#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y4s s LYS 2 N 0.00 2.46 0.00 2.12 0.00 -1.20 -4.70 119.74 118.41 1y4s s LYS 2 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 55.97 55.22 1y4s s LYS 2 Cb 0.00 -2.41 0.00 0.00 0.00 0.00 0.00 37.83 35.42 1y4s s LYS 2 CO 0.00 0.60 0.00 0.41 0.00 0.00 0.00 175.35 176.36 1y4s n GLY 3 N 1.80 0.31 3.63 0.59 0.00 -1.26 -3.52 105.19 106.74 1y4s n GLY 3 Ca -0.16 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.38 1y4s n GLY 3 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y4s n GLN 4 N 0.00 1.65 -3.79 1.61 6.02 -1.25 -4.33 117.38 117.28 1y4s n GLN 4 Ca 0.00 0.59 -0.12 0.00 -0.01 0.00 0.00 57.00 57.46 1y4s n GLN 4 Cb 0.00 -2.24 -0.09 0.00 1.02 0.00 0.00 30.24 28.94 1y4s n GLN 4 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1y4s s GLU 5 N 0.16 0.63 -0.04 -1.09 2.12 -0.52 -5.00 118.70 114.96 1y4s s GLU 5 Ca 0.76 -0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.82 1y4s s GLU 5 Cb -0.78 0.27 0.01 0.00 0.26 0.00 0.00 34.13 33.89 1y4s s GLU 5 CO 0.46 -0.17 -0.11 0.99 -0.54 0.00 0.00 175.26 175.89 1y4s s THR 6 N -1.52 1.00 0.41 -1.70 2.01 -1.26 -1.86 115.64 112.73 1y4s s THR 6 Ca -0.13 -0.44 0.07 0.00 0.31 0.00 0.00 61.69 61.50 1y4s s THR 6 Cb -0.05 -0.90 -0.07 0.00 0.01 0.00 0.00 72.50 71.48 1y4s s THR 6 CO 0.03 0.31 0.05 -0.13 -0.69 0.00 0.00 174.62 174.19 1y4s s ARG 7 N 0.41 2.02 -0.06 4.92 0.52 -0.73 -4.96 118.95 121.07 1y4s s ARG 7 Ca -0.08 -2.05 -0.01 0.00 -0.52 0.00 0.00 55.73 53.06 1y4s s ARG 7 Cb -0.12 -1.71 -0.04 0.00 0.52 0.00 0.00 34.95 33.60 1y4s s ARG 7 CO 0.02 -0.07 0.03 0.20 0.02 0.00 0.00 175.30 175.50 1y4s s GLY 8 N -3.75 1.92 0.36 -3.53 0.00 -1.26 -2.55 107.32 98.51 1y4s s GLY 8 Ca 0.36 -0.83 -0.26 0.00 0.00 0.00 0.00 44.72 44.00 1y4s s GLY 8 CO 0.19 -0.63 1.06 -1.36 0.00 0.00 0.00 173.10 172.36 1y4s s PHE 9 N -1.00 3.37 0.15 1.90 0.08 -0.83 -4.93 117.98 116.72 1y4s s PHE 9 Ca 0.17 1.67 -0.34 0.00 0.12 0.00 0.00 56.93 58.55 1y4s s PHE 9 Cb -0.12 -3.18 -0.16 0.00 -0.57 0.00 0.00 43.02 38.99 1y4s s PHE 9 CO 0.06 -0.59 1.09 0.94 -0.10 0.00 0.00 175.22 176.62 1y4s n GLN 10 N 0.35 0.87 -0.44 0.44 7.27 -1.26 -4.71 117.38 119.89 1y4s n GLN 10 Ca 0.03 0.31 0.37 0.00 0.07 0.00 0.00 57.00 57.78 1y4s n GLN 10 Cb 0.48 -1.76 0.62 0.00 2.41 0.00 0.00 30.24 31.98 1y4s n GLN 10 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1y4s n SER 11 N 1.96 0.17 0.17 1.69 2.88 -1.26 0.70 113.62 119.93 1y4s n SER 11 Ca 0.16 1.20 0.06 0.00 -1.33 0.00 0.00 58.87 58.96 1y4s n SER 11 Cb 0.22 -0.59 0.13 0.00 -0.75 0.00 0.00 64.21 63.22 1y4s n SER 11 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1y4s h GLU 12 N 0.00 0.00 -0.61 -1.46 4.11 -1.99 -3.35 114.58 111.28 1y4s h GLU 12 Ca 0.79 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 60.14 1y4s h GLU 12 Cb 2.62 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.85 1y4s h GLU 12 CO -0.37 0.36 0.09 0.28 0.07 0.00 0.00 179.01 179.43 1y4s h VAL 13 N 0.00 1.26 -0.23 -1.06 2.07 -0.03 -1.37 116.25 116.89 1y4s h VAL 13 Ca -0.00 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.46 1y4s h VAL 13 Cb 1.20 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1y4s h VAL 13 CO 0.05 0.38 0.00 0.50 0.02 0.00 0.00 177.57 178.52 1y4s h LYS 14 N 0.93 0.34 0.00 1.57 3.64 -1.69 0.87 116.57 122.23 1y4s h LYS 14 Ca 0.18 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1y4s h LYS 14 Cb 0.45 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1y4s h LYS 14 CO 0.01 0.37 -0.22 1.96 -2.27 0.00 0.00 179.45 179.31 1y4s h GLN 15 N 0.34 0.00 0.00 1.90 4.20 -1.50 -2.97 115.11 117.08 1y4s h GLN 15 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1y4s h GLN 15 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1y4s h GLN 15 CO 0.01 0.22 -0.04 1.25 -0.67 0.00 0.00 178.83 179.60 1y4s h LEU 16 N 0.00 0.00 0.00 1.46 5.85 0.15 -3.30 115.31 119.47 1y4s h LEU 16 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1y4s h LEU 16 Cb 0.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1y4s h LEU 16 CO 0.03 0.30 0.00 0.18 -0.34 0.00 0.00 178.44 178.61 1y4s n LEU 17 N -3.57 0.00 -0.52 2.25 4.77 -0.17 0.12 117.00 119.89 1y4s n LEU 17 Ca -0.01 0.44 0.43 0.00 -0.03 0.00 0.00 56.01 56.85 1y4s n LEU 17 Cb 0.02 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 41.87 1y4s n LEU 17 CO 0.01 0.00 1.39 -0.74 -1.33 0.00 0.00 177.39 176.72 1y4s h HIS 18 N 0.00 0.09 0.14 -1.77 2.76 -1.78 -0.77 115.15 113.82 1y4s h HIS 18 Ca 0.00 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1y4s h HIS 18 Cb 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1y4s h HIS 18 CO 0.00 -0.02 -0.07 1.25 -1.30 0.00 0.00 177.93 177.79 1y4s h LEU 19 N 0.03 -0.15 -0.96 0.26 5.85 -1.19 -3.36 115.31 115.79 1y4s h LEU 19 Ca 0.77 0.01 0.30 0.00 0.84 0.00 0.00 57.88 59.80 1y4s h LEU 19 Cb 2.98 0.04 -0.16 0.00 0.37 0.00 0.00 40.66 43.88 1y4s h LEU 19 CO -0.07 0.23 0.32 -0.03 -0.34 0.00 0.00 178.44 178.55 1y4s h MET 20 N -0.86 0.14 -0.01 1.25 1.85 0.22 -2.70 114.93 114.83 1y4s h MET 20 Ca -0.02 -0.01 0.01 0.00 -0.61 0.00 0.00 59.70 59.07 1y4s h MET 20 Cb 0.14 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.11 1y4s h MET 20 CO 0.03 0.09 -0.28 0.82 -0.40 0.00 0.00 176.91 177.17 1y4s h ILE 21 N 0.14 0.00 -0.51 1.77 2.04 -1.39 0.13 117.51 119.70 1y4s h ILE 21 Ca 0.66 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.56 1y4s h ILE 21 Cb 1.50 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1y4s h ILE 21 CO -0.73 0.00 0.27 0.45 0.00 0.00 0.00 178.15 178.14 1y4s h HIS 22 N -0.35 0.49 -0.10 1.37 3.86 -1.66 -0.69 115.15 118.08 1y4s h HIS 22 Ca 0.01 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.27 1y4s h HIS 22 Cb 0.38 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.69 1y4s h HIS 22 CO -0.45 0.25 0.31 1.03 0.86 0.00 0.00 177.93 179.93 1y4s h SER 23 N 0.52 0.00 0.00 2.45 0.87 -1.12 -3.06 113.55 113.22 1y4s h SER 23 Ca 0.22 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1y4s h SER 23 Cb 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1y4s h SER 23 CO -0.14 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.34 1y4s n LEU 24 N -3.16 1.43 0.12 2.23 4.77 0.41 -4.20 117.00 118.61 1y4s n LEU 24 Ca 0.00 -1.43 0.09 0.00 -0.03 0.00 0.00 56.01 54.64 1y4s n LEU 24 Cb 0.39 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 41.94 1y4s n LEU 24 CO 0.18 0.36 0.78 0.00 -1.33 0.00 0.00 177.39 177.37 1y4s n TYR 25 N -0.33 0.59 -0.05 -1.77 9.36 -0.86 -0.80 117.16 123.30 1y4s n TYR 25 Ca 0.00 0.29 -0.13 0.00 3.32 0.00 0.00 57.90 61.38 1y4s n TYR 25 Cb 0.27 -0.97 -0.07 0.00 -0.63 0.00 0.00 39.34 37.94 1y4s n TYR 25 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1y4s h SER 26 N 0.00 0.39 -3.29 2.98 4.64 -1.83 -3.33 113.55 113.12 1y4s h SER 26 Ca 0.00 -0.48 -0.69 0.00 -0.47 0.00 0.00 61.79 60.15 1y4s h SER 26 Cb 0.07 -0.11 -0.37 0.00 -0.31 0.00 0.00 62.40 61.69 1y4s h SER 26 CO 0.00 0.80 -0.18 0.20 -0.87 0.00 0.00 176.83 176.77 1y4s s ASN 27 N -6.15 5.78 0.02 4.97 -0.87 0.02 -4.85 114.94 113.86 1y4s s ASN 27 Ca -0.14 -3.75 0.22 0.00 -1.57 0.00 0.00 52.86 47.62 1y4s s ASN 27 Cb 0.05 -1.86 -0.27 0.00 -0.02 0.00 0.00 41.25 39.16 1y4s s ASN 27 CO 0.76 -0.16 0.60 2.29 -2.57 0.00 0.00 177.10 178.02 1y4s n LYS 28 N 2.25 0.65 0.00 -0.60 2.85 -1.13 -3.98 118.16 118.20 1y4s n LYS 28 Ca 0.21 -0.13 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 1y4s n LYS 28 Cb 0.37 -1.59 0.00 0.00 -0.65 0.00 0.00 35.03 33.16 1y4s n LYS 28 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1y4s n GLU 29 N -2.35 0.00 0.20 -1.58 4.71 -1.26 -3.16 120.64 117.20 1y4s n GLU 29 Ca -0.03 0.34 -0.15 0.00 -0.01 0.00 0.00 57.16 57.31 1y4s n GLU 29 Cb 0.57 -1.53 -0.08 0.00 -1.01 0.00 0.00 31.44 29.39 1y4s n GLU 29 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1y4s h ILE 30 N 0.00 0.22 -0.97 -3.67 2.04 -1.95 -3.14 117.51 110.05 1y4s h ILE 30 Ca 0.00 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.10 1y4s h ILE 30 Cb 0.07 0.22 -0.18 0.00 -0.74 0.00 0.00 36.82 36.19 1y4s h ILE 30 CO 0.00 0.00 -0.08 2.22 0.00 0.00 0.00 178.15 180.29 1y4s n PHE 31 N -5.47 0.52 0.22 1.37 -1.74 -1.19 0.26 117.46 111.43 1y4s n PHE 31 Ca -0.09 1.17 0.13 0.00 -0.56 0.00 0.00 57.45 58.10 1y4s n PHE 31 Cb 0.38 -1.16 0.75 0.00 1.52 0.00 0.00 39.48 40.96 1y4s n PHE 31 CO 0.00 0.00 0.00 1.25 -0.56 0.00 0.00 176.76 177.45 1y4s h LEU 32 N 0.00 0.00 0.11 5.98 5.85 -1.80 0.15 115.31 125.60 1y4s h LEU 32 Ca 0.54 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 59.05 1y4s h LEU 32 Cb 1.02 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.07 1y4s h LEU 32 CO -0.94 0.00 -0.90 -0.09 -0.34 0.00 0.00 178.44 176.17 1y4s h ARG 33 N 0.00 0.41 -0.13 1.25 1.12 0.36 -3.19 114.38 114.20 1y4s h ARG 33 Ca 0.05 -0.59 -0.05 0.00 -1.11 0.00 0.00 59.98 58.28 1y4s h ARG 33 Cb 0.23 0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 30.38 1y4s h ARG 33 CO -0.00 1.25 -0.15 0.93 -3.11 0.00 0.00 179.97 178.89 1y4s h GLU 34 N -0.15 0.20 -0.10 0.20 4.39 0.10 -0.29 114.58 118.93 1y4s h GLU 34 Ca -0.14 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.36 1y4s h GLU 34 Cb 1.66 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 30.29 1y4s h GLU 34 CO 0.17 0.36 -0.53 -0.07 -1.16 0.00 0.00 179.01 177.78 1y4s h LEU 35 N 0.19 0.64 -0.36 1.33 3.38 -1.13 -2.26 115.31 117.10 1y4s h LEU 35 Ca 0.04 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.33 1y4s h LEU 35 Cb 0.38 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1y4s h LEU 35 CO 0.02 1.19 0.10 0.40 0.09 0.00 0.00 178.44 180.24 1y4s h ILE 36 N 0.14 1.22 -0.74 1.22 2.04 -1.50 0.22 117.51 120.11 1y4s h ILE 36 Ca -0.04 -0.73 0.14 0.00 1.00 0.00 0.00 64.86 65.23 1y4s h ILE 36 Cb 1.18 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 38.18 1y4s h ILE 36 CO 0.11 0.25 0.27 -1.28 0.00 0.00 0.00 178.15 177.50 1y4s h SER 37 N 0.43 0.23 -0.44 1.72 0.87 -1.07 0.16 113.55 115.44 1y4s h SER 37 Ca 0.11 0.11 -0.13 0.00 -1.23 0.00 0.00 61.79 60.65 1y4s h SER 37 Cb 0.29 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1y4s h SER 37 CO -0.00 0.08 -0.23 0.78 -0.53 0.00 0.00 176.83 176.92 1y4s h ASN 38 N 0.41 0.99 -0.49 6.23 2.35 -0.70 -1.67 115.58 122.68 1y4s h ASN 38 Ca 0.41 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1y4s h ASN 38 Cb 0.63 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 1y4s h ASN 38 CO -0.42 1.17 0.29 0.00 -1.65 0.00 0.00 177.43 176.82 1y4s h ALA 39 N 0.90 1.55 0.17 -0.83 0.00 0.11 0.22 119.26 121.38 1y4s h ALA 39 Ca 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1y4s h ALA 39 Cb 0.81 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1y4s h ALA 39 CO 0.07 0.38 -0.08 1.03 0.00 0.00 0.00 179.25 180.65 1y4s h SER 40 N 0.70 -0.19 -0.42 0.00 0.87 -0.41 -2.15 113.55 111.95 1y4s h SER 40 Ca 0.18 -0.23 0.07 0.00 -1.23 0.00 0.00 61.79 60.59 1y4s h SER 40 Cb 0.00 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1y4s h SER 40 CO -0.03 0.13 0.29 0.44 -0.53 0.00 0.00 176.83 177.13 1y4s h ASP 41 N -0.53 0.25 0.65 6.23 3.32 -0.56 0.65 116.42 126.44 1y4s h ASP 41 Ca -0.02 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 1y4s h ASP 41 Cb 0.40 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1y4s h ASP 41 CO 0.04 0.16 -0.42 0.00 -1.72 0.00 0.00 179.24 177.30 1y4s h ALA 42 N 1.78 1.09 0.13 3.45 0.00 -0.37 -2.46 119.26 122.87 1y4s h ALA 42 Ca 0.19 -0.38 -0.26 0.00 0.00 0.00 0.00 54.91 54.45 1y4s h ALA 42 Cb 0.39 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.14 1y4s h ALA 42 CO -0.04 0.53 -1.10 0.00 0.00 0.00 0.00 179.25 178.64 1y4s h ALA 43 N 1.58 -0.04 -0.67 0.00 0.00 -0.23 -1.45 119.26 118.45 1y4s h ALA 43 Ca -0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.14 1y4s h ALA 43 Cb 0.86 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1y4s h ALA 43 CO 0.05 0.57 0.30 -0.44 0.00 0.00 0.00 179.25 179.74 1y4s h ASP 44 N 0.07 0.87 -0.68 0.00 3.32 -1.31 -1.73 116.42 116.97 1y4s h ASP 44 Ca -0.17 -0.10 0.05 0.00 0.02 0.00 0.00 57.03 56.83 1y4s h ASP 44 Cb 1.81 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 41.08 1y4s h ASP 44 CO 0.21 0.76 0.39 0.11 -1.72 0.00 0.00 179.24 178.99 1y4s h LYS 45 N 0.95 0.72 0.79 3.56 1.79 -1.47 -1.49 116.57 121.42 1y4s h LYS 45 Ca 0.23 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 1y4s h LYS 45 Cb 0.13 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 30.62 1y4s h LYS 45 CO -0.03 0.48 -0.38 1.25 -1.08 0.00 0.00 179.45 179.69 1y4s h LEU 46 N 0.74 -0.89 -1.93 2.94 5.85 -1.23 -2.35 115.31 118.43 1y4s h LEU 46 Ca 0.29 0.02 0.31 0.00 0.84 0.00 0.00 57.88 59.34 1y4s h LEU 46 Cb 0.14 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 1y4s h LEU 46 CO -0.16 -0.57 0.78 0.03 -0.34 0.00 0.00 178.44 178.19 1y4s h ARG 47 N -1.19 0.04 0.52 1.25 3.08 -1.26 0.90 114.38 117.73 1y4s h ARG 47 Ca -0.11 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 1y4s h ARG 47 Cb 0.82 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.87 1y4s h ARG 47 CO 0.18 0.03 -0.25 0.35 -1.07 0.00 0.00 179.97 179.21 1y4s h PHE 48 N 0.04 -0.64 -0.93 3.04 3.57 -0.88 -2.87 116.94 118.26 1y4s h PHE 48 Ca 0.53 -0.02 0.15 0.00 3.53 0.00 0.00 57.97 62.17 1y4s h PHE 48 Cb 2.04 0.21 -0.10 0.00 2.79 0.00 0.00 35.95 40.90 1y4s h PHE 48 CO -0.00 -0.40 0.54 0.00 -2.23 0.00 0.00 178.31 176.22 1y4s h ARG 49 N -0.98 0.73 -0.41 1.11 3.08 -0.74 -0.87 114.38 116.30 1y4s h ARG 49 Ca -0.07 -0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.05 1y4s h ARG 49 Cb 0.53 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1y4s h ARG 49 CO 0.12 0.48 0.30 0.00 -1.07 0.00 0.00 179.97 179.80 1y4s h ALA 50 N 1.58 2.38 0.53 0.04 0.00 -0.87 -1.98 119.26 120.94 1y4s h ALA 50 Ca 0.51 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.38 1y4s h ALA 50 Cb 0.69 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1y4s h ALA 50 CO -0.34 -0.51 -0.40 -0.07 0.00 0.00 0.00 179.25 177.92 1y4s h LEU 51 N 0.00 -1.05 -0.31 0.00 3.38 -0.92 0.14 115.31 116.56 1y4s h LEU 51 Ca 0.20 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1y4s h LEU 51 Cb 0.80 0.32 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 1y4s h LEU 51 CO -0.00 -0.57 -0.33 -1.28 0.09 0.00 0.00 178.44 176.34 1y4s h SER 52 N -0.90 -1.08 -3.11 -0.43 0.87 -1.52 -3.36 113.55 104.02 1y4s h SER 52 Ca -0.07 0.18 -0.60 0.00 -1.23 0.00 0.00 61.79 60.07 1y4s h SER 52 Cb 0.74 0.49 -0.40 0.00 -0.44 0.00 0.00 62.40 62.79 1y4s h SER 52 CO 0.03 -0.34 -0.78 0.21 -0.53 0.00 0.00 176.83 175.42 1y4s s ASN 53 N -5.02 3.41 0.00 6.23 2.47 -0.80 -5.02 114.94 116.21 1y4s s ASN 53 Ca -0.15 -2.36 0.00 0.00 0.42 0.00 0.00 52.86 50.77 1y4s s ASN 53 Cb 0.12 -0.76 0.00 0.00 -1.45 0.00 0.00 41.25 39.16 1y4s s ASN 53 CO 0.67 -0.30 0.07 -2.65 -3.72 0.00 0.00 177.10 171.17 1y4s n PRO 54 N 3.86 0.00 0.00 0.43 -0.02 0.49 -2.69 135.00 137.07 1y4s n PRO 54 Ca 0.09 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.69 1y4s n PRO 54 Cb 0.36 -1.08 0.11 0.00 -0.02 0.00 0.00 33.50 32.87 1y4s n PRO 54 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1y4s n ASP 55 N -0.52 2.05 0.31 2.55 8.00 -1.26 -4.13 116.55 123.54 1y4s n ASP 55 Ca 0.00 -1.52 0.20 0.00 0.71 0.00 0.00 54.79 54.17 1y4s n ASP 55 Cb 0.00 0.29 0.95 0.00 -0.02 0.00 0.00 41.12 42.34 1y4s n ASP 55 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1y4s h LEU 56 N 2.74 0.00 -2.05 0.64 3.38 -1.86 -0.88 115.31 117.27 1y4s h LEU 56 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1y4s h LEU 56 Cb 0.75 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 1y4s h LEU 56 CO 0.00 0.01 0.08 -1.22 0.09 0.00 0.00 178.44 177.40 1y4s n TYR 57 N -3.13 0.49 -1.39 1.13 0.53 -1.26 -4.46 117.16 109.08 1y4s n TYR 57 Ca -0.01 -0.53 -0.15 0.00 -1.02 0.00 0.00 57.90 56.18 1y4s n TYR 57 Cb 0.19 -0.31 -0.15 0.00 -1.03 0.00 0.00 39.34 38.04 1y4s n TYR 57 CO 0.00 0.00 0.00 -1.91 -1.02 0.00 0.00 176.86 173.93 1y4s n GLU 58 N 0.17 0.07 0.00 -0.72 2.13 -0.34 -3.17 120.64 118.79 1y4s n GLU 58 Ca 0.09 -0.18 0.00 0.00 0.66 0.00 0.00 57.16 57.72 1y4s n GLU 58 Cb 0.61 -1.46 0.00 0.00 0.27 0.00 0.00 31.44 30.86 1y4s n GLU 58 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y4s n GLY 59 N 5.43 1.94 3.75 8.31 0.00 -1.26 -5.04 105.19 118.33 1y4s n GLY 59 Ca 0.47 -0.77 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 1y4s n GLY 59 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1y4s s ASP 60 N -4.00 6.52 -0.17 1.61 3.84 -1.19 -4.98 116.67 118.30 1y4s s ASP 60 Ca 0.00 0.61 0.13 0.00 -0.00 0.00 0.00 52.55 53.29 1y4s s ASP 60 Cb 0.00 -2.20 0.39 0.00 -1.38 0.00 0.00 42.92 39.73 1y4s s ASP 60 CO 0.00 0.14 1.20 0.61 -0.00 0.00 0.00 175.17 177.12 1y4s n GLY 61 N 3.04 4.67 2.96 2.12 0.00 -1.26 -4.76 105.19 111.96 1y4s n GLY 61 Ca -0.12 -1.21 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 1y4s n GLY 61 