0.00 0.00 0.00 0.00 44.72 48.32 1n2l s GLY 154 CO -0.08 1.79 1.44 -1.55 0.00 0.00 0.00 173.10 174.71 1n2l n PRO 155 N 1.46 1.36 -0.14 2.90 -0.04 0.60 -3.96 135.00 137.17 1n2l n PRO 155 Ca -0.09 0.49 0.08 0.00 -0.04 0.00 0.00 63.50 63.94 1n2l n PRO 155 Cb 0.57 -2.17 0.11 0.00 -0.04 0.00 0.00 33.50 31.97 1n2l n PRO 155 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n2l h GLN 157 N 0.00 0.28 0.00 0.00 7.50 -1.85 -2.69 115.11 118.35 1n2l h GLN 157 Ca 0.00 -0.02 -0.09 0.00 0.50 0.00 0.00 58.65 59.05 1n2l h GLN 157 Cb 1.05 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 28.51 1n2l h GLN 157 CO 0.00 0.18 -0.70 -0.91 -1.50 0.00 0.00 178.83 175.90 1n2l h ASN 158 N 0.29 0.00 -3.99 1.46 2.35 -1.94 -3.43 115.58 110.32 1n2l h ASN 158 Ca 0.15 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.35 1n2l h ASN 158 Cb 0.10 0.00 0.12 0.00 0.05 0.00 0.00 38.32 38.60 1n2l h ASN 158 CO -0.14 0.37 0.71 -0.76 -1.65 0.00 0.00 177.43 175.96 1n2l s LEU 159 N -6.10 4.11 -0.24 1.61 1.43 -1.01 -4.95 118.68 113.53 1n2l s LEU 159 Ca 0.02 2.95 -0.08 0.00 -1.03 0.00 0.00 54.13 55.99 1n2l s LEU 159 Cb 0.08 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 1n2l s LEU 159 CO 0.75 -1.20 0.09 0.28 0.23 0.00 0.00 176.35 176.51 1n2l s THR 160 N -1.19 4.65 -0.09 5.49 -1.32 -1.26 -2.50 115.64 119.42 1n2l s THR 160 Ca 0.61 -0.06 0.01 0.00 -1.21 0.00 0.00 61.69 61.03 1n2l s THR 160 Cb -0.44 -3.17 -0.25 0.00 -1.51 0.00 0.00 72.50 67.13 1n2l s THR 160 CO 0.57 0.35 0.49 0.00 -2.21 0.00 0.00 174.62 173.83 1n2l s PHE 162 N -2.58 0.96 0.76 0.00 0.08 -0.91 -1.28 117.98 115.02 1n2l s PHE 162 Ca -0.15 -0.31 -0.11 0.00 0.12 0.00 0.00 56.93 56.48 1n2l s PHE 162 Cb 0.07 -0.79 0.05 0.00 -0.57 0.00 0.00 43.02 41.78 1n2l s PHE 162 CO 0.79 -0.23 1.09 -1.25 -0.10 0.00 0.00 175.22 175.53 1n2l s PRO 163 N 0.90 2.30 0.11 0.24 0.04 -1.26 -0.09 135.00 137.24 1n2l s PRO 163 Ca -0.11 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 61.98 1n2l s PRO 163 Cb -0.15 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 1n2l s PRO 163 CO 0.01 -1.61 1.42 -1.00 0.04 0.00 0.00 177.00 175.85 1n2l h PRO 164 N -1.03 0.78 -0.17 0.56 0.13 -2.00 -3.42 132.00 126.85 1n2l h PRO 164 Ca -0.44 -0.44 -0.19 0.00 -0.87 0.00 0.00 66.00 64.06 1n2l h PRO 164 Cb 1.23 0.03 -0.29 0.00 0.13 0.00 0.00 31.00 32.10 1n2l h PRO 164 CO 0.52 1.07 -0.74 0.00 -0.23 0.00 0.00 178.00 178.61 1n2l n ALA 165 N -2.52 2.80 -2.59 -0.56 0.00 -1.24 -5.08 120.51 111.32 1n2l n ALA 165 Ca -0.04 -1.88 -0.43 0.00 0.00 0.00 0.00 53.44 51.09 1n2l n ALA 165 Cb 0.53 -0.76 -0.02 0.00 0.00 0.00 0.00 19.45 19.20 1n2l n ALA 165 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n2l s THR 166 N -1.43 4.33 0.88 0.00 2.01 0.88 -4.99 115.64 117.33 1n2l s THR 166 Ca 0.19 1.47 -0.10 0.00 0.31 0.00 0.00 61.69 63.56 1n2l s THR 166 Cb 0.33 -4.45 0.12 0.00 0.01 0.00 0.00 72.50 68.51 1n2l s THR 166 CO -0.08 -0.69 1.12 -2.84 -0.69 0.00 0.00 174.62 171.43 1n2l s PRO 167 N 4.06 1.32 -0.10 4.92 0.02 -1.26 -1.49 135.00 142.47 1n2l s PRO 167 Ca 0.48 1.33 -0.24 0.00 0.02 0.00 0.00 61.00 62.59 1n2l s PRO 167 Cb -0.11 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 32.61 1n2l s PRO 167 CO 0.23 -2.35 0.75 0.00 -0.33 0.00 0.00 177.00 175.30 1n2l s ASP 169 N 0.94 4.92 0.00 0.00 -4.77 -1.26 -3.84 116.67 112.67 1n2l s ASP 169 Ca 0.38 2.06 0.00 0.00 -3.30 0.00 0.00 52.55 51.70 1n2l s ASP 169 Cb -0.18 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.10 1n2l s ASP 169 CO 0.17 -1.76 0.00 0.61 0.70 0.00 0.00 175.17 174.89 1n2l n GLY 170 N -0.35 1.92 2.06 2.12 0.00 -1.26 -4.37 105.19 105.30 1n2l n GLY 170 Ca 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1n2l n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n2l n GLY 171 N 0.00 2.29 7.00 -0.02 0.00 -1.25 -4.95 105.19 108.26 1n2l n GLY 171 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1n2l n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l s ASP 173 N -4.00 6.80 0.55 0.00 1.01 -0.60 -4.78 116.67 115.65 1n2l s ASP 173 Ca 0.00 2.12 -0.00 0.00 0.71 0.00 0.00 52.55 55.37 1n2l s ASP 173 Cb 0.00 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.41 1n2l s ASP 173 CO 0.00 -0.79 0.79 -1.10 0.21 0.00 0.00 175.17 174.28 1n2l s GLN 174 N 2.99 2.62 -1.34 8.23 -1.52 -1.26 -0.29 119.66 129.09 1n2l s GLN 174 Ca 0.66 -0.61 0.00 0.00 -1.95 0.00 0.00 55.36 53.46 1n2l s GLN 174 Cb -0.31 -2.45 0.00 0.00 -0.22 0.00 0.00 33.01 30.03 1n2l s GLN 174 CO 0.26 -0.69 0.00 0.41 -0.25 0.00 0.00 175.29 175.02 1n2l n GLY 175 N -2.38 1.03 3.32 3.09 0.00 -1.26 -4.91 105.19 104.08 1n2l n GLY 175 Ca 0.06 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.51 1n2l n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n2l s LEU 176 N -3.20 2.52 0.13 0.99 1.43 -1.26 -4.96 118.68 114.34 1n2l s LEU 176 Ca 0.00 -0.98 -0.31 0.00 -1.03 0.00 0.00 54.13 51.82 1n2l s LEU 176 Cb 0.00 -0.63 -0.08 0.00 0.03 0.00 0.00 46.19 45.51 1n2l s LEU 176 CO 0.00 -0.18 1.34 0.54 0.23 0.00 0.00 176.35 178.28 1n2l s VAL 177 N -2.82 3.37 0.34 -1.59 0.11 -1.26 -4.42 120.40 114.14 1n2l s VAL 177 Ca 0.19 1.03 -0.26 0.00 -2.93 0.00 0.00 61.98 60.01 1n2l s VAL 177 Cb -0.01 -3.66 -0.13 0.00 -1.53 0.00 0.00 36.38 31.05 1n2l s VAL 177 CO 0.05 0.10 0.83 -2.65 -3.33 0.00 0.00 175.10 170.11 1n2l n PRO 178 N 3.52 0.99 -1.68 1.54 -0.02 -1.26 -4.70 135.00 133.39 1n2l n PRO 178 Ca 0.09 0.35 -0.45 0.00 -2.02 0.00 0.00 63.50 61.47 1n2l n PRO 178 Cb 0.43 -1.70 -0.04 0.00 -0.02 0.00 0.00 33.50 32.17 1n2l n PRO 178 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1n2l n ILE 179 N -0.26 0.55 -3.34 4.25 -5.35 -1.26 -4.79 119.36 109.17 1n2l n ILE 179 Ca 0.11 -0.10 -0.30 0.00 -0.27 0.00 0.00 62.75 62.19 1n2l n ILE 179 Cb 0.35 -2.01 -0.04 0.00 -1.74 0.00 0.00 39.64 36.20 1n2l n ILE 179 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1n2l s PRO 180 N 3.71 3.70 -0.48 6.28 0.04 -1.26 -3.83 135.00 143.16 1n2l s PRO 180 Ca 0.89 0.13 -0.11 0.00 0.04 0.00 0.00 61.00 61.95 1n2l s PRO 180 Cb -0.59 -2.63 0.11 0.00 0.04 0.00 0.00 34.50 31.43 1n2l s PRO 180 CO 0.46 0.24 0.37 -1.17 0.04 0.00 0.00 177.00 176.93 1n2l s LEU 181 N -3.30 5.71 -0.23 -3.56 2.96 0.61 -4.34 118.68 116.53 1n2l s LEU 181 Ca 0.45 -1.80 -0.23 0.00 -0.22 0.00 0.00 54.13 52.33 1n2l s LEU 181 Cb -0.11 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 1n2l s LEU 181 CO 0.27 -0.70 0.76 -0.76 -1.32 0.00 0.00 176.35 174.60 1n2l s LEU 182 N 1.43 4.09 -0.50 -0.68 1.43 -0.83 0.08 118.68 123.71 1n2l s LEU 182 Ca 0.05 0.95 -0.16 0.00 -1.03 0.00 0.00 54.13 53.93 1n2l s LEU 182 Cb -0.26 -3.08 0.08 0.00 0.03 0.00 0.00 46.19 42.96 1n2l s LEU 182 CO 0.01 -0.44 0.47 0.00 0.23 0.00 0.00 176.35 176.62 1n2l s ALA 183 N 2.58 3.53 0.00 4.21 0.00 -0.01 -2.13 121.76 129.94 1n2l s ALA 183 Ca 0.32 -2.12 0.00 0.00 0.00 0.00 0.00 51.96 50.17 1n2l s ALA 183 Cb -0.16 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1n2l s ALA 183 CO 0.08 -1.86 0.00 0.09 0.00 0.00 0.00 175.76 174.08 1n2l n ASN 184 N 5.45 0.00 -0.18 0.00 3.02 -0.97 -1.74 115.26 120.85 1n2l n ASN 184 Ca -0.11 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.46 1n2l n ASN 184 Cb 0.43 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.62 1n2l n ASN 184 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1n2l n LEU 185 N 0.00 1.30 -4.44 3.41 4.77 -1.26 -4.84 117.00 115.94 1n2l n LEU 185 Ca 0.00 -0.95 -0.32 0.00 -0.03 0.00 0.00 56.01 54.71 1n2l n LEU 185 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1n2l n LEU 185 CO 0.00 0.28 -0.48 -0.44 -1.33 0.00 0.00 177.39 175.41 1n2l s SER 186 N -0.51 3.79 0.12 -1.43 0.01 -0.71 -5.07 113.70 109.90 1n2l s SER 186 Ca 0.05 -0.30 -0.31 0.00 1.31 0.00 0.00 55.95 56.71 1n2l s SER 186 Cb 0.04 -0.70 -0.09 0.00 0.21 0.00 0.00 66.02 65.48 1n2l s SER 186 CO 0.07 0.32 1.50 -0.69 0.41 0.00 0.00 173.24 174.85 1n2l s VAL 187 N -0.75 3.01 -0.11 3.43 1.01 -1.26 -0.83 120.40 124.90 1n2l s VAL 187 Ca 0.12 0.68 0.20 0.00 0.00 0.00 0.00 61.98 62.98 1n2l s VAL 187 Cb -0.10 -3.44 -0.30 0.00 0.00 0.00 0.00 36.38 32.54 1n2l s VAL 187 CO 0.01 0.04 0.28 1.21 0.00 0.00 0.00 175.10 176.64 1n2l n GLU 188 N 4.26 0.67 -3.49 2.72 2.13 0.11 -4.86 120.64 122.19 1n2l n GLU 188 Ca 0.13 -0.11 -0.11 0.00 0.66 0.00 0.00 57.16 57.73 1n2l n GLU 188 Cb 0.41 -1.52 -0.03 0.00 0.27 0.00 0.00 31.44 30.56 1n2l n GLU 188 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1n2l s ALA 189 N -3.01 -1.76 -0.30 4.31 0.00 -1.21 -4.99 121.76 114.80 1n2l s ALA 189 Ca -0.09 0.97 -0.09 0.00 0.00 0.00 0.00 51.96 52.75 1n2l s ALA 189 Cb 0.10 0.36 0.19 0.00 0.00 0.00 0.00 23.12 23.76 1n2l s ALA 189 CO 0.87 -0.62 0.98 -1.14 0.00 0.00 0.00 175.76 175.86 1n2l s GLN 190 N -2.76 0.21 0.23 0.00 0.74 0.12 -0.28 119.66 117.91 1n2l s GLN 190 Ca 0.00 0.25 -0.16 0.00 0.05 0.00 0.00 55.36 55.50 1n2l s GLN 190 Cb -0.01 0.12 -0.08 0.00 1.10 0.00 0.00 33.01 34.14 1n2l s GLN 190 CO -0.06 -0.36 0.67 -2.14 -0.55 0.00 0.00 175.29 172.85 1n2l s PRO 191 N 2.94 4.09 0.49 1.67 0.02 -1.26 -0.63 135.00 142.33 1n2l s PRO 191 Ca 0.19 0.68 -0.21 0.00 0.02 0.00 0.00 61.00 61.69 1n2l s PRO 191 Cb -0.05 -2.77 -0.07 0.00 0.02 0.00 0.00 34.50 31.63 1n2l s PRO 191 CO -0.21 0.35 1.09 -1.25 -0.33 0.00 0.00 177.00 176.65 1n2l s PRO 192 N -2.27 3.68 -0.39 5.54 0.04 -1.25 -4.55 135.00 135.81 1n2l s PRO 192 Ca 0.45 1.52 -0.28 0.00 0.04 0.00 0.00 61.00 62.73 1n2l s PRO 192 Cb -0.14 -2.16 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 1n2l s PRO 192 CO 0.20 -0.56 1.71 -0.46 0.04 0.00 0.00 177.00 177.93 1n2l s TRP 193 N -1.81 1.93 0.19 0.56 -0.00 -1.26 -4.89 118.94 113.66 1n2l s TRP 193 Ca 0.68 0.65 -0.12 0.00 -0.00 0.00 0.00 56.10 57.31 1n2l s TRP 193 Cb -0.21 -4.17 0.13 0.00 -0.00 0.00 0.00 33.47 29.21 1n2l s TRP 193 CO 0.25 -2.63 1.85 -0.07 -0.00 0.00 0.00 176.95 176.35 1n2l h LEU 194 N 13.67 0.68 0.00 5.86 3.38 -1.93 -0.20 115.31 136.78 1n2l h LEU 194 Ca -0.31 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1n2l h LEU 194 Cb 1.15 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1n2l h LEU 194 CO 1.07 0.48 0.00 -2.65 0.09 0.00 0.00 178.44 177.44 1n2l n PRO 195 N -4.68 0.24 -0.02 1.13 -0.02 -1.26 -1.91 135.00 128.48 1n2l n PRO 195 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1n2l n PRO 195 Cb 0.05 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1n2l n PRO 195 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n2l n GLY 196 N -0.47 -2.51 0.27 -1.23 0.00 -0.79 -4.03 105.19 96.44 1n2l n GLY 196 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 1n2l n GLY 196 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1n2l h LEU 197 N 0.00 0.98 -0.61 0.99 5.85 -0.35 -3.15 115.31 119.01 1n2l h LEU 197 Ca 0.00 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 58.32 1n2l h LEU 197 Cb 1.01 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1n2l h LEU 197 CO 0.00 1.23 0.37 -0.08 -0.34 0.00 0.00 178.44 179.62 1n2l h GLU 198 N 0.76 0.69 -0.67 1.25 4.57 -1.87 -2.71 114.58 116.60 1n2l h GLU 198 Ca 0.07 -0.04 0.12 0.00 -1.18 0.00 0.00 59.36 58.32 1n2l h GLU 198 Cb 0.95 -0.16 -0.08 0.00 -0.16 0.00 0.00 28.75 29.30 1n2l h GLU 198 CO 0.09 0.46 0.24 0.00 -1.18 0.00 0.00 179.01 178.62 1n2l h ALA 199 N 1.28 0.89 -0.36 2.92 0.00 -1.90 -1.71 119.26 120.39 1n2l h ALA 199 Ca 0.25 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 1n2l h ALA 199 Cb 0.05 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1n2l h ALA 199 CO -0.12 -0.22 0.10 0.00 0.00 0.00 0.00 179.25 179.01 1n2l h ARG 200 N 0.40 0.52 -0.22 0.00 3.08 -1.51 -2.12 114.38 114.52 1n2l h ARG 200 Ca 0.35 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 60.23 1n2l h ARG 200 Cb 0.50 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1n2l h ARG 200 CO -0.37 0.47 -0.25 1.88 -1.07 0.00 0.00 179.97 180.63 1n2l h TYR 201 N 0.51 0.68 -0.58 3.04 0.05 -1.23 -1.49 116.97 117.96 1n2l h TYR 201 Ca 0.12 -0.21 -0.06 0.00 0.05 0.00 0.00 58.73 58.62 1n2l h TYR 201 Cb 0.18 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.76 1n2l h TYR 201 CO 0.01 0.92 0.10 0.52 -1.05 0.00 0.00 178.16 178.66 1n2l h MET 202 N 0.25 0.92 0.31 4.88 2.86 -1.31 -0.28 114.93 122.55 1n2l h MET 202 Ca 0.03 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1n2l h MET 202 Cb 0.82 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1n2l h MET 202 CO 0.06 0.85 -0.15 0.00 1.06 0.00 0.00 176.91 178.73 1n2l h ALA 203 N 1.24 -0.41 -0.82 6.32 0.00 -1.34 -0.57 119.26 123.67 1n2l h ALA 203 Ca 0.18 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.11 1n2l h ALA 203 Cb 0.37 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1n2l h ALA 203 CO 0.01 -0.66 0.54 0.35 0.00 0.00 0.00 179.25 179.48 1n2l h PHE 204 N -0.55 0.63 0.24 0.00 3.57 -1.01 -1.64 116.94 118.17 1n2l h PHE 204 Ca -0.04 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1n2l h PHE 204 Cb 0.41 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1n2l h PHE 204 CO -0.02 0.23 -0.11 0.00 -2.23 0.00 0.00 178.31 176.18 1n2l h ALA 205 N 1.62 -0.32 -0.68 2.41 0.00 -0.65 -2.20 119.26 119.44 1n2l h ALA 205 Ca 0.41 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.25 1n2l h ALA 205 Cb 0.82 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.65 1n2l h ALA 205 CO -0.16 -0.45 0.23 1.25 0.00 0.00 0.00 179.25 180.12 1n2l h HIS 206 N -0.77 0.39 -0.46 0.00 -0.00 -0.46 -0.54 115.15 113.30 1n2l h HIS 206 Ca -0.03 0.04 -0.03 0.00 -0.00 0.00 0.00 60.37 60.34 1n2l h HIS 206 Cb 0.51 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.83 1n2l h HIS 206 CO 0.05 0.03 0.17 -0.44 -0.00 0.00 0.00 177.93 177.74 1n2l h ASP 207 N 0.37 0.65 -0.60 3.26 3.32 -1.37 0.07 116.42 122.12 1n2l h ASP 207 Ca 0.37 -0.18 0.04 0.00 0.02 0.00 0.00 57.03 57.28 1n2l h ASP 207 Cb 0.54 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 1n2l h ASP 207 CO -0.39 0.66 0.34 0.25 -1.72 0.00 0.00 179.24 178.37 1n2l h LEU 208 N 0.61 0.51 -0.21 1.55 5.85 -0.52 0.65 115.31 123.75 1n2l h LEU 208 Ca 0.15 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.79 1n2l h LEU 208 Cb 0.23 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1n2l h LEU 208 CO -0.01 0.35 -0.26 0.24 -0.34 0.00 0.00 178.44 178.42 1n2l h MET 209 N 0.64 0.54 -0.10 1.25 2.86 -0.97 -2.22 114.93 116.93 1n2l h MET 209 Ca 0.26 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1n2l h MET 209 Cb 0.12 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1n2l h MET 209 CO -0.15 0.90 0.06 0.00 1.06 0.00 0.00 176.91 178.78 1n2l h ALA 210 N 0.64 0.13 -0.56 6.32 0.00 -0.65 -0.65 119.26 124.49 1n2l h ALA 210 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n2l h ALA 210 Cb 0.82 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1n2l h ALA 210 CO 0.06 -0.40 0.36 -0.44 0.00 0.00 0.00 179.25 178.84 1n2l h ASP 211 N 0.12 0.65 -0.59 0.00 5.19 -0.92 -1.29 116.42 119.58 1n2l h ASP 211 Ca 0.04 -0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1n2l h ASP 211 Cb -0.00 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 39.32 1n2l h ASP 211 CO -0.02 0.48 0.33 0.00 -3.12 0.00 0.00 179.24 176.91 1n2l h ALA 212 N 1.19 1.42 -0.21 3.45 0.00 -1.14 -1.90 119.26 122.08 1n2l h ALA 212 Ca 0.20 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1n2l h ALA 212 Cb -0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1n2l h ALA 212 CO -0.04 0.47 -0.03 0.37 0.00 0.00 0.00 179.25 180.02 1n2l h GLN 213 N 0.85 0.39 -0.03 0.00 4.15 -0.35 0.85 115.11 120.98 1n2l h GLN 213 Ca 0.22 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.50 1n2l h GLN 213 Cb 0.04 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.70 1n2l h GLN 213 CO -0.03 0.62 0.00 2.89 -1.93 0.00 0.00 178.83 180.37 1n2l n ARG 214 N -4.64 1.08 0.00 1.69 1.85 -0.56 -2.22 116.66 113.86 1n2l n ARG 214 Ca -0.04 -0.12 0.02 0.00 -1.00 0.00 0.00 57.85 56.71 1n2l n ARG 214 Cb 0.26 -1.15 0.01 0.00 -1.05 0.00 0.00 32.46 30.54 1n2l n ARG 214 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1n2l n GLN 215 N -0.52 0.66 -3.64 2.89 6.02 -0.74 -4.99 117.38 117.07 1n2l n GLN 215 Ca 0.07 -0.66 -0.21 0.00 -0.01 0.00 0.00 57.00 56.19 1n2l n GLN 215 Cb 0.06 -1.03 0.05 0.00 1.02 0.00 0.00 30.24 30.34 1n2l n GLN 215 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1n2l n ASP 216 N 0.04 -1.57 -3.94 1.08 2.03 -0.94 -5.00 116.55 108.26 1n2l n ASP 216 Ca 0.03 -0.76 -0.17 0.00 0.52 0.00 0.00 54.79 54.40 1n2l n ASP 216 Cb 0.11 -4.33 -0.15 0.00 -0.72 0.00 0.00 41.12 36.03 1n2l n ASP 216 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1n2l s ARG 217 N -5.85 0.50 0.13 -0.67 3.52 0.25 -5.05 118.95 111.77 1n2l s ARG 217 Ca 0.03 -0.15 -0.30 0.00 -0.13 0.00 0.00 55.73 55.18 1n2l s ARG 217 Cb -0.02 -0.50 -0.06 0.00 -1.56 0.00 0.00 34.95 32.81 1n2l s ARG 217 CO 0.79 0.06 1.08 -1.25 -0.81 0.00 0.00 175.30 175.17 1n2l s PRO 218 N 0.16 4.58 0.21 5.12 0.04 -1.26 -4.13 135.00 139.72 1n2l s PRO 218 Ca -0.01 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1n2l s PRO 218 Cb -0.05 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 1n2l s PRO 218 CO -0.00 0.03 0.39 -0.59 0.04 0.00 0.00 177.00 176.87 1n2l s PHE 219 N 0.15 3.48 -0.35 0.56 -0.12 -1.26 -0.55 117.98 119.89 1n2l s PHE 219 Ca 0.51 0.29 0.01 0.00 -0.05 0.00 0.00 56.93 57.68 1n2l s PHE 219 Cb -0.27 -1.81 0.11 0.00 -0.63 0.00 0.00 43.02 40.41 1n2l s PHE 219 CO 0.32 0.38 0.13 0.12 -0.05 0.00 0.00 175.22 176.11 1n2l s PHE 220 N -1.91 2.04 -0.44 3.49 5.36 -0.50 -2.69 117.98 123.33 1n2l s PHE 220 Ca 0.38 -2.07 -0.18 0.00 -0.96 0.00 0.00 56.93 54.09 1n2l s PHE 220 Cb -0.11 -1.91 0.03 0.00 -0.34 0.00 0.00 43.02 40.69 1n2l s PHE 220 CO 0.30 -0.86 0.50 -1.17 -1.46 0.00 0.00 175.22 172.52 1n2l s LEU 221 N 1.21 4.87 -0.70 6.12 2.96 -0.71 -0.52 118.68 131.91 1n2l s LEU 221 Ca 0.12 -0.70 -0.16 0.00 -0.22 0.00 0.00 54.13 53.18 1n2l s LEU 221 Cb -0.19 -2.44 0.17 0.00 0.50 0.00 0.00 46.19 44.23 1n2l s LEU 221 CO -0.17 -0.67 0.68 -0.47 -1.32 0.00 0.00 176.35 174.40 1n2l s TYR 222 N 2.30 3.46 -0.90 5.38 5.04 0.51 -0.63 117.35 132.50 1n2l s TYR 222 Ca 0.14 -1.59 -0.17 0.00 -2.44 0.00 0.00 57.07 53.01 1n2l s TYR 222 Cb -0.17 -3.86 0.16 0.00 0.35 0.00 0.00 41.96 38.44 1n2l s TYR 222 CO 0.14 -1.06 1.01 -0.47 -1.34 0.00 0.00 175.55 173.83 1n2l s TYR 223 N 1.10 3.35 -0.87 4.97 5.04 -0.39 -1.60 117.35 128.94 1n2l s TYR 223 Ca 0.12 -1.61 -0.18 0.00 -2.44 0.00 0.00 57.07 52.96 1n2l s TYR 223 Cb -0.19 -4.13 0.14 0.00 0.35 0.00 0.00 41.96 38.14 1n2l s TYR 223 CO -0.03 -1.32 1.02 0.00 -1.34 0.00 0.00 175.55 173.88 1n2l s ALA 224 N 1.81 3.49 0.51 3.97 0.00 -0.78 -0.59 121.76 130.18 1n2l s ALA 224 Ca 0.28 -2.78 -0.20 0.00 0.00 0.00 0.00 51.96 49.26 1n2l s ALA 224 Cb -0.06 -3.90 -0.07 0.00 0.00 0.00 0.00 23.12 19.09 1n2l s ALA 224 CO -0.09 -2.79 1.07 0.45 0.00 0.00 0.00 175.76 174.40 1n2l s SER 225 N 3.35 6.10 0.00 0.00 0.15 -1.09 -1.22 113.70 120.99 1n2l s SER 225 Ca 0.28 1.99 0.28 0.00 0.70 0.00 0.00 55.95 59.20 1n2l s SER 225 Cb -0.08 -2.56 1.10 0.00 -1.71 0.00 0.00 66.02 62.77 1n2l s SER 225 CO -0.07 -0.95 1.79 1.41 1.20 0.00 0.00 173.24 176.62 1n2l n HIS 226 N -1.17 0.00 -1.76 3.44 8.25 -1.26 -3.68 115.22 119.04 1n2l n HIS 226 Ca 0.10 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.14 1n2l n HIS 226 Cb 0.52 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 31.37 1n2l n HIS 226 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1n2l s HIS 227 N -2.62 1.98 0.00 4.41 3.76 -1.26 -2.17 115.29 119.39 1n2l s HIS 227 Ca 0.24 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 1n2l s HIS 227 Cb 0.19 -4.14 0.00 0.00 1.11 0.00 0.00 32.58 29.74 1n2l s HIS 227 CO 0.52 -4.80 0.00 0.25 -0.85 0.00 0.00 174.74 169.86 1n2l n THR 228 N 4.97 0.00 -4.08 1.30 -2.24 -1.25 -2.20 114.28 110.78 1n2l n THR 228 Ca 0.18 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.67 1n2l n THR 228 Cb 0.39 -0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 68.09 1n2l n THR 228 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1n2l s HIS 229 N -2.00 3.13 0.33 4.78 5.04 -0.92 -4.53 115.29 121.11 1n2l s HIS 229 Ca 0.00 0.02 -0.26 0.00 -1.54 0.00 0.00 55.06 53.28 1n2l s HIS 229 Cb 0.00 -1.55 -0.10 0.00 0.04 0.00 0.00 32.58 30.97 1n2l s HIS 229 CO 0.00 0.51 0.95 -0.47 -2.34 0.00 0.00 174.74 173.39 1n2l s TYR 230 N -1.53 3.66 0.36 3.88 5.04 -1.26 -3.92 117.35 123.59 1n2l s TYR 230 Ca 0.29 1.77 -0.24 0.00 -2.44 0.00 0.00 57.07 56.46 1n2l s TYR 230 Cb -0.11 -2.92 -0.10 0.00 0.35 0.00 0.00 41.96 39.18 1n2l s TYR 230 CO 0.22 0.18 0.94 -1.25 -1.34 0.00 0.00 175.55 174.29 1n2l s PRO 231 N -2.15 4.43 0.02 4.97 0.04 -1.26 -4.04 135.00 137.00 1n2l s PRO 231 Ca 0.51 1.22 -0.30 0.00 0.04 0.00 0.00 61.00 62.47 1n2l s PRO 231 Cb -0.18 -2.55 -0.06 0.00 0.04 0.00 0.00 34.50 31.75 1n2l s PRO 231 CO 0.23 0.16 1.39 -0.65 0.04 0.00 0.00 177.00 178.17 1n2l s GLN 232 N -2.51 4.29 0.12 4.56 -1.52 -1.25 -4.99 119.66 118.36 1n2l s GLN 232 Ca 0.55 1.97 0.03 0.00 -1.95 0.00 0.00 55.36 55.95 1n2l s GLN 232 Cb -0.15 -3.52 -0.04 0.00 -0.22 0.00 0.00 33.01 29.08 1n2l s GLN 232 CO 0.19 -0.55 -0.07 -0.59 -0.25 0.00 0.00 175.29 174.03 1n2l s PHE 233 N 2.19 1.06 0.05 0.91 -0.12 -1.26 -4.77 117.98 116.04 1n2l s PHE 233 Ca 0.64 -0.88 -0.27 0.00 -0.05 0.00 0.00 56.93 56.36 1n2l s PHE 233 Cb -0.32 -0.58 0.09 0.00 -0.63 0.00 0.00 43.02 41.58 1n2l s PHE 233 CO 0.27 -0.08 0.91 0.45 -0.05 0.00 0.00 175.22 176.72 1n2l s SER 234 N -3.10 -0.30 0.78 1.98 0.15 -0.40 -4.28 113.70 108.51 1n2l s SER 234 Ca 0.15 -0.13 -0.08 0.00 0.70 0.00 0.00 55.95 56.59 1n2l s SER 234 Cb 0.04 0.42 0.11 0.00 -1.71 0.00 0.00 66.02 64.88 1n2l s SER 234 CO -0.02 -0.72 1.10 -0.83 1.20 0.00 0.00 173.24 173.97 1n2l s GLY 235 N -2.64 1.71 0.63 9.45 0.00 -1.26 -4.21 107.32 111.00 1n2l s GLY 235 Ca 0.07 -1.09 0.39 0.00 0.00 0.00 0.00 44.72 44.09 1n2l s GLY 235 CO -0.05 -0.57 2.30 -1.61 0.00 0.00 0.00 173.10 173.17 1n2l h GLN 236 N -0.87 0.00 0.00 2.90 4.15 -1.91 -1.41 115.11 117.97 1n2l h GLN 236 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 1n2l h GLN 236 Cb 1.29 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.98 1n2l h GLN 236 CO 0.53 0.01 0.00 0.43 -1.93 0.00 0.00 178.83 177.86 1n2l n SER 237 N -3.33 0.04 0.00 -0.69 7.64 -1.26 -3.72 113.62 112.31 1n2l n SER 237 Ca -0.03 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.36 1n2l n SER 237 Cb 0.10 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 1n2l n SER 237 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1n2l n PHE 238 N -1.54 0.00 -1.59 1.43 3.72 -0.59 -4.92 117.46 113.96 1n2l n PHE 238 Ca 0.05 0.00 -0.50 0.00 -0.05 0.00 0.00 57.45 56.94 1n2l n PHE 238 Cb 0.24 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.72 1n2l n PHE 238 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1n2l n ALA 239 N -0.75 0.86 -3.66 4.37 0.00 -0.85 -1.37 120.51 119.10 1n2l n ALA 239 Ca 0.00 0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.34 1n2l n ALA 239 Cb 0.00 -2.51 0.05 0.00 0.00 0.00 0.00 19.45 16.99 1n2l n ALA 239 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1n2l n GLU 240 N 7.21 -5.94 0.00 0.00 1.02 -1.26 -4.89 120.64 116.77 1n2l n GLU 240 Ca 0.31 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 58.15 1n2l n GLU 240 Cb 0.26 -5.52 0.00 0.00 -0.02 0.00 0.00 31.44 26.16 1n2l n GLU 240 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1n2l n ARG 241 N -4.44 0.91 -0.01 3.49 5.12 -0.47 -4.82 116.66 116.44 1n2l n ARG 241 Ca -0.18 -0.21 0.03 0.00 -1.93 0.00 0.00 57.85 