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y4s s GLU 62 N -2.84 1.64 0.53 1.61 2.02 -1.26 -5.10 118.70 115.30 1y4s s GLU 62 Ca 0.36 -2.15 -0.20 0.00 0.02 0.00 0.00 54.97 53.00 1y4s s GLU 62 Cb 0.35 -3.15 -0.06 0.00 0.10 0.00 0.00 34.13 31.37 1y4s s GLU 62 CO -0.06 -1.02 1.14 -0.51 0.02 0.00 0.00 175.26 174.83 1y4s s LEU 63 N 0.42 3.79 -0.06 1.80 1.43 -1.26 -5.02 118.68 119.78 1y4s s LEU 63 Ca 0.14 2.22 -0.30 0.00 -1.03 0.00 0.00 54.13 55.15 1y4s s LEU 63 Cb -0.22 -4.53 0.11 0.00 0.03 0.00 0.00 46.19 41.58 1y4s s LEU 63 CO -0.05 -1.20 0.97 0.00 0.23 0.00 0.00 176.35 176.29 1y4s s ARG 64 N -3.19 0.69 -0.08 1.70 1.70 -1.26 -4.26 118.95 114.24 1y4s s ARG 64 Ca 0.72 -0.23 0.04 0.00 -0.47 0.00 0.00 55.73 55.78 1y4s s ARG 64 Cb -0.25 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.45 1y4s s ARG 64 CO 0.29 -0.30 -0.19 0.54 -1.08 0.00 0.00 175.30 174.56 1y4s s VAL 65 N -2.82 1.69 -0.12 4.99 0.11 -0.63 -3.16 120.40 120.45 1y4s s VAL 65 Ca 0.05 -0.81 0.00 0.00 -2.93 0.00 0.00 61.98 58.29 1y4s s VAL 65 Cb -0.01 -1.48 -0.02 0.00 -1.53 0.00 0.00 36.38 33.35 1y4s s VAL 65 CO -0.07 0.48 -0.13 -0.13 -3.33 0.00 0.00 175.10 171.92 1y4s s ARG 66 N 0.40 3.31 0.08 1.54 0.52 -0.15 -0.94 118.95 123.72 1y4s s ARG 66 Ca -0.16 -0.68 0.06 0.00 -0.52 0.00 0.00 55.73 54.44 1y4s s ARG 66 Cb -0.17 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 1y4s s ARG 66 CO 0.06 0.26 -0.10 0.08 0.02 0.00 0.00 175.30 175.62 1y4s s VAL 67 N 0.24 3.39 0.02 3.52 1.01 -1.12 -1.16 120.40 126.29 1y4s s VAL 67 Ca -0.08 -1.18 -0.28 0.00 0.00 0.00 0.00 61.98 60.43 1y4s s VAL 67 Cb -0.15 -2.56 0.10 0.00 0.00 0.00 0.00 36.38 33.77 1y4s s VAL 67 CO 0.05 0.17 0.98 -0.94 0.00 0.00 0.00 175.10 175.36 1y4s s SER 68 N -2.03 -0.26 -0.11 3.32 1.04 -0.92 -0.18 113.70 114.56 1y4s s SER 68 Ca 0.20 -0.13 -0.08 0.00 0.48 0.00 0.00 55.95 56.42 1y4s s SER 68 Cb -0.11 0.37 0.04 0.00 0.10 0.00 0.00 66.02 66.42 1y4s s SER 68 CO 0.12 -0.63 0.28 0.72 0.98 0.00 0.00 173.24 174.70 1y4s s PHE 69 N -3.04 -0.33 -0.89 5.02 -0.12 -1.26 -0.84 117.98 116.52 1y4s s PHE 69 Ca 0.08 0.79 -0.17 0.00 -0.05 0.00 0.00 56.93 57.58 1y4s s PHE 69 Cb -0.01 0.10 0.16 0.00 -0.63 0.00 0.00 43.02 42.64 1y4s s PHE 69 CO -0.05 -0.19 0.99 0.34 -0.05 0.00 0.00 175.22 176.27 1y4s s ASP 70 N 0.58 6.66 0.66 1.98 -1.08 -0.68 -4.85 116.67 119.94 1y4s s ASP 70 Ca -0.04 -2.25 0.31 0.00 -0.52 0.00 0.00 52.55 50.05 1y4s s ASP 70 Cb -0.05 -2.33 1.68 0.00 -1.46 0.00 0.00 42.92 40.76 1y4s s ASP 70 CO -0.03 -0.90 1.96 0.50 0.52 0.00 0.00 175.17 177.21 1y4s h LYS 71 N 8.48 0.00 0.10 4.34 3.64 -1.89 0.49 116.57 131.73 1y4s h LYS 71 Ca 0.13 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.16 1y4s h LYS 71 Cb 1.03 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 1y4s h LYS 71 CO 0.99 0.00 -1.90 -0.44 -2.27 0.00 0.00 179.45 175.82 1y4s h ASP 72 N 0.00 0.32 0.07 4.20 3.32 -1.96 -3.35 116.42 119.02 1y4s h ASP 72 Ca 0.01 -0.70 0.00 0.00 0.02 0.00 0.00 57.03 56.36 1y4s h ASP 72 Cb 0.64 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1y4s h ASP 72 CO -0.00 1.63 -0.10 0.29 -1.72 0.00 0.00 179.24 179.34 1y4s n LYS 73 N -3.37 1.40 -3.44 3.56 5.02 -0.45 -4.95 118.16 115.92 1y4s n LYS 73 Ca -0.27 -0.85 -0.20 0.00 -2.02 0.00 0.00 58.31 54.97 1y4s n LYS 73 Cb 1.05 -1.48 0.07 0.00 -0.02 0.00 0.00 35.03 34.65 1y4s n LYS 73 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1y4s n ARG 74 N -0.06 -6.91 -4.43 1.97 1.74 0.16 -4.86 116.66 104.27 1y4s n ARG 74 Ca 0.16 0.75 -0.24 0.00 -0.77 0.00 0.00 57.85 57.76 1y4s n ARG 74 Cb 0.37 -5.54 -0.10 0.00 -1.02 0.00 0.00 32.46 26.16 1y4s n ARG 74 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1y4s s THR 75 N -3.30 2.27 -0.03 0.55 -4.23 -1.08 -1.93 115.64 107.90 1y4s s THR 75 Ca 0.40 -2.25 0.03 0.00 -1.18 0.00 0.00 61.69 58.69 1y4s s THR 75 Cb -0.18 -2.18 -0.00 0.00 1.34 0.00 0.00 72.50 71.48 1y4s s THR 75 CO 0.66 -0.36 -0.12 -0.22 -0.54 0.00 0.00 174.62 174.03 1y4s s LEU 76 N -3.22 1.85 -0.07 4.79 2.96 -0.89 -1.69 118.68 122.41 1y4s s LEU 76 Ca 0.25 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1y4s s LEU 76 Cb -0.05 -0.70 0.01 0.00 0.50 0.00 0.00 46.19 45.95 1y4s s LEU 76 CO 0.12 0.10 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.22 1y4s s THR 77 N 0.10 1.27 -0.20 3.68 2.01 -0.02 -0.69 115.64 121.78 1y4s s THR 77 Ca -0.03 -0.57 0.01 0.00 0.31 0.00 0.00 61.69 61.42 1y4s s THR 77 Cb -0.09 -1.14 0.03 0.00 0.01 0.00 0.00 72.50 71.31 1y4s s THR 77 CO 0.01 0.38 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.53 1y4s s ILE 78 N 0.55 1.99 -0.09 1.82 1.01 -0.27 -2.16 121.20 124.04 1y4s s ILE 78 Ca -0.14 -1.11 -0.01 0.00 0.00 0.00 0.00 60.65 59.40 1y4s s ILE 78 Cb -0.15 -1.92 0.03 0.00 0.01 0.00 0.00 42.46 40.43 1y4s s ILE 78 CO 0.04 0.33 -0.02 -0.94 0.00 0.00 0.00 174.94 174.35 1y4s s SER 79 N 1.27 1.89 0.52 3.58 1.04 -0.31 -1.09 113.70 120.60 1y4s s SER 79 Ca 0.01 -0.21 0.07 0.00 0.48 0.00 0.00 55.95 56.29 1y4s s SER 79 Cb -0.15 -0.59 0.04 0.00 0.10 0.00 0.00 66.02 65.42 1y4s s SER 79 CO -0.10 -0.18 0.51 1.51 0.98 0.00 0.00 173.24 175.96 1y4s s ASP 80 N 1.87 4.89 -0.44 7.02 1.47 -0.78 -0.98 116.67 129.73 1y4s s ASP 80 Ca 0.04 -0.99 0.09 0.00 1.18 0.00 0.00 52.55 52.88 1y4s s ASP 80 Cb -0.13 0.12 0.32 0.00 -0.34 0.00 0.00 42.92 42.89 1y4s s ASP 80 CO -0.06 -1.05 0.75 -0.46 0.68 0.00 0.00 175.17 175.02 1y4s n ASN 81 N -1.85 1.79 -0.87 2.11 6.94 -1.19 -2.19 115.26 119.99 1y4s n ASN 81 Ca 0.05 -3.14 0.00 0.00 -0.02 0.00 0.00 54.58 51.46 1y4s n ASN 81 Cb 0.63 -0.61 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 1y4s n ASN 81 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1y4s n GLY 82 N 0.39 3.07 0.41 4.83 0.00 -1.26 -4.79 105.19 107.85 1y4s n GLY 82 Ca 0.26 -2.09 0.36 0.00 0.00 0.00 0.00 46.02 44.56 1y4s n GLY 82 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y4s n VAL 83 N -0.32 -0.29 -0.82 1.61 0.24 -0.55 -3.89 118.33 114.30 1y4s n VAL 83 Ca 0.00 1.80 0.11 0.00 -2.04 0.00 0.00 64.34 64.21 1y4s n VAL 83 Cb 0.00 -2.94 -0.03 0.00 -1.47 0.00 0.00 33.84 29.40 1y4s n VAL 83 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1y4s n GLY 84 N -1.42 -1.86 3.54 7.63 0.00 -1.26 0.61 105.19 112.41 1y4s n GLY 84 Ca 0.38 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 1y4s n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1y4s s MET 85 N -2.03 1.80 0.13 1.61 -1.94 -1.26 -4.50 119.30 113.10 1y4s s MET 85 Ca 0.00 -1.93 0.04 0.00 -1.71 0.00 0.00 55.69 52.08 1y4s s MET 85 Cb 0.00 -1.63 -0.04 0.00 2.01 0.00 0.00 34.83 35.18 1y4s s MET 85 CO 0.00 0.11 0.13 0.99 -0.01 0.00 0.00 175.02 176.24 1y4s s THR 86 N -2.67 4.63 0.19 2.05 2.01 -1.26 -1.10 115.64 119.49 1y4s s THR 86 Ca 0.32 -0.89 -0.13 0.00 0.31 0.00 0.00 61.69 61.30 1y4s s THR 86 Cb 0.03 -3.31 0.11 0.00 0.01 0.00 0.00 72.50 69.34 1y4s s THR 86 CO 0.16 -0.01 1.71 -0.09 -0.69 0.00 0.00 174.62 175.71 1y4s h ARG 87 N 2.75 0.21 -0.27 4.92 2.43 -1.95 0.70 114.38 123.17 1y4s h ARG 87 Ca -0.47 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.66 1y4s h ARG 87 Cb 1.18 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1y4s h ARG 87 CO 0.65 0.14 0.07 -0.44 -1.51 0.00 0.00 179.97 178.88 1y4s h ASP 88 N 0.22 0.34 -0.19 -3.80 3.32 -2.00 -2.11 116.42 112.20 1y4s h ASP 88 Ca 0.25 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 1y4s h ASP 88 Cb 0.34 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1y4s h ASP 88 CO -0.34 0.35 -0.32 -0.33 -1.72 0.00 0.00 179.24 176.89 1y4s h GLU 89 N 0.38 0.54 -0.69 3.56 5.08 -1.40 -2.50 114.58 119.56 1y4s h GLU 89 Ca 0.09 -0.34 0.13 0.00 -1.00 0.00 0.00 59.36 58.25 1y4s h GLU 89 Cb 0.15 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.34 1y4s h GLU 89 CO -0.00 0.94 0.22 0.28 -1.00 0.00 0.00 179.01 179.44 1y4s h VAL 90 N 0.20 0.64 0.00 3.13 2.07 0.89 -0.17 116.25 123.01 1y4s h VAL 90 Ca 0.01 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1y4s h VAL 90 Cb 0.90 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1y4s h VAL 90 CO 0.07 0.06 -0.41 0.40 0.02 0.00 0.00 177.57 177.71 1y4s h ILE 91 N 0.35 1.06 0.15 4.57 2.04 -1.30 -1.75 117.51 122.63 1y4s h ILE 91 Ca 0.37 -1.54 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1y4s h ILE 91 Cb 0.56 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1y4s h ILE 91 CO -0.41 0.40 -0.07 0.44 0.00 0.00 0.00 178.15 178.51 1y4s h ASP 92 N 0.00 -0.17 0.40 1.72 3.32 -0.68 -3.09 116.42 