55.56 1n2l n ARG 241 Cb 0.63 -0.65 -0.12 0.00 -1.16 0.00 0.00 32.46 31.15 1n2l n ARG 241 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1n2l n SER 242 N -0.19 0.33 0.00 0.55 3.41 -1.26 -4.99 113.62 111.47 1n2l n SER 242 Ca 0.00 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1n2l n SER 242 Cb 0.07 1.07 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 1n2l n SER 242 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n2l n GLY 243 N 1.41 2.93 1.36 5.00 0.00 -1.26 -4.44 105.19 110.19 1n2l n GLY 243 Ca -0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1n2l n GLY 243 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1n2l n ARG 244 N -2.00 2.26 0.00 1.61 0.63 -1.26 -5.00 116.66 112.89 1n2l n ARG 244 Ca 0.00 -3.09 0.00 0.00 -0.92 0.00 0.00 57.85 53.84 1n2l n ARG 244 Cb 0.00 -1.92 0.00 0.00 0.45 0.00 0.00 32.46 30.99 1n2l n ARG 244 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n2l n GLY 245 N -0.94 0.24 0.24 5.14 0.00 -1.26 -2.61 105.19 106.00 1n2l n GLY 245 Ca 0.36 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 45.42 1n2l n GLY 245 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n2l h PRO 246 N 0.00 0.01 -0.66 1.61 0.11 -1.98 0.21 132.00 131.30 1n2l h PRO 246 Ca 0.00 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 1n2l h PRO 246 Cb 0.00 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1n2l h PRO 246 CO 0.00 0.01 0.13 0.35 -0.21 0.00 0.00 178.00 178.28 1n2l h PHE 247 N 0.01 1.13 -0.47 0.65 3.04 -1.83 -1.74 116.94 117.73 1n2l h PHE 247 Ca 0.30 -0.14 -0.03 0.00 3.98 0.00 0.00 57.97 62.07 1n2l h PHE 247 Cb 0.46 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.64 1n2l h PHE 247 CO -0.48 0.94 0.16 0.78 -2.02 0.00 0.00 178.31 177.69 1n2l h GLY 248 N 1.06 0.78 0.99 2.40 0.00 -0.85 -1.21 103.07 106.24 1n2l h GLY 248 Ca 0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 1n2l h GLY 248 CO 0.01 0.42 0.32 -0.55 0.00 0.00 0.00 176.54 176.74 1n2l h ASP 249 N 0.63 0.70 -0.32 0.19 3.32 -0.47 0.87 116.42 121.34 1n2l h ASP 249 Ca 0.15 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1n2l h ASP 249 Cb 0.24 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1n2l h ASP 249 CO -0.01 0.58 0.03 -1.28 -1.72 0.00 0.00 179.24 176.85 1n2l h SER 250 N 0.77 0.60 0.24 6.45 0.87 -1.15 -2.27 113.55 119.07 1n2l h SER 250 Ca 0.20 -0.12 -0.22 0.00 -1.23 0.00 0.00 61.79 60.43 1n2l h SER 250 Cb 0.03 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1n2l h SER 250 CO -0.03 0.66 -0.87 0.25 -0.53 0.00 0.00 176.83 176.31 1n2l h LEU 251 N 0.62 0.58 -1.50 2.23 5.85 -0.75 -2.74 115.31 119.61 1n2l h LEU 251 Ca 0.13 -0.43 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 1n2l h LEU 251 Cb 0.34 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1n2l h LEU 251 CO 0.01 1.21 -0.07 -0.03 -0.34 0.00 0.00 178.44 179.22 1n2l h MET 252 N 0.29 0.24 -0.14 1.25 4.05 -0.49 0.90 114.93 121.02 1n2l h MET 252 Ca -0.06 -0.04 -0.13 0.00 -0.28 0.00 0.00 59.70 59.18 1n2l h MET 252 Cb 1.48 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 32.25 1n2l h MET 252 CO 0.15 0.33 -0.42 1.49 0.23 0.00 0.00 176.91 178.69 1n2l h GLU 253 N 0.23 0.53 -0.92 0.39 4.81 -1.36 -0.86 114.58 117.41 1n2l h GLU 253 Ca 0.05 -0.38 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1n2l h GLU 253 Cb 0.28 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1n2l h GLU 253 CO 0.01 1.00 0.58 1.25 -0.73 0.00 0.00 179.01 181.13 1n2l h LEU 254 N 0.15 1.08 -0.50 1.64 6.46 -1.09 0.24 115.31 123.28 1n2l h LEU 254 Ca -0.01 -0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 57.64 1n2l h LEU 254 Cb 1.04 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 1n2l h LEU 254 CO 0.09 0.80 0.08 -0.78 -0.62 0.00 0.00 178.44 178.01 1n2l h ASP 255 N 1.25 0.80 -0.62 1.25 3.58 -0.73 -2.18 116.42 119.77 1n2l h ASP 255 Ca 0.33 -0.26 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 1n2l h ASP 255 Cb -0.10 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.71 1n2l h ASP 255 CO -0.07 0.86 0.13 0.00 -2.88 0.00 0.00 179.24 177.28 1n2l h ALA 256 N 0.97 0.82 -0.89 -0.78 0.00 -0.31 -1.70 119.26 117.37 1n2l h ALA 256 Ca 0.15 -0.25 0.10 0.00 0.00 0.00 0.00 54.91 54.91 1n2l h ALA 256 Cb 0.40 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1n2l h ALA 256 CO 0.01 0.55 0.57 0.00 0.00 0.00 0.00 179.25 180.39 1n2l h ALA 257 N 1.04 1.63 -0.18 0.00 0.00 -0.25 0.35 119.26 121.86 1n2l h ALA 257 Ca 0.19 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.94 1n2l h ALA 257 Cb 0.39 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1n2l h ALA 257 CO 0.01 0.19 -0.55 0.28 0.00 0.00 0.00 179.25 179.18 1n2l h VAL 258 N 0.89 1.33 -0.10 0.00 2.07 -0.99 -2.47 116.25 116.98 1n2l h VAL 258 Ca 0.41 -1.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.11 1n2l h VAL 258 Cb 0.40 1.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1n2l h VAL 258 CO -0.17 0.56 -0.01 1.23 0.02 0.00 0.00 177.57 179.20 1n2l h GLY 259 N 1.09 0.19 1.78 2.17 0.00 0.18 -1.42 103.07 107.06 1n2l h GLY 259 Ca 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1n2l h GLY 259 CO 0.10 0.13 0.06 -0.91 0.00 0.00 0.00 176.54 175.92 1n2l h THR 260 N -0.12 1.10 -0.27 4.70 1.35 -0.46 0.82 112.91 120.03 1n2l h THR 260 Ca 0.03 -0.35 -0.12 0.00 -0.55 0.00 0.00 66.41 65.42 1n2l h THR 260 Cb 0.37 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1n2l h THR 260 CO 0.01 0.12 -0.30 -0.07 -0.25 0.00 0.00 175.52 175.03 1n2l h LEU 261 N 0.29 0.73 -1.12 3.87 3.38 -1.29 -0.30 115.31 120.86 1n2l h LEU 261 Ca 0.07 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 1n2l h LEU 261 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1n2l h LEU 261 CO -0.00 1.06 -0.05 0.24 0.09 0.00 0.00 178.44 179.78 1n2l h MET 262 N 0.41 0.56 -0.03 1.13 2.86 -0.32 -0.83 114.93 118.71 1n2l h MET 262 Ca 0.04 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1n2l h MET 262 Cb 0.87 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.46 1n2l h MET 262 CO 0.07 0.62 -0.02 1.15 1.06 0.00 0.00 176.91 179.79 1n2l h THR 263 N 0.53 1.34 -0.97 2.22 2.02 -0.74 -0.07 112.91 117.24 1n2l h THR 263 Ca 0.11 -1.05 0.07 0.00 0.77 0.00 0.00 66.41 66.31 1n2l h THR 263 Cb 0.41 1.98 -0.07 0.00 -1.74 0.00 0.00 68.15 68.73 1n2l h THR 263 CO 0.02 0.28 0.62 0.00 0.37 0.00 0.00 175.52 176.81 1n2l h ALA 264 N 0.59 1.36 -0.09 6.16 0.00 -0.79 0.20 119.26 126.68 1n2l h ALA 264 Ca 0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1n2l h ALA 264 Cb 0.46 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1n2l h ALA 264 CO 0.01 0.37 -0.55 0.82 0.00 0.00 0.00 179.25 179.90 1n2l h ILE 265 N 1.10 1.36 -0.31 0.00 2.04 -1.08 -2.84 117.51 117.78 1n2l h ILE 265 Ca 0.43 -1.84 -0.10 0.00 1.00 0.00 0.00 64.86 64.34 1n2l h ILE 265 Cb 0.22 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 1n2l h ILE 265 CO -0.19 0.55 -0.21 1.23 0.00 0.00 0.00 178.15 179.53 1n2l h GLY 266 N 1.38 0.76 2.00 5.37 0.00 0.95 -1.56 103.07 111.96 1n2l h GLY 266 Ca 0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 47.33 46.58 1n2l h GLY 266 CO 0.09 0.65 -0.16 -0.55 0.00 0.00 0.00 176.54 176.57 1n2l h ASP 267 N 0.45 0.00 -0.13 0.19 3.32 -0.64 -1.12 116.42 118.49 1n2l h ASP 267 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1n2l h ASP 267 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1n2l h ASP 267 CO 0.06 0.16 0.00 0.18 -1.72 0.00 0.00 179.24 177.92 1n2l n LEU 268 N -3.90 1.58 -2.10 1.55 4.77 -1.08 -4.92 117.00 112.90 1n2l n LEU 268 Ca -0.02 -0.63 -0.19 0.00 -0.03 0.00 0.00 56.01 55.14 1n2l n LEU 268 Cb 0.25 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.25 1n2l n LEU 268 CO 0.33 0.32 -0.24 0.61 -1.33 0.00 0.00 177.39 177.08 1n2l n GLY 269 N 1.13 -0.20 1.53 -0.72 0.00 -0.43 -4.90 105.19 101.61 1n2l n GLY 269 Ca 0.17 -0.09 0.02 0.00 0.00 0.00 0.00 46.02 46.12 1n2l n GLY 269 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n2l n LEU 270 N -2.67 5.10 0.34 0.99 4.77 -0.60 -4.72 117.00 120.20 1n2l n LEU 270 Ca -0.22 -3.15 -0.18 0.00 -0.03 0.00 0.00 56.01 52.43 1n2l n LEU 270 Cb 0.67 -0.66 -0.09 0.00 -2.33 0.00 0.00 43.42 41.01 1n2l n LEU 270 CO 0.26 0.77 0.61 -0.07 -1.33 0.00 0.00 177.39 177.63 1n2l h LEU 271 N 2.51 -1.00 0.00 2.23 3.38 -1.88 -0.87 115.31 119.68 1n2l h LEU 271 Ca 0.12 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1n2l h LEU 271 Cb 1.90 0.30 0.00 0.00 0.09 0.00 0.00 40.66 42.95 1n2l h LEU 271 CO 0.48 -0.60 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 1n2l n GLU 272 N -5.52 0.88 -0.13 1.13 1.02 -1.26 -2.88 120.64 113.87 1n2l n GLU 272 Ca -0.13 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.06 1n2l n GLU 272 Cb 0.41 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.44 1n2l n GLU 272 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1n2l n GLU 273 N -1.00 2.57 -4.08 3.49 1.02 -0.87 -4.81 120.64 116.97 1n2l n GLU 273 Ca 0.21 -2.10 -0.25 0.00 -0.02 0.00 0.00 57.16 55.00 1n2l n GLU 273 Cb 0.10 -1.32 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 1n2l n GLU 273 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1n2l s THR 274 N -1.72 0.92 -0.31 2.62 2.01 -0.39 -0.55 115.64 118.22 1n2l s THR 274 Ca 0.20 -0.26 -0.16 0.00 0.31 0.00 0.00 61.69 61.77 1n2l s THR 274 Cb 0.15 -0.93 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 1n2l s THR 274 CO 0.06 0.34 0.43 -0.22 -0.69 0.00 0.00 174.62 174.54 1n2l s LEU 275 N 1.41 4.22 -0.15 4.42 2.96 0.87 -4.39 118.68 128.02 1n2l s LEU 275 Ca -0.01 0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.97 1n2l s LEU 275 Cb -0.13 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.04 1n2l s LEU 275 CO -0.04 -0.32 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.93 1n2l s VAL 276 N 2.19 3.80 -0.04 1.68 1.01 0.16 -0.59 120.40 128.61 1n2l s VAL 276 Ca 0.16 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.78 1n2l s VAL 276 Cb -0.16 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1n2l s VAL 276 CO 0.11 0.50 -0.13 -0.63 0.00 0.00 0.00 175.10 174.95 1n2l s ILE 277 N 0.32 1.13 0.01 2.22 1.01 -0.45 -0.47 121.20 124.96 1n2l s ILE 277 Ca -0.05 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.12 1n2l s ILE 277 Cb -0.14 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 1n2l s ILE 277 CO 0.03 0.34 -0.18 0.12 0.00 0.00 0.00 174.94 175.25 1n2l s PHE 278 N 0.14 1.57 0.20 3.97 2.19 -1.03 -0.79 117.98 124.23 1n2l s PHE 278 Ca -0.04 -0.32 -0.22 0.00 0.33 0.00 0.00 56.93 56.68 1n2l s PHE 278 Cb -0.10 -0.98 0.07 0.00 -1.31 0.00 0.00 43.02 40.70 1n2l s PHE 278 CO 0.01 0.01 1.01 0.99 1.83 0.00 0.00 175.22 179.08 1n2l s THR 279 N -0.56 0.00 0.20 0.12 2.01 -1.13 -2.33 115.64 113.94 1n2l s THR 279 Ca 0.06 -0.62 0.08 0.00 0.31 0.00 0.00 61.69 61.52 1n2l s THR 279 Cb -0.07 -2.82 -0.05 0.00 0.01 0.00 0.00 72.50 69.57 1n2l s THR 279 CO 0.00 0.00 -0.15 0.00 -0.69 0.00 0.00 174.62 173.78 1n2l s ALA 280 N -2.26 2.00 0.10 7.40 0.00 -1.26 -0.49 121.76 127.24 1n2l s ALA 280 Ca 0.21 -1.62 0.05 0.00 0.00 0.00 0.00 51.96 50.59 1n2l s ALA 280 Cb -0.03 -0.10 -0.23 0.00 0.00 0.00 0.00 23.12 22.76 1n2l s ALA 280 CO 0.06 0.10 1.19 0.38 0.00 0.00 0.00 175.76 177.49 1n2l h ASP 281 N 2.71 0.10 -5.14 0.00 2.03 -1.73 -3.46 116.42 110.94 1n2l h ASP 281 Ca -0.39 -0.12 0.10 0.00 -0.73 0.00 0.00 57.03 55.90 1n2l h ASP 281 Cb 1.22 -0.03 -0.05 0.00 -0.83 0.00 0.00 39.33 39.63 1n2l h ASP 281 CO 0.60 1.09 0.34 0.54 -1.03 0.00 0.00 179.24 180.78 1n2l s ASN 282 N -6.77 -0.18 1.12 4.15 4.22 -1.26 -4.65 114.94 111.57 1n2l s ASN 282 Ca -0.01 -0.62 -0.13 0.00 -2.14 0.00 0.00 52.86 49.96 1n2l s ASN 282 Cb 0.09 0.65 0.23 0.00 1.28 0.00 0.00 41.25 43.50 1n2l s ASN 282 CO 0.83 -1.22 0.85 0.61 -2.04 0.00 0.00 177.10 176.13 1n2l n GLY 