117.91 1y4s h ASP 92 Ca -0.00 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 1y4s h ASP 92 Cb 0.86 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1y4s h ASP 92 CO 0.05 0.35 -0.19 0.45 -1.72 0.00 0.00 179.24 178.18 1y4s h HIS 93 N -1.03 -0.50 -0.02 4.55 3.86 -1.18 -2.87 115.15 117.96 1y4s h HIS 93 Ca -0.02 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1y4s h HIS 93 Cb 0.26 0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.89 1y4s h HIS 93 CO 0.03 -0.21 -0.06 -0.07 0.86 0.00 0.00 177.93 178.47 1y4s h LEU 94 N -1.06 0.08 -1.94 2.43 3.38 -1.51 -3.29 115.31 113.39 1y4s h LEU 94 Ca -0.05 -0.63 0.13 0.00 0.09 0.00 0.00 57.88 57.41 1y4s h LEU 94 Cb 0.51 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1y4s h LEU 94 CO 0.09 0.70 0.33 1.23 0.09 0.00 0.00 178.44 180.88 1y4s h GLY 95 N -0.53 0.09 0.00 0.83 0.00 -1.34 -3.44 103.07 98.68 1y4s h GLY 95 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1y4s h GLY 95 CO 0.01 0.01 0.00 2.41 0.00 0.00 0.00 176.54 178.98 1y4s n THR 96 N -4.42 0.00 -3.15 4.70 -1.04 -1.08 -4.72 114.28 104.57 1y4s n THR 96 Ca 0.08 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.15 1y4s n THR 96 Cb 0.50 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 69.01 1y4s n THR 96 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1y4s s ILE 97 N 3.64 -0.14 0.47 12.58 2.07 -1.26 -4.91 121.20 133.65 1y4s s ILE 97 Ca 0.00 0.00 0.25 0.00 -1.41 0.00 0.00 60.65 59.49 1y4s s ILE 97 Cb 0.00 -0.35 0.45 0.00 0.13 0.00 0.00 42.46 42.68 1y4s s ILE 97 CO 0.00 0.00 1.82 0.00 -1.91 0.00 0.00 174.94 174.85 1y4s h ALA 98 N 7.35 2.56 -3.00 1.50 0.00 -1.88 -3.43 119.26 122.36 1y4s h ALA 98 Ca -0.11 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1y4s h ALA 98 Cb 1.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1y4s h ALA 98 CO -0.15 -0.89 0.00 1.17 0.00 0.00 0.00 179.25 179.38 1y4s n LYS 99 N -4.42 2.54 -4.20 0.00 4.81 -1.26 -5.13 118.16 110.50 1y4s n LYS 99 Ca 0.22 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.54 1y4s n LYS 99 Cb 0.94 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.89 1y4s n LYS 99 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1y4s s SER 100 N -1.22 0.34 0.00 3.14 0.15 -1.26 -5.08 113.70 109.77 1y4s s SER 100 Ca 0.00 -1.42 0.00 0.00 0.70 0.00 0.00 55.95 55.23 1y4s s SER 100 Cb 0.00 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 1y4s s SER 100 CO 0.00 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.17 1y4s n GLY 101 N -0.32 0.00 0.36 9.45 0.00 -1.26 -5.02 105.19 108.40 1y4s n GLY 101 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1y4s n GLY 101 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1y4s n THR 102 N 0.00 0.63 0.22 2.61 -1.04 -1.26 -4.03 114.28 111.41 1y4s n THR 102 Ca 0.00 -0.20 0.15 0.00 -2.04 0.00 0.00 64.05 61.96 1y4s n THR 102 Cb 0.00 -1.29 0.81 0.00 -1.82 0.00 0.00 70.33 68.03 1y4s n THR 102 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1y4s h LYS 103 N -0.22 0.00 0.00 -2.82 3.64 -2.00 -2.83 116.57 112.34 1y4s h LYS 103 Ca -0.27 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.90 1y4s h LYS 103 Cb 1.31 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.09 1y4s h LYS 103 CO -0.11 0.00 -1.79 0.45 -2.27 0.00 0.00 179.45 175.73 1y4s n SER 104 N -2.54 2.32 -0.37 4.20 2.88 -1.26 -4.68 113.62 114.17 1y4s n SER 104 Ca -0.02 -0.02 0.01 0.00 -1.33 0.00 0.00 58.87 57.52 1y4s n SER 104 Cb 0.05 0.58 0.07 0.00 -0.75 0.00 0.00 64.21 64.16 1y4s n SER 104 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1y4s n PHE 105 N -2.52 0.13 -1.01 0.66 7.35 -1.07 -2.27 117.46 118.73 1y4s n PHE 105 Ca -0.20 1.19 -0.30 0.00 -0.76 0.00 0.00 57.45 57.38 1y4s n PHE 105 Cb 0.85 -0.93 -0.02 0.00 0.35 0.00 0.00 39.48 39.73 1y4s n PHE 105 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1y4s n LEU 106 N -5.48 6.48 0.00 -2.13 4.77 -1.25 -4.76 117.00 114.62 1y4s n LEU 106 Ca 0.12 -3.51 -0.04 0.00 -0.03 0.00 0.00 56.01 52.54 1y4s n LEU 106 Cb 0.42 -1.30 0.02 0.00 -2.33 0.00 0.00 43.42 40.23 1y4s n LEU 106 CO -0.13 1.17 0.38 -0.62 -1.33 0.00 0.00 177.39 176.87 1y4s n GLU 107 N 4.12 0.60 0.00 3.23 1.02 -0.96 -5.13 120.64 123.51 1y4s n GLU 107 Ca 0.58 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.51 1y4s n GLU 107 Cb 0.19 1.55 0.00 0.00 -0.02 0.00 0.00 31.44 33.16 1y4s n GLU 107 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1y4s n SER 108 N -1.23 -2.25 -4.53 1.62 3.41 -1.26 -5.14 113.62 104.24 1y4s n SER 108 Ca -0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.15 1y4s n SER 108 Cb 0.36 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 1y4s n SER 108 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1y4s s SER 117 N -4.00 6.66 -1.07 4.04 1.04 -1.26 -5.20 113.70 113.91 1y4s s SER 117 Ca 0.00 -1.95 -0.11 0.00 0.48 0.00 0.00 55.95 54.38 1y4s s SER 117 Cb 0.00 -2.52 0.26 0.00 0.10 0.00 0.00 66.02 63.86 1y4s s SER 117 CO 0.00 -1.26 1.09 -1.10 0.98 0.00 0.00 173.24 172.94 1y4s s GLN 118 N 3.96 4.09 -0.25 4.02 -0.21 -1.26 -4.87 119.66 125.14 1y4s s GLN 118 Ca 0.44 -3.02 -0.29 0.00 0.02 0.00 0.00 55.36 52.52 1y4s s GLN 118 Cb -0.01 -4.59 -0.00 0.00 1.00 0.00 0.00 33.01 29.41 1y4s s GLN 118 CO -0.05 -1.31 1.25 -0.51 -2.12 0.00 0.00 175.29 172.55 1y4s s LEU 119 N -0.71 4.01 0.04 2.90 1.43 -1.26 -4.90 118.68 120.20 1y4s s LEU 119 Ca 0.30 1.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.77 1y4s s LEU 119 Cb -0.09 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1y4s s LEU 119 CO -0.07 -0.92 0.00 -0.38 0.23 0.00 0.00 176.35 175.20 1y4s n ILE 120 N 5.83 0.52 0.00 -0.59 5.41 -1.26 -4.46 119.36 124.80 1y4s n ILE 120 Ca 0.14 0.17 0.00 0.00 1.00 0.00 0.00 62.75 64.06 1y4s n ILE 120 Cb 0.46 -1.54 0.00 0.00 -0.71 0.00 0.00 39.64 37.85 1y4s n ILE 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1y4s n GLY 121 N 3.21 2.30 3.07 7.39 0.00 -1.26 -4.41 105.19 115.49 1y4s n GLY 121 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 1y4s n GLY 121 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y4s s GLN 122 N 0.00 0.56 0.00 1.61 -0.21 -1.26 -5.15 119.66 115.21 1y4s s GLN 122 Ca 0.00 0.24 0.00 0.00 0.02 0.00 0.00 55.36 55.62 1y4s s GLN 122 Cb 0.00 0.02 0.00 0.00 1.00 0.00 0.00 33.01 34.03 1y4s s GLN 122 CO 0.00 -1.08 0.00 1.97 -2.12 0.00 0.00 175.29 174.06 1y4s n PHE 123 N 5.19 0.00 0.00 0.91 -1.74 -1.26 -5.02 117.46 115.54 1y4s n PHE 123 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.94 1y4s n PHE 123 Cb 0.53 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.53 1y4s n PHE 123 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1y4s n GLY 124 N 0.00 1.11 2.85 4.97 0.00 -1.26 -5.05 105.19 107.80 1y4s n GLY 124 Ca 0.00 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.63 1y4s n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y4s s VAL 125 N 1.40 0.26 0.00 1.61 1.01 -1.26 -4.99 120.40 118.43 1y4s s VAL 125 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1y4s s VAL 125 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1y4s s VAL 125 CO 0.00 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.86 1y4s n GLY 126 N 3.98 0.00 0.29 4.51 0.00 -1.26 -2.73 105.19 109.97 1y4s n GLY 126 Ca -0.25 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.86 1y4s n GLY 126 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y4s h PHE 127 N 0.00 0.28 0.00 1.61 3.57 -1.97 0.13 116.94 120.56 1y4s h PHE 127 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1y4s h PHE 127 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1y4s h PHE 127 CO 0.00 -0.15 0.00 0.66 -2.23 0.00 0.00 178.31 176.59 1y4s n TYR 128 N -5.20 0.00 -0.32 0.41 4.01 -1.11 -2.03 117.16 112.92 1y4s n TYR 128 Ca 0.17 0.00 0.21 0.00 -0.16 0.00 0.00 57.90 58.12 1y4s n TYR 128 Cb 0.56 -0.35 0.47 0.00 -0.31 0.00 0.00 39.34 39.71 1y4s n TYR 128 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1y4s h SER 129 N 0.00 0.52 -1.11 7.72 0.87 -0.68 -0.20 113.55 120.66 1y4s h SER 129 Ca 0.00 0.09 0.31 0.00 -1.23 0.00 0.00 61.79 60.96 1y4s h SER 129 Cb 0.14 0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 62.02 1y4s h SER 129 CO 0.00 0.11 0.74 0.00 -0.53 0.00 0.00 176.83 177.16 1y4s h ALA 130 N 1.64 2.54 0.00 6.23 0.00 -1.61 -1.00 119.26 127.06 1y4s h ALA 130 Ca 0.59 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.54 1y4s h ALA 130 Cb 1.37 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1y4s h ALA 130 CO -0.33 -0.95 0.00 1.19 0.00 0.00 0.00 179.25 179.16 1y4s n PHE 131 N -4.51 0.00 0.19 0.00 0.99 -0.09 -0.92 117.46 113.13 1y4s n PHE 131 Ca 0.27 0.00 0.07 0.00 -0.00 0.00 0.00 57.45 57.78 1y4s n PHE 131 Cb 1.04 -0.25 0.34 0.00 -1.00 0.00 0.00 39.48 39.61 1y4s n PHE 131 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1y4s h ILE 132 N 0.00 0.75 0.00 4.37 2.04 -1.34 -3.34 117.51 119.99 1y4s h ILE 132 Ca 0.00 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.39 1y4s h ILE 132 Cb 0.17 1.93 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1y4s h ILE 132 CO 0.00 0.33 -1.07 0.52 0.00 0.00 0.00 178.15 177.93 1y4s n VAL 133 N -3.44 0.04 -4.70 1.67 0.31 -0.98 -4.99 118.33 106.25 1y4s n VAL 133 Ca 0.00 -0.04 -0.33 0.00 -0.01 0.00 0.00 64.34 63.96 1y4s n VAL 133 Cb 0.51 -0.24 -0.12 0.00 -0.91 0.00 0.00 33.84 33.08 1y4s n VAL 133 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1y4s s ALA 134 N -2.06 2.84 -2.86 3.52 0.00 -0.10 -1.18 121.76 121.92 1y4s s ALA 134 Ca -0.01 -0.97 0.25 0.00 0.00 0.00 0.00 51.96 51.24 1y4s s ALA 134 Cb 0.01 -1.08 0.43 0.00 0.00 0.00 0.00 23.12 22.47 1y4s s ALA 134 CO 0.05 0.57 1.39 -0.40 0.00 0.00 0.00 175.76 177.38 1y4s n ASP 135 N 2.08 2.59 -3.65 0.00 5.68 -0.57 -4.31 116.55 118.36 1y4s n ASP 135 Ca -0.17 -1.86 -0.04 0.00 -0.50 0.00 0.00 54.79 52.21 1y4s n ASP 135 Cb 0.53 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.44 1y4s n ASP 135 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1y4s s LYS 136 N -2.00 0.53 -0.03 0.11 2.20 -1.23 -4.37 119.74 114.94 1y4s s LYS 136 Ca 0.31 1.28 0.05 0.00 -0.36 0.00 0.00 55.97 57.24 1y4s s LYS 136 Cb 0.20 0.57 -0.03 0.00 -1.51 0.00 0.00 37.83 37.06 1y4s s LYS 136 CO 0.31 -0.20 -0.17 0.08 -0.36 0.00 0.00 175.35 175.01 1y4s s VAL 137 N 2.52 2.87 -0.03 4.02 1.01 -0.97 -0.92 120.40 128.90 1y4s s VAL 137 Ca -0.06 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.11 1y4s s VAL 137 Cb -0.11 -2.12 -0.00 0.00 0.00 0.00 0.00 36.38 34.15 1y4s s VAL 137 CO -0.17 0.55 -0.12 -0.89 0.00 0.00 0.00 175.10 174.47 1y4s s THR 138 N -0.74 1.02 -0.00 3.92 2.01 0.09 -2.30 115.64 119.63 1y4s s THR 138 Ca 0.12 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.67 1y4s s THR 138 Cb -0.10 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 1y4s s THR 138 CO 0.01 0.30 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.40 1y4s s VAL 139 N 0.10 1.19 -0.28 3.82 1.01 -0.39 0.34 120.40 126.19 1y4s s VAL 139 Ca -0.03 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1y4s s VAL 139 Cb -0.09 -1.00 0.09 0.00 0.00 0.00 0.00 36.38 35.38 1y4s s VAL 139 CO 0.01 0.30 0.12 -0.13 0.00 0.00 0.00 175.10 175.39 1y4s s ARG 140 N -0.46 0.26 0.05 2.72 0.52 -0.47 -1.41 118.95 120.15 1y4s s ARG 140 Ca 0.05 -0.55 0.09 0.00 -0.52 0.00 0.00 55.73 54.81 1y4s s ARG 140 Cb -0.06 -1.39 -0.03 0.00 0.52 0.00 0.00 34.95 33.99 1y4s s ARG 140 CO -0.00 -0.96 -0.25 -0.08 0.02 0.00 0.00 175.30 174.03 1y4s s THR 141 N 2.03 2.27 -0.25 0.02 -1.32 -1.21 -1.86 115.64 115.32 1y4s s THR 141 Ca 0.08 -1.38 -0.01 0.00 -1.21 0.00 0.00 61.69 59.17 1y4s s THR 141 Cb -0.16 -1.90 0.07 0.00 -1.51 0.00 0.00 72.50 69.00 1y4s s THR 141 CO -0.31 0.34 0.02 -0.60 -2.21 0.00 0.00 174.62 171.86 1y4s s ARG 142 N -1.33 1.07 0.65 7.08 3.00 -0.54 0.67 118.95 129.55 1y4s s ARG 142 Ca 0.12 -0.88 -0.17 0.00 -1.00 0.00 0.00 55.73 53.81 1y4s s ARG 142 Cb -0.10 -2.32 -0.08 0.00 0.00 0.00 0.00 34.95 32.45 1y4s s ARG 142 CO 0.03 -0.73 0.38 0.00 0.00 0.00 0.00 175.30 174.98 1y4s n ALA 143 N 4.81 -1.75 -1.81 6.12 0.00 -0.26 -2.72 120.51 124.90 1y4s n ALA 143 Ca -0.08 -0.15 -0.41 0.00 0.00 0.00 0.00 53.44 52.80 1y4s n ALA 143 Cb 0.44 -1.75 -0.02 0.00 0.00 0.00 0.00 19.45 18.11 1y4s n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y4s s ALA 144 N -1.85 3.51 0.00 0.00 0.00 0.20 -3.38 121.76 120.23 1y4s s ALA 144 Ca 0.64 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.82 1y4s s ALA 144 Cb -0.40 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1y4s s ALA 144 CO 0.59 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1y4s n GLY 145 N 1.20 1.39 2.34 0.00 0.00 -1.26 -4.98 105.19 103.87 1y4s n GLY 145 Ca 0.01 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1y4s n GLY 145 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y4s n GLU 146 N 0.00 -3.61 -3.19 1.61 1.02 -1.22 -4.98 120.64 110.27 1y4s n GLU 146 Ca 0.00 -0.99 -0.39 0.00 -0.02 0.00 0.00 57.16 55.76 1y4s n GLU 146 Cb 0.00 -1.36 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 1y4s n GLU 146 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1y4s s LYS 147 N -4.26 4.33 0.00 3.49 1.02 -1.26 -4.94 119.74 118.11 1y4s s LYS 147 Ca 0.45 0.74 0.00 0.00 0.02 0.00 0.00 55.97 57.18 1y4s s LYS 147 Cb -0.08 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 33.87 1y4s s LYS 147 CO 0.38 0.33 0.26 -0.35 -0.92 0.00 0.00 175.35 175.06 1y4s n PRO 148 N 2.85 0.00 0.00 -1.68 -0.04 -1.26 0.45 135.00 135.33 1y4s n PRO 148 Ca -0.06 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.47 1y4s n PRO 148 Cb 0.51 -1.32 -0.01 0.00 -0.04 0.00 0.00 33.50 32.64 1y4s n PRO 148 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1y4s n GLU 149 N -0.73 1.81 -0.73 0.54 1.02 -1.26 -1.29 120.64 119.99 1y4s n GLU 149 Ca 0.00 -0.70 -0.02 0.00 -0.02 0.00 0.00 57.16 56.42 1y4s n GLU 149 Cb 0.00 -1.23 0.21 0.00 -0.02 0.00 0.00 31.44 30.40 1y4s n GLU 149 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1y4s n ASN 150 N -0.26 2.69 -4.75 1.62 3.02 0.17 -4.48 115.26 113.28 1y4s n ASN 150 Ca 0.06 -3.64 -0.35 0.00 -0.03 0.00 0.00 54.58 50.62 1y4s n ASN 150 Cb 0.30 -0.62 0.06 0.00 -0.61 0.00 0.00 39.78 38.92 1y4s n ASN 150 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1y4s s GLY 151 N -2.45 2.48 0.57 7.41 0.00 0.33 -4.75 107.32 110.90 1y4s s GLY 151 Ca 0.44 0.87 0.07 0.00 0.00 0.00 0.00 44.72 46.10 1y4s s GLY 151 CO 0.01 1.26 0.56 0.14 0.00 0.00 0.00 173.10 175.08 1y4s s VAL 152 N -1.89 1.78 -0.18 1.40 1.01 0.21 0.12 120.40 122.86 1y4s s VAL 152 Ca 0.74 -1.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.29 1y4s s VAL 152 Cb -0.28 -2.08 0.05 0.00 0.00 0.00 0.00 36.38 34.07 1y4s s VAL 152 CO 0.39 0.00 0.46 0.12 0.00 0.00 0.00 175.10 176.07 1y4s s PHE 153 N -2.75 -0.58 -0.06 5.22 5.36 -0.54 -3.30 117.98 121.32 1y4s s PHE 153 Ca 0.44 1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 57.71 1y4s s PHE 153 Cb -0.04 0.24 0.03 0.00 -0.34 0.00 0.00 43.02 42.92 1y4s s PHE 153 CO 0.28 -0.30 0.05 -0.46 -1.46 0.00 0.00 175.22 173.33 1y4s s TRP 154 N 0.79 0.18 0.12 10.12 -0.00 -0.50 -2.54 118.94 127.11 1y4s s TRP 154 Ca -0.04 0.11 0.08 0.00 -0.00 0.00 0.00 56.10 56.25 1y4s s TRP 154 Cb -0.05 -0.56 -0.04 0.00 -0.00 0.00 0.00 33.47 32.82 1y4s s TRP 154 CO -0.06 -0.26 -0.20 -2.00 -0.00 0.00 0.00 176.95 174.43 1y4s s GLU 155 N 2.13 1.17 -0.30 5.86 2.12 -0.36 -1.27 118.70 128.06 1y4s s GLU 155 Ca 0.05 -1.24 -0.16 0.00 0.36 0.00 0.00 54.97 53.97 1y4s s GLU 155 Cb -0.13 -1.37 0.16 0.00 0.26 0.00 0.00 34.13 33.06 1y4s s GLU 155 CO -0.04 0.30 1.02 0.45 -0.54 0.00 0.00 175.26 176.46 1y4s s SER 156 N -2.16 -0.48 0.00 -1.70 0.15 -0.97 0.10 113.70 108.64 1y4s s SER 156 Ca 0.10 0.70 0.15 0.00 0.70 0.00 0.00 55.95 57.60 1y4s s SER 156 Cb -0.09 1.39 0.92 0.00 -1.71 0.00 0.00 66.02 66.53 1y4s s SER 156 CO 0.05 -0.10 1.55 0.00 1.20 0.00 0.00 173.24 175.94 1y4s n ALA 157 N 4.27 2.54 -0.77 5.45 0.00 -1.26 -2.29 120.51 128.45 1y4s n ALA 157 Ca -0.13 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1y4s n ALA 157 Cb 0.55 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1y4s n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y4s n GLY 158 N 0.68 0.07 0.07 0.00 0.00 -1.26 -4.68 105.19 100.06 1y4s n GLY 158 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1y4s n GLY 158 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1y4s h GLU 159 N 0.19 0.07 0.00 1.61 5.08 -1.92 -3.46 114.58 116.16 1y4s h GLU 159 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1y4s h GLU 159 Cb 0.45 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1y4s h GLU 159 CO 0.00 0.38 0.00 0.41 -1.00 0.00 0.00 179.01 178.80 1y4s n GLY 160 N -0.20 0.00 3.41 -3.84 0.00 -1.26 -4.94 105.19 98.36 1y4s n GLY 160 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 1y4s n GLY 160 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1y4s s GLU 161 N -0.01 1.62 0.16 1.61 -1.05 -1.26 -1.95 118.70 117.82 1y4s s GLU 161 Ca 0.00 -1.91 -0.05 0.00 -0.15 0.00 0.00 54.97 52.86 1y4s s GLU 161 Cb 0.00 -0.57 -0.02 0.00 -0.44 0.00 0.00 34.13 33.10 1y4s s GLU 161 CO 0.00 -0.30 0.19 1.52 0.95 0.00 0.00 175.26 177.63 1y4s s TYR 162 N -3.45 0.69 0.04 4.83 -0.85 -1.06 -4.39 117.35 113.16 1y4s s TYR 162 Ca 0.35 -1.03 0.06 0.00 -0.52 0.00 0.00 57.07 55.93 1y4s s TYR 162 Cb 0.07 -0.27 -0.02 0.00 0.38 0.00 0.00 41.96 42.12 1y4s s TYR 162 CO 0.15 -0.66 -0.18 0.99 -1.52 0.00 0.00 175.55 174.33 1y4s s THR 163 N -4.03 1.44 0.11 -3.49 2.01 0.12 -1.77 115.64 110.02 1y4s s THR 163 Ca 0.24 -1.10 0.06 0.00 0.31 0.00 0.00 61.69 61.19 1y4s s THR 163 Cb 0.05 -1.