283 N -0.49 -1.86 3.74 0.45 0.00 -0.44 -3.21 105.19 103.38 1n2l n GLY 283 Ca -0.05 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 1n2l n GLY 283 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n2l s PRO 284 N -4.25 4.36 -0.64 1.61 0.04 -1.26 -3.56 135.00 131.30 1n2l s PRO 284 Ca 0.66 2.12 -0.28 0.00 0.04 0.00 0.00 61.00 63.54 1n2l s PRO 284 Cb -0.23 -3.18 0.03 0.00 0.04 0.00 0.00 34.50 31.16 1n2l s PRO 284 CO 0.64 -0.30 1.23 -2.00 0.04 0.00 0.00 177.00 176.62 1n2l s GLU 285 N -0.10 3.39 0.14 4.56 2.12 -1.26 -1.87 118.70 125.68 1n2l s GLU 285 Ca 0.58 0.08 0.27 0.00 0.36 0.00 0.00 54.97 56.26 1n2l s GLU 285 Cb -0.38 -4.08 0.88 0.00 0.26 0.00 0.00 34.13 30.81 1n2l s GLU 285 CO 0.39 -1.87 1.77 0.25 -0.54 0.00 0.00 175.26 175.26 1n2l n THR 286 N 6.58 0.40 0.30 -1.70 -2.24 0.31 -3.26 114.28 114.67 1n2l n THR 286 Ca 0.07 -0.20 0.17 0.00 -2.27 0.00 0.00 64.05 61.82 1n2l n THR 286 Cb 0.49 -0.50 0.82 0.00 -2.10 0.00 0.00 70.33 69.04 1n2l n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n2l h MET 287 N 0.00 0.00 0.00 -0.78 -0.00 -1.13 -0.32 114.93 112.70 1n2l h MET 287 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1n2l h MET 287 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.27 1n2l h MET 287 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.91 177.45 1n2l n ARG 288 N -2.83 0.02 0.00 -0.10 5.12 -1.20 -4.95 116.66 112.72 1n2l n ARG 288 Ca -0.01 0.08 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 1n2l n ARG 288 Cb 0.18 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.98 1n2l n ARG 288 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1n2l n MET 289 N -1.49 0.00 0.29 5.56 2.81 -0.13 -2.48 117.12 121.68 1n2l n MET 289 Ca 0.06 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 56.02 1n2l n MET 289 Cb 0.28 0.00 0.34 0.00 -0.71 0.00 0.00 33.22 33.13 1n2l n MET 289 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1n2l h SER 290 N 5.30 0.00 -0.42 7.83 0.02 -1.94 1.05 113.55 125.39 1n2l h SER 290 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1n2l h SER 290 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1n2l h SER 290 CO 0.00 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.23 1n2l n ARG 291 N -2.47 3.61 -4.23 3.45 1.74 -1.03 -4.65 116.66 113.07 1n2l n ARG 291 Ca -0.01 -2.86 -0.27 0.00 -0.77 0.00 0.00 57.85 53.95 1n2l n ARG 291 Cb 0.65 -1.91 -0.06 0.00 -1.02 0.00 0.00 32.46 30.12 1n2l n ARG 291 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1n2l s GLY 292 N -1.35 2.48 0.00 -0.13 0.00 0.36 -4.69 107.32 104.00 1n2l s GLY 292 Ca 0.45 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.50 1n2l s GLY 292 CO 0.14 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.87 1n2l n GLY 293 N -1.32 -2.07 2.92 0.20 0.00 -1.26 -4.93 105.19 98.73 1n2l n GLY 293 Ca -0.05 -1.50 -0.15 0.00 0.00 0.00 0.00 46.02 44.32 1n2l n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l h SER 295 N 8.32 0.00 0.00 0.00 4.64 -1.88 0.82 113.55 125.45 1n2l h SER 295 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1n2l h SER 295 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1n2l h SER 295 CO 0.15 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 1n2l n GLY 296 N 0.76 0.97 0.22 -0.77 0.00 -1.26 -2.99 105.19 102.11 1n2l n GLY 296 Ca 0.04 -0.58 0.11 0.00 0.00 0.00 0.00 46.02 45.59 1n2l n GLY 296 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1n2l h LEU 297 N 0.00 0.00-10.28 0.99 -0.00 -1.97 -3.45 115.31 100.60 1n2l h LEU 297 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.88 57.37 1n2l h LEU 297 Cb 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 40.66 40.84 1n2l h LEU 297 CO 0.00 0.19 0.23 -0.76 -0.00 0.00 0.00 178.44 178.10 1n2l s LEU 298 N -6.56 2.70 -0.07 0.17 1.43 -1.16 -4.48 118.68 110.72 1n2l s LEU 298 Ca 0.02 2.00 -0.12 0.00 -1.03 0.00 0.00 54.13 55.01 1n2l s LEU 298 Cb 0.09 -4.43 -0.05 0.00 0.03 0.00 0.00 46.19 41.83 1n2l s LEU 298 CO 0.64 -2.89 0.28 -0.60 0.23 0.00 0.00 176.35 174.01 1n2l s ARG 299 N -4.72 3.79 3.38 1.70 3.52 -1.26 -4.69 118.95 120.68 1n2l s ARG 299 Ca 0.65 0.14 0.00 0.00 -0.13 0.00 0.00 55.73 56.40 1n2l s ARG 299 Cb -0.21 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 1n2l s ARG 299 CO 0.58 0.64 0.00 0.00 -0.81 0.00 0.00 175.30 175.71 1n2l n GLY 301 N 0.00 3.55 3.58 0.00 0.00 -1.26 -4.34 105.19 106.72 1n2l n GLY 301 Ca 0.00 -0.28 -0.48 0.00 0.00 0.00 0.00 46.02 45.26 1n2l n GLY 301 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1n2l n LYS 302 N 0.00 1.19 0.00 1.61 4.81 -0.78 -2.36 118.16 122.62 1n2l n LYS 302 Ca 0.00 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 1n2l n LYS 302 Cb 0.00 -1.87 0.00 0.00 0.02 0.00 0.00 35.03 33.18 1n2l n LYS 302 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n2l n GLY 303 N 1.80 2.02 3.72 3.14 0.00 -0.63 -3.64 105.19 111.61 1n2l n GLY 303 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1n2l n GLY 303 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n2l s THR 304 N -2.34 3.86 -2.04 2.61 -4.23 -1.00 -4.50 115.64 108.01 1n2l s THR 304 Ca 0.00 -1.68 0.14 0.00 -1.18 0.00 0.00 61.69 58.97 1n2l s THR 304 Cb 0.00 -3.07 0.37 0.00 1.34 0.00 0.00 72.50 71.14 1n2l s THR 304 CO 0.00 -0.35 1.33 0.35 -0.54 0.00 0.00 174.62 175.41 1n2l n THR 305 N -0.95 0.50 -1.67 3.99 -2.24 -1.26 -4.35 114.28 108.31 1n2l n THR 305 Ca -0.07 -0.52 -0.31 0.00 -2.27 0.00 0.00 64.05 60.88 1n2l n THR 305 Cb 0.58 0.30 0.04 0.00 -2.10 0.00 0.00 70.33 69.15 1n2l n THR 305 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1n2l s TYR 306 N -1.50 3.24 0.30 4.78 2.02 -1.26 -4.81 117.35 120.13 1n2l s TYR 306 Ca 0.28 1.33 0.07 0.00 -0.37 0.00 0.00 57.07 58.38 1n2l s TYR 306 Cb 0.15 -2.87 0.80 0.00 -0.40 0.00 0.00 41.96 39.64 1n2l s TYR 306 CO 0.20 -1.13 1.71 0.93 -1.57 0.00 0.00 175.55 175.69 1n2l h GLU 307 N -0.64 0.48 0.00 -0.62 4.39 -1.90 -0.01 114.58 116.28 1n2l h GLU 307 Ca -0.44 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1n2l h GLU 307 Cb 1.21 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1n2l h GLU 307 CO 0.59 0.31 0.00 0.78 -1.16 0.00 0.00 179.01 179.53 1n2l h GLY 308 N 0.49 0.00 0.00 -3.84 0.00 -1.05 -0.18 103.07 98.49 1n2l h GLY 308 Ca 0.60 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.81 1n2l h GLY 308 CO -0.50 0.00 -1.87 0.61 0.00 0.00 0.00 176.54 174.78 1n2l n GLY 309 N -0.88 -0.74 0.04 4.60 0.00 -0.05 -4.11 105.19 104.05 1n2l n GLY 309 Ca -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 46.02 45.68 1n2l n GLY 309 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1n2l n VAL 310 N -2.28 0.49 -2.99 1.61 0.24 -1.02 -1.33 118.33 113.05 1n2l n VAL 310 Ca -0.13 -0.43 -0.43 0.00 -2.04 0.00 0.00 64.34 61.32 1n2l n VAL 310 Cb 0.68 -0.32 -0.06 0.00 -1.47 0.00 0.00 33.84 32.67 1n2l n VAL 310 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1n2l s ARG 311 N -2.54 3.34 0.18 7.34 3.52 -0.10 -1.50 118.95 129.20 1n2l s ARG 311 Ca -0.05 -0.26 0.06 0.00 -0.13 0.00 0.00 55.73 55.35 1n2l s ARG 311 Cb 0.05 -3.97 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 1n2l s ARG 311 CO 0.51 -1.16 0.14 -1.21 -0.81 0.00 0.00 175.30 172.77 1n2l s GLU 312 N 3.24 2.88 0.89 5.12 0.41 -0.53 -4.38 118.70 126.32 1n2l s GLU 312 Ca 0.27 -0.93 -0.11 0.00 -0.41 0.00 0.00 54.97 53.79 1n2l s GLU 312 Cb -0.13 -2.61 0.12 0.00 -1.78 0.00 0.00 34.13 29.73 1n2l s GLU 312 CO 0.20 0.46 1.09 -1.25 -0.49 0.00 0.00 175.26 175.28 1n2l s PRO 313 N -3.26 1.33 -0.18 0.39 0.04 -1.26 -4.25 135.00 127.81 1n2l s PRO 313 Ca 0.31 0.85 -0.27 0.00 0.04 0.00 0.00 61.00 61.93 1n2l s PRO 313 Cb -0.09 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.70 1n2l s PRO 313 CO 0.23 -2.20 0.70 0.00 0.04 0.00 0.00 177.00 175.78 1n2l s ALA 314 N -2.93 -1.76 -0.18 8.56 0.00 -1.26 -4.17 121.76 120.03 1n2l s ALA 314 Ca 0.63 1.74 -0.04 0.00 0.00 0.00 0.00 51.96 54.29 1n2l s ALA 314 Cb -0.18 -0.72 0.08 0.00 0.00 0.00 0.00 23.12 22.31 1n2l s ALA 314 CO 0.57 -0.35 0.22 -0.51 0.00 0.00 0.00 175.76 175.69 1n2l s LEU 315 N -0.23 -0.14 -0.02 0.00 1.43 -0.99 -2.56 118.68 116.18 1n2l s LEU 315 Ca -0.04 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 52.87 1n2l s LEU 315 Cb -0.03 0.43 -0.05 0.00 0.03 0.00 0.00 46.19 46.56 1n2l s LEU 315 CO 0.04 -0.30 0.44 0.00 0.23 0.00 0.00 176.35 176.76 1n2l s ALA 316 N 2.34 3.64 -0.05 4.21 0.00 -0.09 -2.45 121.76 129.35 1n2l s ALA 316 Ca 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 51.96 51.81 1n2l s ALA 316 Cb -0.15 -2.47 0.04 0.00 0.00 0.00 0.00 23.12 20.54 1n2l s ALA 316 CO -0.11 0.37 0.11 0.12 0.00 0.00 0.00 175.76 176.24 1n2l s PHE 317 N -0.70 -0.09 -0.33 0.00 5.36 0.38 -1.41 117.98 121.19 1n2l s PHE 317 Ca 0.24 0.38 -0.08 0.00 -0.96 0.00 0.00 56.93 56.51 1n2l s PHE 317 Cb -0.17 -0.20 0.21 0.00 -0.34 0.00 0.00 43.02 42.52 1n2l s PHE 317 CO 0.13 -0.16 1.10 -0.46 -1.46 0.00 0.00 175.22 174.37 1n2l s TRP 318 N 1.42 -0.27 0.12 10.12 -0.00 -1.26 0.40 118.94 129.48 1n2l s TRP 318 Ca -0.06 -0.06 -0.34 0.00 -0.00 0.00 0.00 56.10 55.64 1n2l s TRP 318 Cb -0.12 0.05 -0.17 0.00 -0.00 0.00 0.00 33.47 33.23 1n2l s TRP 318 CO -0.05 -0.20 0.98 -2.30 -0.00 0.00 0.00 176.95 175.38 1n2l n PRO 319 N 2.85 0.52 -0.08 5.86 -0.02 -1.26 -0.44 135.00 142.42 1n2l n PRO 319 Ca 0.10 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1n2l n PRO 319 Cb 0.65 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 1n2l n PRO 319 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n2l n GLY 320 N 1.85 2.37 0.00 -1.23 0.00 -1.26 -4.64 105.19 102.29 1n2l n GLY 320 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1n2l n GLY 320 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1n2l n HIS 321 N -2.00 0.00 -3.51 1.61 8.25 -0.60 -5.00 115.22 113.96 1n2l n HIS 321 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 1n2l n HIS 321 Cb 0.00 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 1n2l n HIS 321 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1n2l s ILE 322 N -1.66 5.19 -0.00 1.59 -1.09 0.42 -4.22 121.20 121.43 1n2l s ILE 322 Ca 0.00 -0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 57.68 1n2l s ILE 322 Cb 0.00 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 37.07 1n2l s ILE 322 CO 0.00 -0.14 1.11 0.00 -1.23 0.00 0.00 174.94 174.68 1n2l s ALA 323 N 1.69 3.34 -0.07 9.38 0.00 -1.26 -4.68 121.76 130.17 1n2l s ALA 323 Ca 0.05 0.65 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 1n2l s ALA 323 Cb -0.18 -3.43 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 1n2l s ALA 323 CO 0.10 -0.46 2.07 -2.30 0.00 0.00 0.00 175.76 175.16 1n2l n PRO 324 N 4.32 2.47 -0.97 0.00 -0.02 -1.26 -4.00 135.00 135.54 1n2l n PRO 324 Ca 0.08 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 1n2l n PRO 324 Cb 0.48 -3.06 0.00 0.00 -0.02 0.00 0.00 33.50 30.90 1n2l n PRO 324 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n2l n GLY 325 N 5.02 1.10 2.72 -1.23 0.00 -1.26 -4.94 105.19 106.60 1n2l n GLY 325 Ca 0.24 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 1n2l n GLY 325 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n2l s VAL 326 N -2.30 0.36 -0.07 1.61 1.01 -1.26 -2.24 120.40 117.51 1n2l s VAL 326 Ca 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 1n2l s VAL 326 Cb 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1n2l s VAL 326 CO 0.00 -0.11 0.09 0.28 0.00 0.00 0.00 175.10 175.36 1n2l s THR 327 N 1.94 5.00 -1.96 3.92 -1.32 -1.09 -4.96 115.64 117.18 1n2l s THR 327 Ca 0.01 -0.10 0.19 0.00 -1.21 0.00 0.00 61.69 60.57 1n2l s THR 327 Cb -0.16 -3.20 0.36 0.00 -1.51 0.00 0.00 72.50 67.99 1n2l s THR 327 CO -0.07 0.52 1.29 1.41 -2.21 0.00 0.00 174.62 175.55 1n2l n HIS 328 N 1.71 0.44 -1.78 9.09 8.25 -1.26 -2.26 115.22 129.40 1n2l n HIS 328 Ca -0.17 -0.28 -0.39 0.00 -0.26 0.00 0.00 57.72 56.62 1n2l n HIS 328 Cb 0.54 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.67 1n2l n HIS 328 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1n2l s GLU 329 N -1.27 3.53 0.16 -0.41 8.01 -1.26 -4.63 118.70 122.83 1n2l s GLU 329 Ca 0.32 2.38 -0.31 0.00 0.01 0.00 0.00 54.97 57.38 1n2l s GLU 329 Cb 0.19 -2.55 -0.09 0.00 -4.31 0.00 0.00 34.13 27.37 1n2l s GLU 329 CO 0.26 -0.93 1.39 -0.51 0.01 0.00 0.00 175.26 175.47 1n2l s LEU 330 N -2.95 4.39 -0.10 1.80 1.02 -1.26 -4.55 118.68 117.02 1n2l s LEU 330 Ca 0.64 2.42 -0.24 0.00 0.02 0.00 0.00 54.13 56.97 1n2l s LEU 330 Cb -0.43 -3.60 0.06 0.00 0.02 0.00 0.00 46.19 42.24 1n2l s LEU 330 CO 0.54 -0.64 0.57 0.00 0.02 0.00 0.00 176.35 176.84 1n2l s ALA 331 N 0.66 -1.44 0.16 4.21 0.00 -1.10 -4.39 121.76 119.85 1n2l s ALA 331 Ca 0.62 1.23 0.02 0.00 0.00 0.00 0.00 51.96 53.83 1n2l s ALA 331 Cb -0.38 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1n2l s ALA 331 CO 0.34 -0.31 -0.02 0.45 0.00 0.00 0.00 175.76 176.22 1n2l s SER 332 N -0.67 1.33 0.50 0.00 0.15 -1.26 -0.46 113.70 113.28 1n2l s SER 332 Ca -0.08 -1.13 0.33 0.00 0.70 0.00 0.00 55.95 55.78 1n2l s SER 332 Cb -0.03 0.09 1.56 0.00 -1.71 0.00 0.00 66.02 65.93 1n2l s SER 332 CO 0.05 -0.51 2.00 0.77 1.20 0.00 0.00 173.24 176.75 1n2l h SER 333 N 2.74 0.00 0.79 5.45 4.64 -1.59 -1.05 113.55 124.53 1n2l h SER 333 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1n2l h SER 333 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1n2l h SER 333 CO 0.63 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 176.52 1n2l h LEU 334 N 0.00 0.00 0.00 5.97 3.38 -1.83 -2.76 115.31 120.07 1n2l h LEU 334 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1n2l h LEU 334 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1n2l h LEU 334 CO 0.00 0.00 -0.79 0.47 0.09 0.00 0.00 178.44 178.21 1n2l n ASP 335 N -2.74 0.65 -0.22 -0.43 8.00 -0.40 -3.81 116.55 117.61 1n2l n ASP 335 Ca 0.01 -0.04 -0.04 0.00 0.71 0.00 0.00 54.79 55.43 1n2l n ASP 335 Cb 0.25 0.44 0.06 0.00 -0.02 0.00 0.00 41.12 41.85 1n2l n ASP 335 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1n2l h LEU 336 N 0.00 0.65 0.45 0.64 3.38 -1.59 -1.67 115.31 117.17 1n2l h LEU 336 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1n2l h LEU 336 Cb 0.73 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1n2l h LEU 336 CO 0.00 0.46 -0.41 0.25 0.09 0.00 0.00 178.44 178.83 1n2l h LEU 337 N 0.78 -1.10 -1.20 1.67 6.46 -1.78 0.13 115.31 120.27 1n2l h LEU 337 Ca 0.25 0.09 -0.00 0.00 -0.12 0.00 0.00 57.88 58.10 1n2l h LEU 337 Cb 0.01 0.36 -0.04 0.00 -0.73 0.00 0.00 40.66 40.26 1n2l h LEU 337 CO -0.10 -0.57 0.45 -0.65 -0.62 0.00 0.00 178.44 176.95 1n2l h PRO 338 N -0.87 1.00 0.02 5.25 0.11 -1.80 0.17 132.00 135.87 1n2l h PRO 338 Ca -0.04 -0.08 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 1n2l h PRO 338 Cb 0.76 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1n2l h PRO 338 CO -0.04 0.69 -0.01 1.15 -0.21 0.00 0.00 178.00 179.58 1n2l h THR 339 N 1.02 1.11 -0.12 -1.15 2.02 -1.02 -0.30 112.91 114.46 1n2l h THR 339 Ca 0.27 -0.40 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 1n2l h THR 339 Cb -0.06 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1n2l h THR 339 CO -0.05 0.10 -0.40 -0.07 0.37 0.00 0.00 175.52 175.47 1n2l h LEU 340 N -0.19 0.28 -0.68 2.58 3.38 -0.50 -2.22 115.31 117.95 1n2l h LEU 340 Ca -0.00 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1n2l h LEU 340 Cb 0.18 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1n2l h LEU 340 CO 0.00 0.65 -0.29 0.00 0.09 0.00 0.00 178.44 178.90 1n2l h ALA 341 N 1.36 0.86 -0.47 1.53 0.00 -0.53 -1.80 119.26 120.22 1n2l h ALA 341 Ca 0.02 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 1n2l h ALA 341 Cb 0.80 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1n2l h ALA 341 CO 0.06 0.63 -0.24 0.00 0.00 0.00 0.00 179.25 179.71 1n2l h ALA 342 N 1.07 0.69 -0.15 0.00 0.00 -0.78 0.02 119.26 120.11 1n2l h ALA 342 Ca 0.07 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 1n2l h ALA 342 Cb 0.80 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1n2l h ALA 342 CO 0.07 0.67 -0.41 -0.07 0.00 0.00 0.00 179.25 179.51 1n2l h LEU 343 N 0.84 0.37 -0.06 0.00 3.38 -1.29 -2.75 115.31 115.80 1n2l h LEU 343 Ca 0.10 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1n2l h LEU 343 Cb 0.82 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1n2l h LEU 343 CO 0.07 0.74 -0.17 0.00 0.09 0.00 0.00 178.44 179.17 1n2l n ALA 344 N -2.48 2.79 -1.01 1.53 0.00 -0.69 -4.45 120.51 116.20 1n2l n ALA 344 Ca -0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 53.44 53.21 1n2l n ALA 344 Cb 0.50 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.61 1n2l n ALA 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n2l n GLY 345 N 1.44 0.32 3.74 0.00 0.00 -0.46 -4.76 105.19 105.47 1n2l n GLY 345 Ca 0.09 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1n2l n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l s ALA 346 N -1.61 3.41 0.18 4.61 0.00 -0.13 -4.99 121.76 123.22 1n2l s ALA 346 Ca 0.00 0.90 -0.32 0.00 0.00 0.00 0.00 51.96 52.55 1n2l s ALA 346 Cb 0.00 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.61 1n2l s ALA 346 CO 0.00 -0.33 1.64 -2.14 0.00 0.00 0.00 175.76 174.93 1n2l s PRO 347 N -0.17 4.18 0.29 0.00 0.02 -1.26 -4.56 135.00 133.50 1n2l s PRO 347 Ca 0.52 2.46 -0.29 0.00 0.02 0.00 0.00 61.00 63.72 1n2l s PRO 347 Cb -0.31 -3.16 -0.09 0.00 0.02 0.00 0.00 34.50 30.95 1n2l s PRO 347 CO 0.36 -0.68 1.07 -1.17 -0.33 0.00 0.00 177.00 176.25 1n2l s LEU 348 N 1.30 4.50 0.81 -5.54 2.96 -1.26 -4.98 118.68 116.46 1n2l s LEU 348 Ca 0.73 2.19 -0.12 0.00 -0.22 0.00 0.00 54.13 56.71 1n2l s LEU 348 Cb -0.46 -3.72 0.09 0.00 0.50 0.00 0.00 46.19 42.60 1n2l s LEU 348 CO 0.32 -0.16 1.14 -2.16 -1.32 0.00 0.00 176.35 174.17 1n2l s PRO 349 N -1.59 1.74 0.31 0.98 0.04 -1.26 -4.96 135.00 130.26 1n2l s PRO 349 Ca 0.46 1.48 0.04 0.00 0.04 0.00 0.00 61.00 63.02 1n2l s PRO 349 Cb -0.30 -1.81 0.50 0.00 0.04 0.00 0.00 34.50 32.93 1n2l s PRO 349 CO 0.38 -2.08 1.79 -0.97 0.04 0.00 0.00 177.00 176.15 1n2l h ASN 350 N -1.17 0.46 -3.30 6.66 -0.73 -2.03 -3.45 115.58 112.01 1n2l h ASN 350 Ca -0.44 -0.13 -0.57 0.00 1.87 0.00 0.00 56.30 57.02 1n2l h ASN 350 Cb 1.26 -0.12 0.14 0.00 0.27 0.00 0.00 38.32 39.87 1n2l h ASN 350 CO 0.47 0.65 0.19 1.33 -0.37 0.00 0.00 177.43 179.69 1n2l n VAL 351 N -4.18 2.85 -2.20 2.57 0.24 -1.26 -4.88 118.33 111.46 1n2l n VAL 351 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 1n2l n VAL 351 Cb 0.34 -1.21 -0.02 0.00 -1.47 0.00 0.00 33.84 31.48 1n2l n VAL 351 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1n2l s THR 352 N -1.35 3.75 0.10 3.34 -4.23 -1.26 -4.99 115.64 111.00 1n2l s THR 352 Ca 0.67 0.79 -0.20 0.00 -1.18 0.00 0.00 61.69 61.76 1n2l s THR 352 Cb -0.50 -3.94 -0.07 0.00 1.34 0.00 0.00 72.50 69.33 1n2l s THR 352 CO 0.54 -0.55 0.62 -0.76 -0.54 0.00 0.00 174.62 173.93 1n2l s LEU 353 N 5.77 4.53 -0.16 4.79 2.01 -1.26 -4.88 118.68 129.48 1n2l s LEU 353 Ca 0.69 1.34 0.09 0.00 0.01 0.00 0.00 54.13 56.26 1n2l s LEU 353 Cb -0.19 -3.01 0.56 0.00 0.01 0.00 0.00 46.19 43.56 1n2l s LEU 353 CO 0.32 0.25 1.35 0.47 1.01 0.00 0.00 176.35 179.75 1n2l n ASP 354 N 1.62 4.23 -4.11 2.29 8.00 -0.94 -4.93 116.55 122.71 1n2l n ASP 354 Ca -0.09 -2.63 -0.26 0.00 0.71 0.00 0.00 54.79 52.52 1n2l n ASP 354 Cb 0.50 -0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 40.92 1n2l n ASP 354 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n2l n GLY 355 N 0.43 3.69 3.21 0.44 0.00 -1.25 -4.80 105.19 106.91 1n2l n GLY 355 Ca 0.19 -2.34 -0.12 0.00 0.00 0.00 0.00 46.02 43.75 1n2l n GLY 355 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n2l s PHE 356 N -2.44 1.12 -0.54 1.61 0.08 -1.26 -4.95 117.98 111.61 1n2l s PHE 356 Ca 0.00 -1.24 -0.22 0.00 0.12 0.00 0.00 56.93 55.59 1n2l s PHE 356 Cb -0.00 -0.61 0.05 0.00 -0.57 0.00 0.00 43.02 41.89 1n2l s PHE 356 CO 0.00 -0.48 0.79 0.34 -0.10 0.00 0.00 175.22 175.77 1n2l s ASP 357 N -3.15 6.28 0.00 1.36 2.15 -1.26 -3.95 116.67 118.10 1n2l s ASP 357 Ca 0.31 -0.65 0.12 0.00 0.43 0.00 0.00 52.55 52.76 1n2l s ASP 357 Cb 0.07 -2.37 0.46 0.00 -0.30 0.00 0.00 42.92 40.78 1n2l s ASP 357 CO 0.07 -1.08 1.33 0.18 -0.17 0.00 0.00 175.17 175.51 1n2l n LEU 358 N 6.86 1.17 -0.36 -1.34 4.32 -1.26 -4.36 117.00 122.03 1n2l n LEU 358 Ca -0.02 -0.55 0.07 0.00 -0.02 0.00 0.00 56.01 55.49 1n2l n LEU 358 Cb 0.46 -0.12 0.24 0.00 -1.62 0.00 0.00 43.42 42.38 1n2l n LEU 358 CO 0.59 0.28 1.23 0.77 -1.22 0.00 0.00 177.39 179.03 1n2l h SER 359 N 1.37 0.91 -0.59 -1.43 4.64 -1.90 -1.83 113.55 114.71 1n2l h SER 359 Ca 0.00 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.42 1n2l h SER 359 Cb 0.31 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 1n2l h SER 359 CO 0.00 0.48 0.31 -0.65 -0.87 0.00 0.00 176.83 176.10 1n2l h PRO 360 N 0.98 0.58 -0.33 4.77 0.11 -1.88 0.54 132.00 136.76 1n2l h PRO 360 Ca 0.50 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.57 1n2l h PRO 360 Cb 0.50 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1n2l h PRO 360 CO -0.27 0.38 0.20 1.25 -0.21 0.00 0.00 178.00 179.35 1n2l h LEU 361 N 0.59 0.39 -0.22 2.35 5.85 -1.38 0.30 115.31 123.20 1n2l h LEU 361 Ca 0.26 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 1n2l h LEU 361 Cb 0.17 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1n2l h LEU 361 CO -0.17 0.33 0.03 -0.07 -0.34 0.00 0.00 178.44 178.21 1n2l h LEU 362 N 0.42 0.36 0.00 2.25 3.38 -0.64 -2.88 115.31 118.20 1n2l h LEU 362 Ca 0.12 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1n2l h LEU 362 Cb 0.01 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1n2l h LEU 362 CO -0.02 0.54 0.00 0.18 0.09 0.00 0.00 178.44 179.23 1n2l n LEU 363 N -4.71 0.00 -1.32 1.67 4.77 0.18 -4.27 117.00 113.33 1n2l n LEU 363 Ca -0.04 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 56.13 1n2l n LEU 363 Cb 0.21 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 1n2l n LEU 363 CO 0.37 -0.02 -0.15 0.61 -1.33 0.00 0.00 177.39 176.87 1n2l n GLY 364 N 1.15 0.22 0.85 -0.72 0.00 0.86 -4.90 105.19 102.66 1n2l n GLY 364 Ca 0.13 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.87 1n2l n GLY 364 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n2l n THR 365 N -3.67 0.19 -2.69 2.61 -2.24 0.02 -5.01 114.28 103.48 1n2l n THR 365 Ca -0.14 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1n2l n THR 365 Cb 0.56 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 70.04 1n2l n THR 365 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n2l n GLY 366 N 1.14 -1.29 4.01 3.38 0.00 -1.13 -4.99 105.19 106.31 1n2l n GLY 366 Ca 0.13 -0.91 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 1n2l n GLY 366 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n2l s LYS 367 N -0.63 2.79 0.25 1.61 1.02 -1.26 -3.43 119.74 120.09 1n2l s LYS 367 Ca 0.00 -1.27 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 1n2l s LYS 367 Cb 0.00 -2.74 -0.09 0.00 -0.52 0.00 0.00 37.83 34.48 1n2l s LYS 367 CO 0.00 -0.29 0.96 0.45 -0.92 0.00 0.00 175.35 175.55 1n2l s SER 368 N -4.36 7.59 0.24 2.83 0.15 -1.26 -4.45 113.70 114.44 1n2l s SER 368 Ca 0.55 1.99 0.25 0.00 0.70 0.00 0.00 55.95 59.44 1n2l s SER 368 Cb -0.10 -2.61 0.91 0.00 -1.71 0.00 0.00 66.02 62.51 1n2l s SER 368 CO 0.33 0.11 1.75 -2.65 1.20 0.00 0.00 173.24 173.98 1n2l n PRO 369 N 1.42 0.23 -2.06 5.44 -0.02 -1.26 -4.76 135.00 133.99 1n2l n PRO 369 Ca -0.02 0.33 -0.43 0.00 -2.02 0.00 0.00 63.50 61.37 1n2l n PRO 369 Cb 0.47 -1.85 -0.03 0.00 -0.02 0.00 0.00 33.50 32.07 1n2l