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 1y4s s THR 163 CO 0.03 0.14 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.27 1y4s s VAL 164 N -0.80 1.28 -0.07 3.82 1.01 -0.78 -1.22 120.40 123.64 1y4s s VAL 164 Ca 0.05 -1.64 -0.31 0.00 0.00 0.00 0.00 61.98 60.09 1y4s s VAL 164 Cb -0.08 -1.44 0.11 0.00 0.00 0.00 0.00 36.38 34.97 1y4s s VAL 164 CO 0.01 -0.38 0.99 0.00 0.00 0.00 0.00 175.10 175.72 1y4s s ALA 165 N -1.99 -1.90 0.13 5.51 0.00 -1.05 -1.44 121.76 121.02 1y4s s ALA 165 Ca 0.07 1.23 -0.10 0.00 0.00 0.00 0.00 51.96 53.16 1y4s s ALA 165 Cb -0.06 0.15 -0.06 0.00 0.00 0.00 0.00 23.12 23.15 1y4s s ALA 165 CO 0.03 -0.62 0.45 -0.51 0.00 0.00 0.00 175.76 175.11 1y4s s ASP 166 N -2.25 6.65 0.35 0.00 1.01 -1.23 -1.47 116.67 119.72 1y4s s ASP 166 Ca 0.05 0.84 -0.08 0.00 0.71 0.00 0.00 52.55 54.08 1y4s s ASP 166 Cb -0.01 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.74 1y4s s ASP 166 CO -0.07 0.10 0.57 0.27 0.21 0.00 0.00 175.17 176.25 1y4s s ILE 167 N -1.52 0.00 0.26 0.77 -4.36 0.12 -3.28 121.20 113.19 1y4s s ILE 167 Ca 0.38 -1.40 0.08 0.00 -0.26 0.00 0.00 60.65 59.45 1y4s s ILE 167 Cb -0.13 -2.66 -0.04 0.00 1.25 0.00 0.00 42.46 40.88 1y4s s ILE 167 CO 0.20 0.00 0.15 0.28 0.24 0.00 0.00 174.94 175.80 1y4s s THR 168 N -2.95 4.08 -0.30 8.37 -1.32 -1.26 0.12 115.64 122.38 1y4s s THR 168 Ca 0.25 -1.55 -0.14 0.00 -1.21 0.00 0.00 61.69 59.04 1y4s s THR 168 Cb -0.02 -3.22 0.18 0.00 -1.51 0.00 0.00 72.50 67.92 1y4s s THR 168 CO 0.16 -0.34 1.05 -0.75 -2.21 0.00 0.00 174.62 172.53 1y4s s LYS 169 N -3.81 0.20 0.02 7.08 2.20 -0.42 -4.81 119.74 120.21 1y4s s LYS 169 Ca 0.33 0.41 -0.12 0.00 -0.36 0.00 0.00 55.97 56.23 1y4s s LYS 169 Cb -0.07 0.23 -0.06 0.00 -1.51 0.00 0.00 37.83 36.42 1y4s s LYS 169 CO 0.24 -0.17 1.18 0.93 -0.36 0.00 0.00 175.35 177.16 1y4s h GLU 170 N 7.80 -0.39 -7.04 4.03 4.39 -2.00 -3.42 114.58 117.95 1y4s h GLU 170 Ca -0.14 0.03 -0.55 0.00 0.34 0.00 0.00 59.36 59.04 1y4s h GLU 170 Cb 1.16 0.09 0.18 0.00 -0.10 0.00 0.00 28.75 30.08 1y4s h GLU 170 CO -0.03 -0.26 0.17 -0.40 -1.16 0.00 0.00 179.01 177.33 1y4s n ASP 171 N -3.15 0.63 -4.92 1.42 5.68 -1.26 -4.87 116.55 110.08 1y4s n ASP 171 Ca -0.05 0.63 -0.27 0.00 -0.50 0.00 0.00 54.79 54.59 1y4s n ASP 171 Cb 0.16 -1.44 -0.03 0.00 -1.14 0.00 0.00 41.12 38.67 1y4s n ASP 171 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1y4s s ARG 172 N -3.64 3.54 0.00 0.11 3.52 -1.26 -4.74 118.95 116.48 1y4s s ARG 172 Ca 0.73 -0.29 0.00 0.00 -0.13 0.00 0.00 55.73 56.04 1y4s s ARG 172 Cb -0.32 -2.80 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 1y4s s ARG 172 CO 0.51 0.36 0.00 0.41 -0.81 0.00 0.00 175.30 175.77 1y4s n GLY 173 N -0.75 0.37 2.94 8.12 0.00 -1.10 -4.47 105.19 110.30 1y4s n GLY 173 Ca -0.04 -2.09 -0.17 0.00 0.00 0.00 0.00 46.02 43.72 1y4s n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y4s s THR 174 N -0.27 0.44 -0.20 2.61 2.01 -0.93 -1.46 115.64 117.84 1y4s s THR 174 Ca 0.00 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.81 1y4s s THR 174 Cb 0.00 -0.41 0.05 0.00 0.01 0.00 0.00 72.50 72.15 1y4s s THR 174 CO 0.00 0.15 -0.07 -0.70 -0.69 0.00 0.00 174.62 173.30 1y4s s GLU 175 N 0.17 1.75 -0.27 4.92 2.12 -0.78 -1.87 118.70 124.75 1y4s s GLU 175 Ca -0.02 -0.77 -0.05 0.00 0.36 0.00 0.00 54.97 54.49 1y4s s GLU 175 Cb -0.06 -2.33 0.01 0.00 0.26 0.00 0.00 34.13 32.01 1y4s s GLU 175 CO -0.00 -0.47 0.02 0.42 -0.54 0.00 0.00 175.26 174.69 1y4s s ILE 176 N 1.47 3.59 -0.21 -3.70 1.01 -0.25 -1.37 121.20 121.74 1y4s s ILE 176 Ca -0.02 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.88 1y4s s ILE 176 Cb -0.17 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 1y4s s ILE 176 CO -0.08 0.19 -0.01 -0.89 0.00 0.00 0.00 174.94 174.16 1y4s s THR 177 N 1.46 3.77 -0.19 2.92 2.01 0.15 -1.12 115.64 124.64 1y4s s THR 177 Ca 0.03 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 61.60 1y4s s THR 177 Cb -0.16 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.59 1y4s s THR 177 CO -0.00 0.41 0.04 -0.76 -0.69 0.00 0.00 174.62 173.62 1y4s s LEU 178 N 1.28 3.61 -0.60 4.42 1.02 0.13 -0.74 118.68 127.81 1y4s s LEU 178 Ca 0.04 -0.02 -0.17 0.00 0.02 0.00 0.00 54.13 54.00 1y4s s LEU 178 Cb -0.15 -1.92 0.13 0.00 0.02 0.00 0.00 46.19 44.28 1y4s s LEU 178 CO 0.00 0.13 0.60 -2.28 0.02 0.00 0.00 176.35 174.82 1y4s s HIS 179 N 0.62 3.25 0.29 0.29 5.65 -0.10 -2.09 115.29 123.21 1y4s s HIS 179 Ca 0.02 -1.30 -0.29 0.00 0.25 0.00 0.00 55.06 53.74 1y4s s HIS 179 Cb -0.13 -3.87 -0.13 0.00 -1.18 0.00 0.00 32.58 27.27 1y4s s HIS 179 CO 0.02 -1.09 1.15 1.28 -0.65 0.00 0.00 174.74 175.45 1y4s n LEU 180 N 5.38 2.50 -4.55 8.88 4.77 -0.81 -1.52 117.00 131.65 1y4s n LEU 180 Ca -0.09 1.18 -0.31 0.00 -0.03 0.00 0.00 56.01 56.77 1y4s n LEU 180 Cb 0.42 -1.36 0.26 0.00 -2.33 0.00 0.00 43.42 40.40 1y4s n LEU 180 CO 0.52 -0.99 0.60 -0.13 -1.33 0.00 0.00 177.39 176.06 1y4s s ARG 181 N -1.46 -1.74 -0.30 3.23 0.52 -0.33 -4.70 118.95 114.16 1y4s s ARG 181 Ca 0.59 -0.19 -0.19 0.00 -0.52 0.00 0.00 55.73 55.42 1y4s s ARG 181 Cb -0.66 -1.55 -0.01 0.00 0.52 0.00 0.00 34.95 33.25 1y4s s ARG 181 CO 0.59 -4.03 0.57 -1.21 0.02 0.00 0.00 175.30 171.24 1y4s s GLU 182 N -5.49 3.90 0.00 3.54 2.02 -1.26 -3.70 118.70 117.71 1y4s s GLU 182 Ca 0.72 0.21 0.00 0.00 0.02 0.00 0.00 54.97 55.92 1y4s s GLU 182 Cb -0.08 -3.72 0.00 0.00 0.10 0.00 0.00 34.13 30.43 1y4s s GLU 182 CO 0.56 -0.51 0.00 0.41 0.02 0.00 0.00 175.26 175.74 1y4s n GLY 183 N 4.50 1.34 0.19 -1.39 0.00 -1.26 -5.00 105.19 103.56 1y4s n GLY 183 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1y4s n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y4s n GLU 184 N -0.17 0.26 0.00 1.61 -0.58 -1.24 -4.84 120.64 115.68 1y4s n GLU 184 Ca 0.00 -0.85 0.00 0.00 -0.42 0.00 0.00 57.16 55.89 1y4s n GLU 184 Cb 0.00 -0.58 0.00 0.00 -0.57 0.00 0.00 31.44 30.29 1y4s n GLU 184 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1y4s n ASP 185 N -0.10 0.00 0.01 1.62 8.00 -1.26 -1.93 116.55 122.88 1y4s n ASP 185 Ca 0.01 0.18 -0.12 0.00 0.71 0.00 0.00 54.79 55.56 1y4s n ASP 185 Cb 0.56 -0.18 -0.07 0.00 -0.02 0.00 0.00 41.12 41.41 1y4s n ASP 185 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1y4s h GLU 186 N 0.00 0.06 -0.21 -1.24 5.08 -1.98 -2.72 114.58 113.57 1y4s h GLU 186 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1y4s h GLU 186 Cb 0.05 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1y4s h GLU 186 CO 0.00 0.20 0.00 1.19 -1.00 0.00 0.00 179.01 179.40 1y4s n PHE 187 N -4.98 0.00 -1.15 4.33 3.01 -0.81 -1.29 117.46 116.57 1y4s n PHE 187 Ca -0.07 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.49 1y4s n PHE 187 Cb 0.10 -0.02 0.15 0.00 -0.01 0.00 0.00 39.48 39.70 1y4s n PHE 187 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1y4s n LEU 188 N -0.10 2.41 -4.24 4.37 4.77 -1.02 -4.87 117.00 118.31 1y4s n LEU 188 Ca 0.00 -3.22 -0.32 0.00 -0.03 0.00 0.00 56.01 52.44 1y4s n LEU 188 Cb 0.05 -0.45 -0.16 0.00 -2.33 0.00 0.00 43.42 40.53 1y4s n LEU 188 CO 0.00 0.82 -0.53 -0.62 -1.33 0.00 0.00 177.39 175.73 1y4s s ASP 189 N -2.93 3.32 0.13 -1.43 2.15 -0.41 -4.85 116.67 112.65 1y4s s ASP 189 Ca 0.33 -0.52 -0.27 0.00 0.43 0.00 0.00 52.55 52.53 1y4s s ASP 189 Cb 0.29 -1.47 -0.05 0.00 -0.30 0.00 0.00 42.92 41.40 1y4s s ASP 189 CO 0.01 0.14 1.62 -0.78 -0.17 0.00 0.00 175.17 175.99 1y4s h ASP 190 N 6.87 -0.91 -0.56 -0.34 1.82 -1.93 -1.83 116.42 119.53 1y4s h ASP 190 Ca -0.24 0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.53 1y4s h ASP 190 Cb 1.22 0.37 -0.03 0.00 0.68 0.00 0.00 39.33 41.58 1y4s h ASP 190 CO 0.51 -0.36 0.37 -0.25 -1.61 0.00 0.00 179.24 177.89 1y4s h TRP 191 N -0.44 0.71 0.83 0.28 -0.00 -1.96 0.12 115.95 115.48 1y4s h TRP 191 Ca 