n PRO 369 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1n2l s ARG 370 N -3.22 3.96 0.00 -0.52 1.81 -1.26 -4.81 118.95 114.91 1n2l s ARG 370 Ca 0.07 1.91 0.00 0.00 -1.72 0.00 0.00 55.73 55.99 1n2l s ARG 370 Cb 0.11 -4.01 0.00 0.00 -0.45 0.00 0.00 34.95 30.59 1n2l s ARG 370 CO 0.49 -1.10 0.00 0.00 -0.68 0.00 0.00 175.30 174.01 1n2l n GLN 371 N 7.41 1.23 -4.03 3.54 10.64 -1.26 -4.43 117.38 130.48 1n2l n GLN 371 Ca 0.18 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 55.24 1n2l n GLN 371 Cb 0.44 -0.90 -0.11 0.00 -0.86 0.00 0.00 30.24 28.81 1n2l n GLN 371 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1n2l s SER 372 N -1.59 0.58 0.02 2.61 0.01 -1.26 -1.85 113.70 112.22 1n2l s SER 372 Ca 0.00 -0.52 0.04 0.00 1.31 0.00 0.00 55.95 56.78 1n2l s SER 372 Cb 0.00 0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.28 1n2l s SER 372 CO 0.00 -0.24 -0.11 -0.76 0.41 0.00 0.00 173.24 172.54 1n2l s LEU 373 N -1.50 2.12 -0.03 2.44 1.43 0.14 -4.97 118.68 118.32 1n2l s LEU 373 Ca -0.12 -0.35 0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1n2l s LEU 373 Cb -0.10 -0.48 -0.01 0.00 0.03 0.00 0.00 46.19 45.63 1n2l s LEU 373 CO -0.00 0.03 -0.21 -0.36 0.23 0.00 0.00 176.35 176.04 1n2l s PHE 374 N -0.66 1.92 -0.04 0.29 0.08 -1.26 -0.54 117.98 117.77 1n2l s PHE 374 Ca 0.01 -0.44 0.05 0.00 0.12 0.00 0.00 56.93 56.67 1n2l s PHE 374 Cb -0.06 -1.25 -0.01 0.00 -0.57 0.00 0.00 43.02 41.13 1n2l s PHE 374 CO 0.00 -0.09 -0.20 -0.06 -0.10 0.00 0.00 175.22 174.77 1n2l s PHE 375 N -0.31 1.93 0.10 0.36 0.08 -0.23 -4.70 117.98 115.21 1n2l s PHE 375 Ca 0.03 -0.53 0.08 0.00 0.12 0.00 0.00 56.93 56.64 1n2l s PHE 375 Cb -0.10 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.03 1n2l s PHE 375 CO 0.01 -0.16 -0.16 0.71 -0.10 0.00 0.00 175.22 175.52 1n2l s TYR 376 N -0.11 2.59 0.94 0.36 2.02 -1.07 -1.37 117.35 120.71 1n2l s TYR 376 Ca -0.02 -0.23 -0.14 0.00 -0.37 0.00 0.00 57.07 56.31 1n2l s TYR 376 Cb -0.11 -1.38 0.16 0.00 -0.40 0.00 0.00 41.96 40.22 1n2l s TYR 376 CO 0.02 0.38 1.21 -1.25 -1.57 0.00 0.00 175.55 174.34 1n2l s PRO 377 N -2.06 0.90 0.16 -1.71 0.04 -1.26 -4.53 135.00 126.54 1n2l s PRO 377 Ca 0.18 -0.05 -0.15 0.00 0.04 0.00 0.00 61.00 61.02 1n2l s PRO 377 Cb -0.11 -1.84 0.06 0.00 0.04 0.00 0.00 34.50 32.65 1n2l s PRO 377 CO 0.10 -2.30 1.79 0.77 0.04 0.00 0.00 177.00 177.41 1n2l h SER 378 N -1.56 0.34 -3.93 6.66 0.02 -1.96 -3.32 113.55 109.80 1n2l h SER 378 Ca -0.46 0.01 -0.67 0.00 -0.84 0.00 0.00 61.79 59.82 1n2l h SER 378 Cb 1.29 -0.06 -0.38 0.00 0.14 0.00 0.00 62.40 63.40 1n2l h SER 378 CO 0.51 0.25 -0.56 -0.31 -1.14 0.00 0.00 176.83 175.58 1n2l s TYR 379 N -6.15 3.48 0.76 3.45 1.51 -1.26 -1.81 117.35 117.32 1n2l s TYR 379 Ca -0.13 -2.83 -0.04 0.00 -1.01 0.00 0.00 57.07 53.06 1n2l s TYR 379 Cb 0.12 -3.05 0.13 0.00 -0.11 0.00 0.00 41.96 39.05 1n2l s TYR 379 CO 0.72 -0.87 1.05 -1.25 -1.11 0.00 0.00 175.55 174.09 1n2l s PRO 380 N 0.40 1.56 -0.03 -1.71 0.04 -1.25 -5.06 135.00 128.95 1n2l s PRO 380 Ca 0.13 -0.88 -0.29 0.00 0.04 0.00 0.00 61.00 60.00 1n2l s PRO 380 Cb -0.22 -2.23 0.08 0.00 0.04 0.00 0.00 34.50 32.17 1n2l s PRO 380 CO -0.04 -1.59 0.74 0.16 0.04 0.00 0.00 177.00 176.32 1n2l s ASP 381 N -4.73 -0.57 0.56 6.66 -4.77 -1.26 -4.98 116.67 107.58 1n2l s ASP 381 Ca 0.67 0.49 0.36 0.00 -3.30 0.00 0.00 52.55 50.76 1n2l s ASP 381 Cb -0.06 0.49 1.63 0.00 -1.09 0.00 0.00 42.92 43.90 1n2l s ASP 381 CO 0.46 -0.62 2.07 -0.33 0.70 0.00 0.00 175.17 177.44 1n2l h GLU 382 N 2.68 0.00 0.05 2.11 5.08 -2.00 -2.00 114.58 120.50 1n2l h GLU 382 Ca -0.26 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1n2l h GLU 382 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1n2l h GLU 382 CO 0.37 0.00 -0.02 0.28 -1.00 0.00 0.00 179.01 178.63 1n2l h VAL 383 N 0.00 1.22 0.06 3.13 2.07 -2.00 -3.38 116.25 117.35 1n2l h VAL 383 Ca 0.00 -1.65 -0.14 0.00 0.82 0.00 0.00 66.70 65.73 1n2l h VAL 383 Cb 0.35 2.20 0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1n2l h VAL 383 CO 0.00 0.37 -0.58 0.03 0.02 0.00 0.00 177.57 177.41 1n2l h ARG 384 N -0.89 0.29 0.00 1.57 3.08 -2.00 -3.50 114.38 112.94 1n2l h ARG 384 Ca -0.01 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.65 1n2l h ARG 384 Cb 0.66 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1n2l h ARG 384 CO 0.01 1.12 0.00 0.41 -1.07 0.00 0.00 179.97 180.44 1n2l n GLY 385 N 1.36 -0.17 3.74 0.04 0.00 -0.75 -4.84 105.19 104.56 1n2l n GLY 385 Ca -0.12 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 1n2l n GLY 385 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n2l s VAL 386 N 0.00 2.27 -0.02 1.61 -7.23 -1.26 -4.77 120.40 111.00 1n2l s VAL 386 Ca 0.00 0.22 -0.16 0.00 -1.81 0.00 0.00 61.98 60.23 1n2l s VAL 386 Cb 0.00 -3.14 -0.33 0.00 0.56 0.00 0.00 36.38 33.47 1n2l s VAL 386 CO 0.00 0.03 0.85 -0.26 -0.31 0.00 0.00 175.10 175.40 1n2l h PHE 387 N 5.54 0.77 -3.94 2.82 -1.00 -1.55 -3.45 116.94 116.14 1n2l h PHE 387 Ca -0.45 -0.57 -0.31 0.00 2.81 0.00 0.00 57.97 59.45 1n2l h PHE 387 Cb 1.21 -0.03 -0.25 0.00 3.61 0.00 0.00 35.95 40.49 1n2l h PHE 387 CO 0.61 1.54 -0.75 0.00 -1.61 0.00 0.00 178.31 178.10 1n2l s ALA 388 N -2.54 0.55 -0.03 2.45 0.00 -1.20 -1.24 121.76 119.74 1n2l s ALA 388 Ca -0.13 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.36 1n2l s ALA 388 Cb 0.04 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1n2l s ALA 388 CO 0.88 0.06 -0.07 0.08 0.00 0.00 0.00 175.76 176.71 1n2l s VAL 389 N -0.69 0.67 -0.02 0.00 1.01 -1.01 -1.07 120.40 119.30 1n2l s VAL 389 Ca -0.03 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 61.76 1n2l s VAL 389 Cb -0.06 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1n2l s VAL 389 CO 0.00 0.23 -0.26 -0.60 0.00 0.00 0.00 175.10 174.47 1n2l s ARG 390 N 0.38 2.10 -0.17 2.72 3.52 0.30 -0.96 118.95 126.86 1n2l s ARG 390 Ca -0.06 -0.93 -0.04 0.00 -0.13 0.00 0.00 55.73 54.57 1n2l s ARG 390 Cb -0.10 -2.04 0.07 0.00 -1.56 0.00 0.00 34.95 31.33 1n2l s ARG 390 CO 0.00 0.56 0.16 0.99 -0.81 0.00 0.00 175.30 176.21 1n2l s THR 391 N -0.61 -0.23 0.00 4.11 2.01 -0.15 0.29 115.64 121.05 1n2l s THR 391 Ca 0.10 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.06 1n2l s THR 391 Cb -0.10 -0.57 0.00 0.00 0.01 0.00 0.00 72.50 71.84 1n2l s THR 391 CO -0.01 -0.16 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 1n2l n GLY 392 N 5.31 2.41 0.63 4.40 0.00 -0.77 -2.05 105.19 115.12 1n2l n GLY 392 Ca -0.06 0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.05 1n2l n GLY 392 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1n2l n LYS 393 N 6.11 1.55 -4.28 1.61 2.85 -1.26 -4.96 118.16 119.78 1n2l n LYS 393 Ca 0.00 -1.61 -0.34 0.00 -1.05 0.00 0.00 58.31 55.31 1n2l n LYS 393 Cb 0.00 -1.29 -0.10 0.00 -0.65 0.00 0.00 35.03 32.99 1n2l n LYS 393 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1n2l s TYR 394 N -1.10 3.14 -0.12 5.58 2.02 -0.87 0.09 117.35 126.08 1n2l s TYR 394 Ca 0.20 -0.02 -0.00 0.00 -0.37 0.00 0.00 57.07 56.87 1n2l s TYR 394 Cb 0.13 -1.93 0.03 0.00 -0.40 0.00 0.00 41.96 39.78 1n2l s TYR 394 CO 0.18 0.19 -0.07 0.21 -1.57 0.00 0.00 175.55 174.49 1n2l s LYS 395 N -0.07 1.51 0.11 -0.62 2.20 -0.46 -0.98 119.74 121.44 1n2l s LYS 395 Ca 0.04 -0.29 -0.06 0.00 -0.36 0.00 0.00 55.97 55.29 1n2l s LYS 395 Cb -0.13 -1.65 -0.06 0.00 -1.51 0.00 0.00 37.83 34.49 1n2l s LYS 395 CO 0.02 -0.29 0.37 0.00 -0.36 0.00 0.00 175.35 175.09 1n2l s ALA 396 N 1.70 3.78 -0.47 3.13 0.00 -0.13 -1.81 121.76 127.95 1n2l s ALA 396 Ca 0.04 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.53 1n2l s ALA 396 Cb -0.13 -2.17 0.12 0.00 0.00 0.00 0.00 23.12 20.95 1n2l s ALA 396 CO -0.08 0.64 0.21 -1.01 0.00 0.00 0.00 175.76 175.52 1n2l s HIS 397 N -1.55 3.12 0.25 0.00 3.76 -0.46 -2.39 115.29 118.01 1n2l s HIS 397 Ca 0.37 -3.02 0.05 0.00 -0.15 0.00 0.00 55.06 52.31 1n2l s HIS 397 Cb -0.13 -2.71 0.28 0.00 1.11 0.00 0.00 32.58 31.13 1n2l s HIS 397 CO 0.22 -0.79 1.57 0.74 -0.85 0.00 0.00 174.74 175.63 1n2l h PHE 398 N 6.77 0.26 -3.44 1.40 0.04 -1.46 -3.02 116.94 117.50 1n2l h PHE 398 Ca -0.07 -0.10 -0.27 0.00 2.80 0.00 0.00 57.97 60.34 1n2l h PHE 398 Cb 0.92 -0.05 -0.32 0.00 2.20 0.00 0.00 35.95 38.71 1n2l h PHE 398 CO 0.50 0.75 -0.67 -0.06 -0.60 0.00 0.00 178.31 178.22 1n2l s PHE 399 N -3.75 -0.05 0.06 -0.55 0.08 -1.12 -0.46 117.98 112.18 1n2l s PHE 399 Ca -0.04 0.26 0.07 0.00 0.12 0.00 0.00 56.93 57.34 1n2l s PHE 399 Cb 0.12 -0.14 -0.04 0.00 -0.57 0.00 0.00 43.02 42.39 1n2l s PHE 399 CO 0.79 -0.11 -0.15 0.95 -0.10 0.00 0.00 175.22 176.60 1n2l s THR 400 N 0.94 3.03 -0.07 0.64 -4.23 -0.45 -4.72 115.64 110.79 1n2l s THR 400 Ca -0.08 -1.20 -0.21 0.00 -1.18 0.00 0.00 61.69 59.03 1n2l s THR 400 Cb -0.10 -2.33 0.04 0.00 1.34 0.00 0.00 72.50 71.45 1n2l s THR 400 CO -0.04 0.26 0.47 -1.58 -0.54 0.00 0.00 174.62 173.20 1n2l s GLN 401 N -1.70 0.77 0.00 3.99 0.74 -1.26 -1.06 119.66 121.14 1n2l s GLN 401 Ca 0.17 0.16 0.00 0.00 0.05 0.00 0.00 55.36 55.73 1n2l s GLN 401 Cb -0.11 0.36 0.00 0.00 1.10 0.00 0.00 33.01 34.36 1n2l s GLN 401 CO 0.08 -0.20 0.00 0.41 -0.55 0.00 0.00 175.29 175.03 1n2l n GLY 402 N 1.51 0.50 3.57 2.59 0.00 -0.51 -4.69 105.19 108.18 1n2l n GLY 402 Ca -0.19 -1.89 -0.15 0.00 0.00 0.00 0.00 46.02 43.79 1n2l n GLY 402 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n2l s SER 403 N -1.00 -0.64 0.35 1.61 0.15 0.13 -4.78 113.70 109.52 1n2l s SER 403 Ca 0.00 0.95 0.15 0.00 0.70 0.00 0.00 55.95 57.75 1n2l s SER 403 Cb 0.00 0.86 0.63 0.00 -1.71 0.00 0.00 66.02 65.81 1n2l s SER 403 CO 0.00 -0.42 1.74 0.00 1.20 0.00 0.00 173.24 175.76 1n2l h ALA 404 N 3.74 1.11 0.00 5.45 0.00 -1.89 -2.41 119.26 125.25 1n2l h ALA 404 Ca -0.27 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 1n2l h ALA 404 Cb 1.15 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1n2l h ALA 404 CO 0.24 0.55 -0.52 0.45 0.00 0.00 0.00 179.25 179.96 1n2l h HIS 405 N 0.00 0.00 -0.50 0.00 3.86 -1.91 -2.93 115.15 113.67 1n2l h HIS 405 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1n2l h HIS 405 Cb 0.87 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.34 1n2l h HIS 405 CO 0.00 0.52 0.00 0.43 0.86 0.00 0.00 177.93 179.74 1n2l n SER 406 N -3.75 3.15 -4.55 2.45 7.64 -0.93 -0.53 113.62 117.10 1n2l n SER 406 Ca -0.01 -2.15 -0.29 0.00 1.01 0.00 0.00 58.87 57.43 1n2l n SER 406 Cb 0.56 -0.41 0.17 0.00 -1.01 0.00 0.00 64.21 63.52 1n2l n SER 406 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1n2l s ASP 407 N -0.90 2.75 0.00 6.43 1.01 -1.11 -4.14 116.67 120.72 1n2l s ASP 407 Ca 0.36 0.92 0.00 0.00 0.71 0.00 0.00 52.55 54.54 1n2l s ASP 407 Cb 0.21 -1.44 0.00 0.00 1.01 0.00 0.00 42.92 42.70 1n2l s ASP 407 CO 0.21 -3.02 0.00 0.35 0.21 0.00 0.00 175.17 172.92 1n2l n THR 408 N -4.07 0.00 -2.07 -1.27 -2.24 -1.26 -2.80 114.28 100.58 1n2l n THR 408 Ca 0.08 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.57 1n2l n THR 408 Cb 0.59 -0.14 0.16 0.00 -2.10 0.00 0.00 70.33 68.83 1n2l n THR 408 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1n2l s THR 409 N -3.08 2.04 0.04 4.28 -4.23 -1.26 -5.02 115.64 108.42 1n2l s THR 409 Ca 0.00 -0.13 -0.06 0.00 -1.18 0.00 0.00 61.69 60.32 1n2l s THR 409 Cb 0.00 -2.91 -0.29 0.00 1.34 0.00 0.00 72.50 70.63 1n2l s THR 409 CO 0.00 0.00 1.03 0.00 -0.54 0.00 0.00 174.62 175.11 1n2l h ALA 410 N -1.32 0.10 -2.06 3.99 0.00 -1.95 -3.44 119.26 114.57 1n2l h ALA 410 Ca -0.43 -0.95 -0.58 0.00 0.00 0.00 0.00 54.91 52.95 1n2l h ALA 410 Cb 1.25 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.10 1n2l h ALA 410 CO 0.42 0.98 0.73 0.34 0.00 0.00 0.00 179.25 181.72 1n2l s ASP 411 N -7.18 6.92 0.29 0.00 2.15 -1.26 -4.93 116.67 112.66 1n2l s ASP 411 Ca -0.06 1.06 0.23 0.00 0.43 0.00 0.00 52.55 54.21 1n2l s ASP 411 Cb 0.06 -2.51 1.06 0.00 -0.30 0.00 0.00 42.92 41.23 1n2l s ASP 411 CO 0.88 -0.75 1.69 -0.81 -0.17 0.00 0.00 175.17 176.01 1n2l n PRO 412 N 6.55 0.17 0.07 4.34 -0.04 -1.26 -2.63 135.00 142.20 1n2l n PRO 412 Ca 0.10 0.52 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 1n2l n PRO 412 Cb 0.47 -1.91 0.43 0.00 -0.04 0.00 0.00 33.50 32.45 1n2l n PRO 412 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n2l n ALA 413 N -1.78 1.80 -0.05 0.55 0.00 -1.26 -3.11 120.51 116.65 1n2l n ALA 413 Ca 0.01 0.01 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 1n2l n ALA 413 Cb 0.14 -1.35 -0.15 0.00 0.00 0.00 0.00 19.45 18.09 1n2l n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n2l s HIS 415 N -2.62 2.04 0.55 0.00 3.76 -1.18 0.21 115.29 118.05 1n2l s HIS 415 Ca -0.07 1.50 0.40 0.00 -0.15 0.00 0.00 55.06 56.74 1n2l s HIS 415 Cb 0.07 -3.68 2.13 0.00 1.11 0.00 0.00 32.58 32.21 1n2l s HIS 415 CO 0.83 -2.94 2.28 0.00 -0.85 0.00 0.00 174.74 174.06 1n2l h ALA 416 N 0.39 1.08 -0.82 -1.40 0.00 -1.83 -1.44 119.26 115.24 1n2l h ALA 416 Ca -0.50 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.42 1n2l h ALA 416 Cb 1.33 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 1n2l h ALA 416 CO 0.52 0.01 0.54 0.77 0.00 0.00 0.00 179.25 181.10 1n2l h SER 417 N 0.00 0.91 -2.17 0.00 0.02 -1.90 -3.39 113.55 107.02 1n2l h SER 417 Ca -0.00 -0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 60.42 1n2l h SER 417 Cb 0.11 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1n2l h SER 417 CO 0.00 0.64 1.33 -0.44 -1.14 0.00 0.00 176.83 177.22 1n2l s SER 418 N -6.25 5.44 0.82 3.07 0.01 -0.54 -4.97 113.70 111.27 1n2l s SER 418 Ca -0.11 0.54 -0.12 0.00 1.31 0.00 0.00 55.95 57.56 1n2l s SER 418 Cb 0.18 -2.53 0.08 0.00 0.21 0.00 0.00 66.02 63.97 1n2l s SER 418 CO 0.79 -2.21 1.14 -0.94 0.41 0.00 0.00 173.24 172.43 1n2l s SER 419 N 7.52 4.37 -0.15 2.44 1.04 -1.26 -1.42 113.70 126.24 1n2l s SER 419 Ca 0.69 0.97 -0.29 0.00 0.48 0.00 0.00 55.95 57.80 1n2l s SER 419 Cb -0.14 -1.57 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 1n2l s SER 419 CO 0.24 -2.01 1.95 -0.22 0.98 0.00 0.00 173.24 174.18 1n2l s LEU 420 N -5.71 3.87 -0.03 2.42 0.20 -1.26 -4.55 118.68 113.64 1n2l s LEU 420 Ca 0.62 2.02 0.07 0.00 0.69 0.00 0.00 54.13 57.53 1n2l s LEU 420 Cb -0.13 -3.52 -0.02 0.00 -0.43 0.00 0.00 46.19 42.09 1n2l s LEU 420 CO 0.51 -1.48 -0.25 0.42 -0.29 0.00 0.00 176.35 175.27 1n2l s THR 421 N 6.20 1.99 0.49 3.68 -4.23 -0.23 -4.97 115.64 118.57 1n2l s THR 421 Ca 0.88 -1.07 -0.08 0.00 -1.18 0.00 0.00 61.69 60.24 1n2l s THR 421 Cb -0.33 -1.66 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 1n2l s THR 421 CO 0.35 0.56 0.84 0.00 -0.54 0.00 0.00 174.62 175.83 1n2l s ALA 422 N -0.50 3.32 -0.12 3.99 0.00 -1.26 -1.34 121.76 125.85 1n2l s ALA 422 Ca 0.07 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 51.67 1n2l s ALA 422 Cb -0.11 -2.74 0.05 0.00 0.00 0.00 0.00 23.12 20.32 1n2l s ALA 422 CO 0.00 -0.34 0.06 -1.01 0.00 0.00 0.00 175.76 174.47 1n2l s HIS 423 N -2.75 0.37 -0.21 0.00 3.76 0.39 -4.92 115.29 111.93 1n2l s HIS 423 Ca 0.50 -0.20 -0.04 0.00 -0.15 0.00 0.00 55.06 55.17 1n2l s HIS 423 Cb -0.10 -0.70 0.08 0.00 1.11 0.00 0.00 32.58 32.97 1n2l s HIS 423 CO 0.43 -0.40 0.14 -1.21 -0.85 0.00 0.00 174.74 172.86 1n2l s GLU 424 N 2.07 0.13 0.73 1.40 0.41 -1.26 -2.76 118.70 119.43 1n2l s GLU 424 Ca 0.03 -0.10 -0.11 0.00 -0.41 0.00 0.00 54.97 54.38 1n2l s GLU 424 Cb -0.14 -1.47 0.03 0.00 -1.78 0.00 0.00 34.13 30.77 1n2l s GLU 424 CO -0.06 -0.76 1.08 -1.25 -0.49 0.00 0.00 175.26 173.78 1n2l s PRO 425 N 2.19 2.59 0.74 0.39 0.04 -1.26 -5.13 135.00 134.57 1n2l s PRO 425 Ca 0.05 1.11 -0.14 0.00 0.04 0.00 0.00 61.00 62.06 1n2l s PRO 425 Cb -0.16 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.49 1n2l s PRO 425 CO -0.17 -1.38 1.16 -1.25 0.04 0.00 0.00 177.00 175.40 1n2l s PRO 426 N -4.86 2.15 -0.26 0.56 0.04 -1.11 -4.93 135.00 126.59 1n2l s PRO 426 Ca 0.60 1.56 -0.29 0.00 0.04 0.00 0.00 61.00 62.92 1n2l s PRO 426 Cb -0.16 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.51 1n2l s PRO 426 CO 0.54 -1.78 1.50 -0.51 0.04 0.00 0.00 177.00 176.79 1n2l s LEU 427 N -5.39 3.86 -0.22 -3.56 1.43 -1.14 -4.76 118.68 108.91 1n2l s LEU 427 Ca 0.70 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 55.11 1n2l s LEU 427 Cb -0.24 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.39 1n2l s LEU 427 CO 0.47 -1.22 0.22 -0.22 0.23 0.00 0.00 176.35 175.84 1n2l s LEU 428 N 4.97 4.14 -0.06 1.79 2.96 -1.26 -1.36 118.68 129.87 1n2l s LEU 428 Ca 0.66 0.25 0.05 0.00 -0.22 0.00 0.00 54.13 54.87 1n2l s LEU 428 Cb -0.21 -2.22 -0.01 0.00 0.50 0.00 0.00 46.19 44.25 1n2l s LEU 428 CO 0.27 0.05 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.82 1n2l s TYR 429 N 0.99 2.20 -0.71 5.38 2.02 -0.75 -0.31 117.35 126.17 1n2l s TYR 429 Ca 0.11 -0.67 -0.18 0.00 -0.37 0.00 0.00 57.07 55.97 1n2l s TYR 429 Cb -0.13 -1.45 0.14 0.00 -0.40 0.00 0.00 41.96 40.11 1n2l s TYR 429 CO 0.04 -0.22 0.79 0.34 -1.57 0.00 0.00 175.55 174.94 1n2l s ASP 430 N -0.05 6.41 0.57 2.29 -1.08 -1.26 -1.35 116.67 122.20 1n2l s ASP 430 Ca -0.05 -1.87 0.31 0.00 -0.52 0.00 0.00 52.55 50.42 1n2l s ASP 430 Cb -0.13 -2.29 1.76 0.00 -1.46 0.00 0.00 42.92 40.79 1n2l s ASP 430 CO 0.04 -0.96 2.19 -0.07 0.52 0.00 0.00 175.17 176.89 1n2l h LEU 431 N 9.47 0.00 -1.37 -1.34 3.38 -0.50 0.29 115.31 125.24 1n2l h LEU 431 Ca -0.11 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1n2l h LEU 431 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1n2l h LEU 431 CO 1.02 0.05 -0.24 0.77 0.09 0.00 0.00 178.44 180.12 1n2l h SER 432 N 0.00 0.11 0.00 -0.43 4.64 -1.91 -2.52 113.55 113.43 1n2l h SER 432 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1n2l h SER 432 Cb 0.16 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1n2l h SER 432 CO 0.01 0.36 -0.39 2.29 -0.87 0.00 0.00 176.83 178.22 1n2l n LYS 433 N -4.21 4.54 -3.18 4.77 2.85 -1.08 -4.81 118.16 117.04 1n2l n LYS 433 Ca -0.02 -0.01 -0.22 0.00 -1.05 0.00 0.00 58.31 57.02 1n2l n LYS 433 Cb 0.33 -0.76 -0.05 0.00 -0.65 0.00 0.00 35.03 33.89 1n2l n LYS 433 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1n2l n ASP 434 N -1.21 0.29 0.12 -5.58 2.03 1.00 -4.94 116.55 108.27 1n2l n ASP 434 Ca 0.00 -2.80 0.12 0.00 0.52 0.00 0.00 54.79 52.63 1n2l n ASP 434 Cb 0.06 -0.57 0.48 0.00 -0.72 0.00 0.00 41.12 40.37 1n2l n ASP 434 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1n2l n PRO 435 N 1.07 0.19 0.00 -0.67 -0.04 -0.96 -2.52 135.00 132.07 1n2l n PRO 435 Ca 0.22 0.41 0.14 0.00 -0.04 0.00 0.00 63.50 64.23 1n2l n PRO 435 Cb 0.57 -1.86 0.63 0.00 -0.04 0.00 0.00 33.50 32.81 1n2l n PRO 435 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n2l n GLY 436 N 0.01 -1.35 3.44 0.55 0.00 -1.26 -4.63 105.19 101.95 1n2l n GLY 436 Ca 0.02 -0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 1n2l n GLY 436 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n2l n GLU 437 N -1.38 -3.05 -0.04 1.61 1.02 -1.05 -4.33 120.64 113.43 1n2l n GLU 437 Ca 0.10 0.74 -0.02 0.00 -0.02 0.00 0.00 57.16 57.96 1n2l n GLU 437 Cb 0.30 -5.37 -0.08 0.00 -0.02 0.00 0.00 31.44 26.27 1n2l n GLU 437 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1n2l n ASN 438 N -3.07 2.60 -4.06 1.62 4.13 -1.26 -4.95 115.26 110.27 1n2l n ASN 438 Ca -0.14 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.80 1n2l n ASN 438 Cb 0.63 0.94 -0.15 0.00 -1.54 0.00 0.00 39.78 39.66 1n2l n ASN 438 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1n2l s TYR 439 N -2.37 3.50 -0.02 3.10 2.02 -1.26 -5.09 117.35 117.23 1n2l s TYR 439 Ca -0.05 -2.60 -0.30 0.00 -0.37 0.00 0.00 57.07 53.76 1n2l s TYR 439 Cb 0.04 -2.42 -0.04 0.00 -0.40 0.00 0.00 41.96 39.13 1n2l s TYR 439 CO 0.41 -0.91 1.26 1.21 -1.57 0.00 0.00 175.55 175.95 1n2l s ASN 440 N 1.05 6.99 -0.01 2.29 2.47 -1.26 -4.66 114.94 121.81 1n2l s ASN 440 Ca 0.01 1.93 -0.25 0.00 0.42 0.00 0.00 52.86 54.96 1n2l s ASN 440 Cb -0.20 -2.56 -0.19 0.00 -1.45 0.00 0.00 41.25 36.85 1n2l s ASN 440 CO -0.06 -0.61 1.29 -0.07 -3.72 0.00 0.00 177.10 173.93 1n2l h LEU 441 N 8.07 0.04 -0.16 3.21 3.38 -1.05 -2.92 115.31 125.88 1n2l h LEU 441 Ca -0.36 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1n2l h LEU 441 Cb 1.17 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1n2l h LEU 441 CO 0.88 0.50 0.00 0.18 0.09 0.00 0.00 178.44 180.09 1n2l n LEU 442 N -4.83 0.09 -4.40 1.67 4.32 -1.26 -4.32 117.00 108.27 1n2l n LEU 442 Ca -0.08 0.53 -0.28 0.00 -0.02 0.00 0.00 56.01 56.16 1n2l n LEU 442 Cb 0.25 -0.53 -0.08 0.00 -1.62 0.00 0.00 43.42 41.45 1n2l n LEU 442 CO 0.34 -0.43 1.48 0.61 -1.22 0.00 0.00 177.39 178.17 1n2l n GLY 443 N -0.69 0.84 0.00 -0.72 0.00 -1.11 -5.02 105.19 98.49 1n2l n GLY 443 Ca 0.02 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1n2l n GLY 443 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n2l n GLY 444 N 5.67 -2.27 0.00 -0.02 0.00 -1.26 -4.99 105.19 102.31 1n2l n GLY 444 Ca 0.45 0.74 0.00 0.00 0.00 0.00 0.00 46.02 47.21 1n2l n GLY 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l n ALA 448 N 0.00 0.00 -1.67 4.61 0.00 -1.26 -5.20 120.51 116.99 1n2l n ALA 448 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.98 1n2l n ALA 448 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1n2l n ALA 448 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1n2l n THR 449 N 0.00 0.10 -0.30 0.00 -1.04 -1.26 -4.71 114.28 107.07 1n2l n THR 449 Ca 0.00 -0.02 0.33 0.00 -2.04 0.00 0.00 64.05 62.32 1n2l n THR 449 Cb 0.00 -1.58 0.71 0.00 -1.82 0.00 0.00 70.33 67.65 1n2l n THR 449 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1n2l h PRO 450 N 6.44 0.05 -0.08 -2.82 0.11 -2.05 0.21 132.00 133.86 1n2l h PRO 450 Ca -0.46 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1n2l h PRO 450 Cb 1.26 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1n2l h PRO 450 CO 0.90 0.04 -0.04 1.49 -0.21 0.00 0.00 178.00 180.17 1n2l h GLU 451 N 0.06 0.16 0.01 1.05 4.81 -1.99 -0.81 114.58 117.87 1n2l h GLU 451 Ca 0.55 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.71 1n2l h GLU 451 Cb 2.08 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.46 1n2l h GLU 451 CO -0.05 0.54 -0.00 0.28 -0.73 0.00 0.00 179.01 179.04 1n2l h VAL 452 N -0.22 1.05 -0.63 0.32 2.07 -1.11 -1.37 116.25 116.36 1n2l h VAL 452 Ca 0.02 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.41 1n2l h VAL 452 Cb 0.49 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1n2l h VAL 452 CO 0.01 0.04 0.42 0.25 0.02 0.00 0.00 177.57 178.31 1n2l h LEU 453 N -0.09 0.61 -0.68 2.57 5.85 -0.75 0.14 115.31 122.96 1n2l h LEU 453 Ca -0.00 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.57 1n2l h LEU 453 Cb 0.08 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1n2l h LEU 453 CO 0.00 0.41 -0.65 -0.61 -0.34 0.00 0.00 178.44 177.26 1n2l h GLN 454 N 0.70 0.07 -0.09 1.25 4.15 -0.83 -2.92 115.11 117.44 1n2l h GLN 454 Ca 0.26 -0.05 -0.24 0.00 0.77 0.00 0.00 58.65 59.38 1n2l h GLN 454 Cb 0.15 0.01 0.01 0.00 0.21 0.00 0.00 27.48 27.86 1n2l h GLN 454 CO -0.07 0.69 -0.89 0.00 -1.93 0.00 0.00 178.83 176.63 1n2l h ALA 455 N 1.29 0.24 -0.35 3.38 0.00 0.04 -2.98 119.26 120.88 1n2l h ALA 455 Ca -0.01 -0.64 0.05 0.00 0.00 0.00 0.00 54.91 54.32 1n2l h ALA 455 Cb 1.15 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1n2l h ALA 455 CO 0.09 0.69 0.05 1.25 0.00 0.00 0.00 179.25 181.32 1n2l h LEU 456 N 0.49 -0.03 -0.98 0.00 5.85 -0.74 0.16 115.31 120.06 1n2l h LEU 456 Ca -0.08 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1n2l h LEU 456 Cb 1.53 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.62 1n2l h LEU 456 CO 0.18 0.02 0.39 0.11 -0.34 0.00 0.00 178.44 178.79 1n2l h LYS 457 N 0.16 1.11 -0.31 1.25 1.57 -1.56 -0.24 116.57 118.55 1n2l h LYS 457 Ca 0.17 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1n2l h LYS 457 Cb 0.20 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1n2l h LYS 457 CO -0.24 0.84 -0.12 0.37 -0.57 0.00 0.00 179.45 179.74 1n2l h GLN 458 N 1.10 0.63 -0.63 3.15 4.15 -1.25 -1.78 115.11 120.49 1n2l h GLN 458 Ca 0.27 -0.26 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 1n2l h GLN 458 Cb 0.09 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1n2l h GLN 458 CO -0.04 0.84 0.16 -0.07 -1.93 0.00 0.00 178.83 177.79 1n2l h LEU 459 N 0.39 0.95 -1.11 -2.39 3.38 -0.72 0.46 115.31 116.27 1n2l h LEU 459 Ca 0.07 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 1n2l h LEU 459 Cb 0.63 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1n2l h LEU 459 CO 0.04 0.93 -0.32 1.56 0.09 0.00 0.00 178.44 180.74 1n2l h GLN 460 N 0.92 0.21 0.03 1.13 4.20 -1.00 -2.21 115.11 118.39 1n2l h GLN 460 Ca 0.20 -0.08 -0.23 0.00 0.06 0.00 0.00 58.65 58.60 1n2l h GLN 460 Cb 0.35 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.14 1n2l h GLN 460 CO 0.00 0.52 -0.91 1.25 -0.67 0.00 0.00 178.83 179.02 1n2l h LEU 461 N 0.19 0.74 -0.81 1.46 5.85 -1.02 -2.84 115.31 118.89 1n2l h LEU 461 Ca 0.02 -0.78 0.05 0.00 0.84 0.00 0.00 57.88 58.01 1n2l h LEU 461 Cb 0.67 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 1n2l h LEU 461 CO 0.05 1.43 0.51 -0.07 -0.34 0.00 0.00 178.44 180.02 1n2l h LEU 462 N 0.14 0.82 0.74 2.25 3.38 -0.77 0.50 115.31 122.36 1n2l h LEU 462 Ca -0.12 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1n2l h LEU 462 Cb 1.60 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 42.19 1n2l h LEU 462 CO 0.18 0.55 -0.35 0.50 0.09 0.00 0.00 178.44 179.40 1n2l h LYS 463 N 0.96 -0.95 -0.81 1.13 3.64 -1.46 -2.30 116.57 116.78 1n2l h LYS 463 Ca 0.34 0.06 0.14 0.00 -1.27 0.00 0.00 60.65 59.92 1n2l h LYS 463 Cb 0.08 0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 32.03 1n2l h LYS 463 CO -0.14 -0.61 0.40 0.00 -2.27 0.00 0.00 179.45 176.83 1n2l h ALA 464 N -0.88 1.20 -0.41 5.00 0.00 -1.22 -0.04 119.26 122.90 1n2l h ALA 464 Ca -0.10 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1n2l h ALA 464 Cb 0.78 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1n2l h ALA 464 CO 0.17 -0.09 -0.08 1.96 0.00 0.00 0.00 179.25 181.20 1n2l h GLN 465 N 0.60 0.70 -0.00 0.00 4.20 -0.86 -2.31 115.11 117.43 1n2l h GLN 465 Ca 0.44 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 1n2l h GLN 465 Cb 0.60 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1n2l h GLN 465 CO -0.35 0.76 -0.09 1.25 -0.67 0.00 0.00 178.83 179.74 1n2l h LEU 466 N 0.64 0.08 -0.99 1.46 5.85 -0.72 -2.47 115.31 119.16 1n2l h LEU 466 Ca 0.12 -0.76 0.18 0.00 0.84 0.00 0.00 57.88 58.26 1n2l h LEU 466 Cb 0.51 -0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.41 1n2l h LEU 466 CO 0.03 0.83 0.60 0.44 -0.34 0.00 0.00 178.44 180.00 1n2l h ASP 467 N -0.65 0.77 -0.22 1.25 3.32 -1.03 0.29 116.42 120.16 1n2l h ASP 467 Ca -0.01 0.09 -0.14 0.00 0.02 0.00 0.00 57.03 57.00 1n2l h ASP 467 Cb 0.84 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1n2l h ASP 467 CO 0.02 0.28 -0.40 0.00 -1.72 0.00 0.00 179.24 177.42 1n2l h ALA 468 N 1.63 0.34 0.27 3.45 0.00 -1.46 -3.37 119.26 120.13 1n2l h ALA 468 Ca 0.57 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1n2l h ALA 468 Cb 0.86 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1n2l h ALA 468 CO -0.38 0.44 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 1n2l h ALA 469 N 0.62 -0.37 -2.49 0.00 0.00 -0.74 -3.44 119.26 112.83 1n2l h ALA 469 Ca 0.01 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.22 1n2l h ALA 469 Cb 1.00 0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.95 1n2l h ALA 469 CO 0.09 -0.39 0.90 0.08 0.00 0.00 0.00 179.25 179.92 1n2l s VAL 470 N -3.35 3.10 -0.14 0.00 1.01 0.92 -5.01 120.40 116.93 1n2l s VAL 470 Ca -0.10 0.66 -0.00 0.00 0.00 0.00 0.00 61.98 62.54 1n2l s VAL 470 Cb 0.01 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.95 1n2l s VAL 470 CO 0.35 0.02 -0.14 0.28 0.00 0.00 0.00 175.10 175.62 1n2l s THR 471 N 1.99 2.91 0.08 3.92 -1.32 -1.26 -4.80 115.64 117.17 1n2l s THR 471 Ca 0.70 -0.70 -0.31 0.00 -1.21 0.00 0.00 61.69 60.17 1n2l s THR 471 Cb -0.39 -2.23 -0.09 0.00 -1.51 0.00 0.00 72.50 68.28 1n2l s THR 471 CO 0.31 0.51 1.75 -0.36 -2.21 0.00 0.00 174.62 174.62 1n2l s PHE 472 N 0.58 2.21 0.52 9.09 0.40 -1.26 -4.54 117.98 124.98 1n2l s PHE 472 Ca -0.08 0.12 -0.17 0.00 -0.60 0.00 0.00 56.93 56.20 1n2l s PHE 472 Cb -0.16 -4.07 -0.07 0.00 0.51 0.00 0.00 43.02 39.23 1n2l s PHE 472 CO 0.03 -4.38 1.00 0.20 0.70 0.00 0.00 175.22 172.77 1n2l s GLY 473 N 2.71 2.18 -0.28 4.36 0.00 0.14 -4.94 107.32 111.50 1n2l s GLY 473 Ca 0.78 0.31 -0.40 0.00 0.00 0.00 0.00 44.72 45.41 1n2l s GLY 473 CO 0.34 0.60 1.76 -1.05 0.00 0.00 0.00 173.10 174.76 1n2l n PRO 474 N -1.47 1.20 -1.54 2.90 -0.02 -1.26 -3.77 135.00 131.04 1n2l n PRO 474 Ca 0.07 0.44 -0.47 0.00 -2.02 0.00 0.00 63.50 61.53 1n2l n PRO 474 Cb 0.54 -2.13 -0.05 0.00 -0.02 0.00 0.00 33.50 31.83 1n2l n PRO 474 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n2l n SER 475 N 5.53 2.81 -0.08 2.55 2.88 -1.26 -4.16 113.62 121.89 1n2l n SER 475 Ca 0.27 0.35 -0.08 0.00 -1.33 0.00 0.00 58.87 58.08 1n2l n SER 475 Cb 0.14 -1.42 0.08 0.00 -0.75 0.00 0.00 64.21 62.25 1n2l n SER 475 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1n2l h GLN 476 N 13.47 0.78 0.00 -1.46 1.08 -0.68 -2.74 115.11 125.56 1n2l h GLN 476 Ca -0.36 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 56.51 1n2l h GLN 476 Cb 1.28 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.68 1n2l h GLN 476 CO 0.98 0.95 0.00 0.28 -0.95 0.00 0.00 178.83 180.09 1n2l h VAL 477 N 0.67 0.00 -0.00 -0.54 2.07 -1.74 -2.27 116.25 114.43 1n2l h VAL 477 Ca 0.09 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1n2l h VAL 477 Cb 0.78 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1n2l h VAL 477 CO 0.06 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 177.41 1n2l n ALA 478 N -1.83 3.02 0.31 1.67 0.00 -1.03 -3.88 120.51 118.77 1n2l n ALA 478 Ca 0.02 -0.33 0.14 0.00 0.00 0.00 0.00 53.44 53.27 1n2l n ALA 478 Cb 0.24 -1.22 0.65 0.00 0.00 0.00 0.00 19.45 19.12 1n2l n ALA 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n2l h ARG 479 N 0.67 0.00 0.00 0.00 3.08 -1.46 -3.49 114.38 113.19 1n2l h ARG 479 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1n2l h ARG 479 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1n2l h ARG 479 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1n2l n GLY 480 N -0.40 1.34 3.29 0.04 0.00 -1.25 -4.85 105.19 103.35 1n2l n GLY 480 Ca 0.00 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.65 1n2l n GLY 480 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n2l s GLU 481 N -1.81 3.10 -0.27 1.61 2.02 -1.26 -1.65 118.70 120.44 1n2l s GLU 481 Ca 0.00 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.19 1n2l s GLU 481 Cb 0.00 -2.40 0.07 0.00 0.10 0.00 0.00 34.13 31.90 1n2l s GLU 481 CO 0.00 0.23 -0.01 0.34 0.02 0.00 0.00 175.26 175.84 1n2l s ASP 482 N 0.26 4.09 0.61 -0.19 2.15 0.85 -4.98 116.67 119.45 1n2l s ASP 482 Ca -0.14 -1.46 0.31 0.00 0.43 0.00 0.00 52.55 51.69 1n2l s ASP 482 Cb -0.17 -1.23 1.73 0.00 -0.30 0.00 0.00 42.92 42.95 1n2l s ASP 482 CO 0.07 -0.29 2.09 -0.65 -0.17 0.00 0.00 175.17 176.22 1n2l h PRO 483 N 7.90 0.00 0.00 4.34 0.11 -1.98 -1.78 132.00 140.59 1n2l h PRO 483 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1n2l h PRO 483 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1n2l h PRO 483 CO 0.45 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.24 1n2l n ALA 484 N -2.24 1.36 1.30 -0.75 0.00 -1.26 -1.82 120.51 117.10 1n2l n ALA 484 Ca 0.01 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1n2l n ALA 484 Cb 0.33 -1.12 0.38 0.00 0.00 0.00 0.00 19.45 19.05 1n2l n ALA 484 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1n2l n LEU 485 N -1.46 1.35 -4.66 0.00 4.77 -0.67 -4.91 117.00 111.41 1n2l n LEU 485 Ca 0.02 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.16 1n2l n LEU 485 Cb 0.08 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1n2l n LEU 485 CO 0.06 0.24 1.32 -1.10 -1.33 0.00 0.00 177.39 176.59 1n2l s GLN 486 N -2.31 4.20 -0.18 3.23 -0.21 -0.75 -4.87 119.66 118.76 1n2l s GLN 486 Ca 0.29 2.14 -0.30 0.00 0.02 0.00 0.00 55.36 57.50 1n2l s GLN 486 Cb 0.20 -3.90 -0.08 0.00 1.00 0.00 0.00 33.01 30.23 1n2l s GLN 486 CO 0.45 -0.80 2.14 -0.89 -2.12 0.00 0.00 175.29 174.07 1n2l n ILE 487 N 5.34 0.42 -4.65 1.08 5.41 -1.26 -4.96 119.36 120.73 1n2l n ILE 487 Ca 0.16 -0.33 -0.33 0.00 1.00 0.00 0.00 62.75 63.25 1n2l n ILE 487 Cb 0.43 -2.27 -0.12 0.00 -0.71 0.00 0.00 39.64 36.96 1n2l n ILE 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1n2l s HIS 490 N -5.10 3.38 0.26 0.00 3.76 -1.26 -4.99 115.29 111.33 1n2l s HIS 490 Ca -0.12 -1.69 -0.30 0.00 -0.15 0.00 0.00 55.06 52.80 1n2l s HIS 490 Cb 0.12 -3.37 -0.10 0.00 1.11 0.00 0.00 32.58 30.34 1n2l s HIS 490 CO 0.82 -0.95 1.43 -2.14 -0.85 0.00 0.00 174.74 173.05 1n2l s PRO 491 N 1.41 4.27 -0.71 8.40 0.02 -1.26 -2.84 135.00 144.30 1n2l s PRO 491 Ca 0.05 2.29 -0.02 0.00 0.02 0.00 0.00 61.00 63.34 1n2l s PRO 491 Cb -0.26 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.16 1n2l s PRO 491 CO 0.01 -0.40 0.60 0.41 -0.33 0.00 0.00 177.00 177.29 1n2l n GLY 492 N 2.05 0.05 3.95 0.52 0.00 -1.26 -5.02 105.19 105.48 1n2l n GLY 492 Ca 0.06 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 1n2l n GLY 492 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n2l s THR 494 N -2.57 -0.01 -0.23 0.00 -4.23 -1.26 -4.18 115.64 103.15 1n2l s THR 494 Ca 0.49 0.03 -0.17 0.00 -1.18 0.00 0.00 61.69 60.85 1n2l s THR 494 Cb -0.10 -0.80 -0.03 0.00 1.34 0.00 0.00 72.50 72.91 1n2l s THR 494 CO 0.38 0.01 0.47 -2.16 -0.54 0.00 0.00 174.62 172.78 1n2l s PRO 495 N 1.06 4.12 0.52 3.99 0.04 -1.26 -4.85 135.00 138.63 1n2l s PRO 495 Ca -0.06 0.28 -0.18 0.00 0.04 0.00 0.00 61.00 61.08 1n2l s PRO 495 Cb -0.06 -3.60 -0.07 0.00 0.04 0.00 0.00 34.50 30.81 1n2l s PRO 495 CO -0.10 -0.22 1.02 1.03 0.04 0.00 0.00 177.00 178.77 1n2l s ARG 496 N 1.88 3.71 0.02 4.56 0.52 -1.26 -1.73 118.95 126.65 1n2l s ARG 496 Ca 0.21 1.18 0.25 0.00 -0.52 0.00 0.00 55.73 56.85 1n2l s ARG 496 Cb -0.15 -2.09 0.53 0.00 0.52 0.00 0.00 34.95 33.75 1n2l s ARG 496 CO 0.09 -0.48 1.43 -0.35 0.02 0.00 0.00 175.30 176.01 1n2l n PRO 497 N -1.45 0.05 0.19 3.54 -0.04 -1.26 -4.85 135.00 131.17 1n2l n PRO 497 Ca 0.08 0.01 0.18 0.00 -0.04 0.00 0.00 63.50 63.73 1n2l n PRO 497 Cb 0.53 -1.53 0.72 0.00 -0.04 0.00 0.00 33.50 33.18 1n2l n PRO 497 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n2l h ALA 498 N 2.92 1.83 -0.26 0.55 0.00 -1.86 -1.66 119.26 120.79 1n2l h ALA 498 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1n2l h ALA 498 Cb 0.54 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1n2l h ALA 498 CO 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 179.25 178.65 1n2l s HIS 501 N 2.58 1.15 0.00 0.00 3.76 -1.26 -4.62 115.29 116.90 1n2l s HIS 501 Ca 0.23 -0.84 0.00 0.00 -0.15 0.00 0.00 55.06 54.30 1n2l s HIS 501 Cb -0.13 -0.62 0.00 0.00 1.11 0.00 0.00 32.58 32.94 1n2l s HIS 501 CO -0.02 -0.03 0.00 0.00 -0.85 0.00 0.00 174.74 173.85 1n2l n PRO 503 N 0.00 -0.87 0.00 0.00 -0.02 -1.25 -0.71 135.00 132.15 1n2l n PRO 503 Ca 0.00 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.56 1n2l n PRO 503 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 33.54 1n2l n PRO 503 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23