0.07 0.01 -0.04 0.00 -0.00 0.00 0.00 58.89 58.93 1y4s h TRP 191 Cb 0.54 -0.24 0.00 0.00 -0.00 0.00 0.00 29.16 29.46 1y4s h TRP 191 CO -0.34 0.45 -0.44 -0.09 -0.00 0.00 0.00 178.44 178.02 1y4s h ARG 192 N 0.76 -1.13 -0.09 2.65 9.65 -1.80 0.38 114.38 124.80 1y4s h ARG 192 Ca 0.20 0.08 0.00 0.00 -1.10 0.00 0.00 59.98 59.16 1y4s h ARG 192 Cb -0.08 0.26 -0.00 0.00 -1.39 0.00 0.00 29.97 28.75 1y4s h ARG 192 CO -0.04 -0.75 0.06 0.28 2.80 0.00 0.00 179.97 182.31 1y4s h VAL 193 N -1.17 1.02 -0.64 0.20 2.07 -1.35 -1.01 116.25 115.36 1y4s h VAL 193 Ca -0.11 -0.04 0.12 0.00 0.82 0.00 0.00 66.70 67.49 1y4s h VAL 193 Cb 0.92 0.89 -0.09 0.00 -1.52 0.00 0.00 31.29 31.49 1y4s h VAL 193 CO 0.16 0.02 0.19 -0.09 0.02 0.00 0.00 177.57 177.87 1y4s h ARG 194 N 0.12 0.32 -0.24 1.57 9.65 -0.71 0.06 114.38 125.15 1y4s h ARG 194 Ca 0.03 -0.02 0.02 0.00 -1.10 0.00 0.00 59.98 58.92 1y4s h ARG 194 Cb -0.01 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 1y4s h ARG 194 CO -0.01 0.21 0.09 1.03 2.80 0.00 0.00 179.97 184.09 1y4s h SER 195 N 0.33 0.10 -0.18 -3.80 0.87 0.28 -1.09 113.55 110.06 1y4s h SER 195 Ca 0.34 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.91 1y4s h SER 195 Cb 0.49 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1y4s h SER 195 CO -0.39 0.09 0.07 0.40 -0.53 0.00 0.00 176.83 176.48 1y4s h ILE 196 N 0.20 1.16 -0.06 2.23 2.04 0.15 0.02 117.51 123.25 1y4s h ILE 196 Ca 0.10 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 1y4s h ILE 196 Cb 0.06 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1y4s h ILE 196 CO -0.10 0.15 -0.16 0.40 0.00 0.00 0.00 178.15 178.44 1y4s h ILE 197 N 0.13 1.15 0.72 -0.67 2.04 -0.99 0.32 117.51 120.21 1y4s h ILE 197 Ca 0.06 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 1y4s h ILE 197 Cb 0.17 1.29 0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1y4s h ILE 197 CO -0.01 0.20 -0.35 -1.28 0.00 0.00 0.00 178.15 176.72 1y4s h SER 198 N 0.09 -0.82 -0.95 1.72 0.87 -0.90 -2.79 113.55 110.78 1y4s h SER 198 Ca 0.02 0.02 0.10 0.00 -1.23 0.00 0.00 61.79 60.69 1y4s h SER 198 Cb 0.34 0.21 -0.08 0.00 -0.44 0.00 0.00 62.40 62.44 1y4s h SER 198 CO 0.02 -0.45 0.58 0.50 -0.53 0.00 0.00 176.83 176.96 1y4s h LYS 199 N -1.23 0.94 -0.68 2.24 3.64 -0.48 -2.86 116.57 118.14 1y4s h LYS 199 Ca -0.10 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1y4s h LYS 199 Cb 0.75 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1y4s h LYS 199 CO 0.16 0.62 0.00 0.66 -2.27 0.00 0.00 179.45 178.63 1y4s n TYR 200 N -4.63 1.45 -3.30 1.91 0.53 0.11 -4.75 117.16 108.47 1y4s n TYR 200 Ca 0.16 -0.51 -0.10 0.00 -1.02 0.00 0.00 57.90 56.43 1y4s n TYR 200 Cb 0.29 -0.36 -0.05 0.00 -1.03 0.00 0.00 39.34 38.18 1y4s n TYR 200 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1y4s s SER 201 N -0.61 0.22 0.00 7.72 1.04 -1.05 -4.85 113.70 116.17 1y4s s SER 201 Ca 0.39 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1y4s s SER 201 Cb 0.29 1.08 0.00 0.00 0.10 0.00 0.00 66.02 67.49 1y4s s SER 201 CO 0.13 -0.25 0.00 0.47 0.98 0.00 0.00 173.24 174.57 1y4s n ASP 202 N 4.52 0.00 0.04 7.02 8.00 -1.26 -4.62 116.55 130.25 1y4s n ASP 202 Ca 0.09 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.71 1y4s n ASP 202 Cb 0.49 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.08 1y4s n ASP 202 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1y4s n HIS 203 N -0.72 0.36 -3.40 1.24 1.44 -1.26 -4.63 115.22 108.25 1y4s n HIS 203 Ca 0.00 0.11 -0.40 0.00 -2.01 0.00 0.00 57.72 55.42 1y4s n HIS 203 Cb 0.00 -0.69 -0.09 0.00 0.12 0.00 0.00 29.99 29.33 1y4s n HIS 203 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1y4s s ILE 204 N -3.07 5.17 0.35 0.61 1.01 -1.26 -4.14 121.20 119.86 1y4s s ILE 204 Ca 0.11 0.23 0.04 0.00 0.00 0.00 0.00 60.65 61.02 1y4s s ILE 204 Cb 0.14 -3.78 0.20 0.00 0.01 0.00 0.00 42.46 39.04 1y4s s ILE 204 CO 0.49 -0.01 1.93 0.00 0.00 0.00 0.00 174.94 177.35 1y4s h ALA 205 N 8.37 1.45 -2.52 9.38 0.00 -1.87 -3.36 119.26 130.71 1y4s h ALA 205 Ca -0.31 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 53.94 1y4s h ALA 205 Cb 1.15 -0.18 0.04 0.00 0.00 0.00 0.00 17.79 18.80 1y4s h ALA 205 CO 0.67 0.42 1.09 -1.17 0.00 0.00 0.00 179.25 180.26 1y4s s LEU 206 N -9.31 4.39 0.29 0.00 2.96 -1.26 -4.18 118.68 111.57 1y4s s LEU 206 Ca -0.08 2.75 -0.30 0.00 -0.22 0.00 0.00 54.13 56.28 1y4s s LEU 206 Cb 0.16 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 43.17 1y4s s LEU 206 CO 0.76 -0.99 1.51 -2.84 -1.32 0.00 0.00 176.35 173.47 1y4s s PRO 207 N 2.55 4.19 -0.37 0.98 0.02 -1.26 -4.82 135.00 136.28 1y4s s PRO 207 Ca 0.80 2.46 -0.00 0.00 0.02 0.00 0.00 61.00 64.27 1y4s s PRO 207 Cb -0.46 -3.05 0.10 0.00 0.02 0.00 0.00 34.50 31.11 1y4s s PRO 207 CO 0.36 -0.51 0.13 0.08 -0.33 0.00 0.00 177.00 176.72 1y4s s VAL 208 N -0.24 2.87 0.58 3.83 1.01 -1.26 -1.61 120.40 125.58 1y4s s VAL 208 Ca 0.59 -2.13 -0.05 0.00 0.00 0.00 0.00 61.98 60.39 1y4s s VAL 208 Cb -0.45 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 32.94 1y4s s VAL 208 CO 0.49 -0.62 0.88 -1.61 0.00 0.00 0.00 175.10 174.24 1y4s s GLU 209 N 1.05 2.91 -0.04 2.72 2.02 -0.11 -1.63 118.70 125.62 1y4s s GLU 209 Ca 0.08 -0.07 -0.02 0.00 0.02 0.00 0.00 54.97 54.99 1y4s s GLU 209 Cb -0.21 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 31.74 1y4s s GLU 209 CO -0.06 -0.68 0.08 -1.50 0.02 0.00 0.00 175.26 173.13 1y4s s ILE 210 N -2.95 -0.03 0.11 -1.63 2.07 -0.64 -2.79 121.20 115.33 1y4s s ILE 210 Ca 0.54 0.12 -0.31 0.00 -1.41 0.00 0.00 60.65 59.59 1y4s s ILE 210 Cb -0.10 -0.14 -0.10 0.00 0.13 0.00 0.00 42.46 42.24 1y4s s ILE 210 CO 0.44 0.05 1.86 -0.70 -1.91 0.00 0.00 174.94 174.68 1y4s s GLU 211 N 0.70 4.14 -0.13 3.50 2.12 0.74 -2.99 118.70 126.78 1y4s s GLU 211 Ca -0.06 2.61 0.01 0.00 0.36 0.00 0.00 54.97 57.89 1y4s s GLU 211 Cb -0.08 -3.69 -0.01 0.00 0.26 0.00 0.00 34.13 30.62 1y4s s GLU 211 CO -0.03 -0.86 -0.16 0.21 -0.54 0.00 0.00 175.26 173.87 1y4s s LYS 212 N 3.02 3.24 -0.11 4.30 2.20 -1.06 -4.95 119.74 126.38 1y4s s LYS 212 Ca 0.82 -0.75 0.01 0.00 -0.36 0.00 0.00 55.97 55.69 1y4s s LYS 212 Cb -0.46 -2.56 -0.01 0.00 -1.51 0.00 0.00 37.83 33.29 1y4s s LYS 212 CO 0.37 0.12 -0.16 1.03 -0.36 0.00 0.00 175.35 176.36 1y4s s ARG 213 N 0.55 3.16 0.01 4.03 0.52 -1.26 -0.87 118.95 125.09 1y4s s ARG 213 Ca -0.10 -0.73 0.02 0.00 -0.52 0.00 0.00 55.73 54.40 1y4s s ARG 213 Cb -0.16 -2.51 -0.01 0.00 0.52 0.00 0.00 34.95 32.78 1y4s s ARG 213 CO 0.04 0.28 -0.07 -2.00 0.02 0.00 0.00 175.30 173.56 1y4s s GLU 214 N 0.16 0.55 -0.89 3.54 2.56 -0.15 -5.02 118.70 119.45 1y4s s GLU 214 Ca -0.09 -0.40 -0.10 0.00 0.00 0.00 0.00 54.97 54.38 1y4s s GLU 214 Cb -0.15 -0.48 0.23 0.00 2.00 0.00 0.00 34.13 35.73 1y4s s GLU 214 CO 0.05 0.12 0.83 -2.00 -0.56 0.00 0.00 175.26 173.71 1y4s s GLU 215 N -0.58 3.64 -1.10 4.30 2.12 -1.26 -1.08 118.70 124.74 1y4s s GLU 215 Ca -0.01 -2.76 -0.05 0.00 0.36 0.00 0.00 54.97 52.52 1y4s s GLU 215 Cb -0.05 -4.35 0.30 0.00 0.26 0.00 0.00 34.13 30.29 1y4s s GLU 215 CO 0.00 -1.26 1.52 1.63 -0.54 0.00 0.00 175.26 176.61 1y4s n LYS 216 N 3.42 4.41 0.00 4.30 5.02 -1.26 -5.01 118.16 129.04 1y4s n LYS 216 Ca 0.17 -4.47 0.00 0.00 -2.02 0.00 0.00 58.31 51.98 1y4s n LYS 216 Cb 0.43 -2.55 0.00 0.00 -0.02 0.00 0.00 35.03 32.89 1y4s n LYS 216 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1y4s n ASP 217 N 1.53 -1.15 0.00 4.39 8.00 -1.26 -4.76 116.55 123.30 1y4s n ASP 217 Ca 0.27 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1y4s n ASP 217 Cb 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 1y4s n ASP 217 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y4s n GLY 218 N 0.00 0.00 0.00 0.44 0.00 -1.26 -4.44 105.19 99.93 1y4s n GLY 218 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1y4s n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y4s n GLU 219 N 0.00 2.08 -4.31 1.61 1.02 -1.26 -5.08 120.64 114.69 1y4s n GLU 219 Ca 0.00 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.86 1y4s n GLU 219 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.32 1y4s n GLU 219 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1y4s s THR 220 N 0.06 2.97 -0.35 2.62 2.01 -1.26 -4.64 115.64 117.05 1y4s s THR 220 Ca 0.00 -1.64 0.02 0.00 0.31 0.00 0.00 61.69 60.39 1y4s s THR 220 Cb 0.00 -2.42 0.10 0.00 0.01 0.00 0.00 72.50 70.18 1y4s s THR 220 CO 0.00 -0.03 0.07 -0.69 -0.69 0.00 0.00 174.62 173.28 1y4s s VAL 221 N -1.48 2.51 0.07 3.82 1.01 -0.24 -4.95 120.40 121.13 1y4s s VAL 221 Ca 0.22 -2.19 -0.10 0.00 0.00 0.00 0.00 61.98 59.91 1y4s s VAL 221 Cb -0.09 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 1y4s s VAL 221 CO 0.13 -0.55 0.39 -0.63 0.00 0.00 0.00 175.10 174.43 1y4s s ILE 222 N 0.98 5.11 0.11 2.22 1.01 -1.26 -0.97 121.20 128.39 1y4s s ILE 222 Ca 0.08 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.17 1y4s s ILE 222 Cb -0.20 -3.64 -0.00 0.00 0.01 0.00 0.00 42.46 38.63 1y4s s ILE 222 CO -0.07 0.31 0.13 -1.20 0.00 0.00 0.00 174.94 174.11 1y4s n SER 223 N 0.96 -0.35 -3.19 3.58 7.64 -0.05 -5.00 113.62 117.20 1y4s n SER 223 Ca -0.09 -1.62 0.01 0.00 1.01 0.00 0.00 58.87 58.18 1y4s n SER 223 Cb 0.52 0.70 -0.01 0.00 -1.01 0.00 0.00 64.21 64.41 1y4s n SER 223 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1y4s s TRP 224 N -3.68 -1.72 0.09 1.43 0.52 -1.26 -2.58 118.94 111.74 1y4s s TRP 224 Ca 0.10 0.24 -0.19 0.00 0.02 0.00 0.00 56.10 56.27 1y4s s TRP 224 Cb 0.00 0.32 -0.07 0.00 -1.15 0.00 0.00 33.47 32.57 1y4s s TRP 224 CO 0.07 -1.17 0.58 -1.83 0.02 0.00 0.00 176.95 174.62 1y4s s GLU 225 N 1.83 4.18 0.17 4.98 -1.05 -1.16 -4.68 118.70 122.97 1y4s s GLU 225 Ca 0.16 0.72 -0.23 0.00 -0.15 0.00 0.00 54.97 55.48 1y4s s GLU 225 Cb -0.04 -3.18 -0.08 0.00 -0.44 0.00 0.00 34.13 30.39 1y4s s GLU 225 CO -0.07 0.60 0.74 -1.59 0.95 0.00 0.00 175.26 175.89 1y4s s LYS 226 N -1.27 4.43 -0.02 -4.83 -2.85 -1.26 -1.63 119.74 112.32 1y4s s LYS 226 Ca 0.31 1.03 0.22 0.00 -1.00 0.00 0.00 55.97 56.52 1y4s s LYS 226 Cb -0.19 -3.15 -0.32 0.00 -2.06 0.00 0.00 37.83 32.11 1y4s s LYS 226 CO 0.19 0.53 0.57 -0.89 0.10 0.00 0.00 175.35 175.85 1y4s n ILE 227 N 1.37 0.00 -2.90 3.79 5.41 -0.65 -4.95 119.36 121.43 1y4s n ILE 227 Ca -0.05 -0.39 -0.36 0.00 1.00 0.00 0.00 62.75 62.94 1y4s n ILE 227 Cb 0.50 0.21 -0.06 0.00 -0.71 0.00 0.00 39.64 39.58 1y4s n ILE 227 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1y4s s ASN 228 N -4.19 7.19 -0.08 4.38 2.47 -1.21 -4.93 114.94 118.57 1y4s s ASN 228 Ca -0.05 1.67 -0.13 0.00 0.42 0.00 0.00 52.86 54.77 1y4s s ASN 228 Cb 0.14 -2.52 -0.29 0.00 -1.45 0.00 0.00 41.25 37.14 1y4s s ASN 228 CO 0.90 -0.07 0.60 0.50 -3.72 0.00 0.00 177.10 175.31 1y4s h LYS 229 N 3.10 0.32 -3.15 0.43 3.64 -1.90 -3.44 116.57 115.57 1y4s h LYS 229 Ca -0.47 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 58.36 1y4s h LYS 229 Cb 1.19 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 33.20 1y4s h LYS 229 CO 0.65 1.26 -0.39 0.00 -2.27 0.00 0.00 179.45 178.70 1y4s n ALA 230 N -2.92 -2.90 -3.21 5.00 0.00 -1.26 -5.03 120.51 110.19 1y4s n ALA 230 Ca -0.25 0.40 0.04 0.00 0.00 0.00 0.00 53.44 53.62 1y4s n ALA 230 Cb 0.99 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 19.54 1y4s n ALA 230 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y4s s GLN 231 N -1.31 0.13 -0.34 0.00 -0.21 -1.26 -4.97 119.66 111.71 1y4s s GLN 231 Ca -0.04 0.28 -0.42 0.00 0.02 0.00 0.00 55.36 55.21 1y4s s GLN 231 Cb 0.00 0.16 -0.16 0.00 1.00 0.00 0.00 33.01 34.01 1y4s s GLN 231 CO 0.10 -0.09 1.74 0.00 -2.12 0.00 0.00 175.29 174.92 1y4s n ALA 232 N 5.07 -0.37 -0.15 6.09 0.00 -1.26 -4.45 120.51 125.44 1y4s n ALA 232 Ca -0.08 0.39 -0.05 0.00 0.00 0.00 0.00 53.44 53.71 1y4s n ALA 232 Cb 0.54 -2.17 0.02 0.00 0.00 0.00 0.00 19.45 17.84 1y4s n ALA 232 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1y4s h LEU 233 N 7.01 -0.74 0.00 0.00 5.85 -1.86 -0.59 115.31 124.97 1y4s h LEU 233 Ca -0.44 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1y4s h LEU 233 Cb 1.33 0.40 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1y4s h LEU 233 CO 0.97 -0.24 0.00 -2.67 -0.34 0.00 0.00 178.44 176.16 1y4s n TRP 234 N -5.40 0.00 -0.06 1.25 2.14 -1.26 -2.68 117.44 111.42 1y4s n TRP 234 Ca 0.03 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.40 1y4s n TRP 234 Cb 0.31 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 30.68 1y4s n TRP 234 CO 0.00 0.00 0.00 1.15 2.07 0.00 0.00 177.69 180.91 1y4s h THR 235 N 0.00 1.01 -3.95 -1.67 2.02 -1.44 -3.48 112.91 105.40 1y4s h THR 235 Ca 0.00 -2.26 -0.48 0.00 0.77 0.00 0.00 66.41 64.43 1y4s h THR 235 Cb 0.00 2.50 0.17 0.00 -1.74 0.00 0.00 68.15 69.08 1y4s h THR 235 CO 0.00 0.50 0.19 -0.13 0.37 0.00 0.00 175.52 176.45 1y4s s ARG 236 N -2.39 0.75 -0.15 6.66 0.52 -1.09 -4.98 118.95 118.27 1y4s s ARG 236 Ca -0.25 1.01 -0.29 0.00 -0.52 0.00 0.00 55.73 55.69 1y4s s ARG 236 Cb 0.05 -1.74 -0.01 0.00 0.52 0.00 0.00 34.95 33.77 1y4s s ARG 236 CO 0.66 -2.64 0.98 -0.80 0.02 0.00 0.00 175.30 173.52 1y4s s ASN 237 N -3.04 7.15 0.24 0.23 0.01 -1.26 -4.94 114.94 113.33 1y4s s ASN 237 Ca 0.65 1.42 0.10 0.00 -0.71 0.00 0.00 52.86 54.33 1y4s s ASN 237 Cb -0.21 -2.53 0.79 0.00 0.41 0.00 0.00 41.25 39.71 1y4s s ASN 237 CO 0.59 -0.49 1.07 0.29 -1.51 0.00 0.00 177.10 177.05 1y4s n LYS 238 N 5.36 -0.05 -0.07 -0.60 5.02 -1.26 0.94 118.16 127.51 1y4s n LYS 238 Ca 0.09 0.96 0.25 0.00 -2.02 0.00 0.00 58.31 57.59 1y4s n LYS 238 Cb 0.48 -1.66 0.71 0.00 -0.02 0.00 0.00 35.03 34.53 1y4s n LYS 238 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1y4s h SER 239 N 0.00 0.00 0.00 4.39 0.02 -2.02 -2.19 113.55 113.75 1y4s h SER 239 Ca 0.53 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.44 1y4s h SER 239 Cb 1.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1y4s h SER 239 CO -0.56 0.00 -1.68 -0.62 -1.14 0.00 0.00 176.83 172.83 1y4s n GLU 240 N -3.87 0.62 -2.69 3.45 1.02 0.27 -4.95 120.64 114.49 1y4s n GLU 240 Ca 0.14 -0.11 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 1y4s n GLU 240 Cb 0.89 -1.33 -0.02 0.00 -0.02 0.00 0.00 31.44 30.95 1y4s n GLU 240 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1y4s s ILE 241 N -2.89 4.72 0.65 -3.67 1.01 -0.82 -5.03 121.20 115.16 1y4s s ILE 241 Ca -0.05 1.98 -0.09 0.00 0.00 0.00 0.00 60.65 62.49 1y4s s ILE 241 Cb 0.08 -4.29 0.01 0.00 0.01 0.00 0.00 42.46 38.28 1y4s s ILE 241 CO 0.58 -0.13 0.99 0.42 0.00 0.00 0.00 174.94 176.80 1y4s s THR 242 N 2.94 3.58 0.39 2.92 -4.23 -1.26 -4.92 115.64 115.06 1y4s s THR 242 Ca 0.44 0.23 0.09 0.00 -1.18 0.00 0.00 61.69 61.27 1y4s s THR 242 Cb -0.16 -3.47 0.17 0.00 1.34 0.00 0.00 72.50 70.39 1y4s s THR 242 CO 0.08 -0.54 1.93 0.44 -0.54 0.00 0.00 174.62 175.99 1y4s h ASP 243 N -0.40 0.26 0.20 3.99 3.32 -1.97 -1.32 116.42 120.49 1y4s h ASP 243 Ca -0.45 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 1y4s h ASP 243 Cb 1.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1y4s h ASP 243 CO 0.62 0.38 -0.14 -0.08 -1.72 0.00 0.00 179.24 178.31 1y4s h GLU 244 N 0.27 -0.32 -0.48 3.56 4.81 -2.00 -0.12 114.58 120.29 1y4s h GLU 244 Ca 0.06 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1y4s h GLU 244 Cb 0.32 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1y4s h GLU 244 CO 0.02 -0.21 0.25 0.93 -0.73 0.00 0.00 179.01 179.26 1y4s h GLU 245 N -0.33 0.66 -0.03 1.92 5.08 -1.85 -2.06 114.58 117.97 1y4s h GLU 245 Ca -0.01 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1y4s h GLU 245 Cb 0.29 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1y4s h GLU 245 CO 0.00 0.50 -0.54 1.88 -1.00 0.00 0.00 179.01 179.85 1y4s h TYR 246 N 0.67 0.11 0.02 4.33 -1.99 -0.72 -2.66 116.97 116.73 1y4s h TYR 246 Ca 0.17 -0.04 -0.03 0.00 2.00 0.00 0.00 58.73 60.84 1y4s h TYR 246 Cb 0.04 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.75 1y4s h TYR 246 CO 0.00 0.61 -0.12 0.87 -0.00 0.00 0.00 178.16 179.53 1y4s h LYS 247 N 0.07 0.05 -0.74 4.88 1.57 -0.47 -3.07 116.57 118.86 1y4s h LYS 247 Ca -0.00 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1y4s h LYS 247 Cb 0.98 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 1y4s h LYS 247 CO 0.08 1.00 0.25 0.93 -0.57 0.00 0.00 179.45 181.13 1y4s h GLU 248 N -0.87 1.13 -0.65 3.15 4.39 -1.49 -1.76 114.58 118.48 1y4s h GLU 248 Ca -0.02 -0.23 0.08 0.00 0.34 0.00 0.00 59.36 59.53 1y4s h GLU 248 Cb 1.06 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.50 1y4s h GLU 248 CO 0.02 0.95 0.43 0.35 -1.16 0.00 0.00 179.01 179.60 1y4s h PHE 249 N 1.09 0.58 -0.02 4.33 3.57 -1.59 0.10 116.94 125.00 1y4s h PHE 249 Ca 0.24 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1y4s h PHE 249 Cb 0.28 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1y4s h PHE 249 CO 0.02 0.29 0.00 -0.92 -2.23 0.00 0.00 178.31 175.48 1y4s h TYR 250 N 0.56 0.04 -0.64 0.41 3.20 -1.23 -2.22 116.97 117.09 1y4s h TYR 250 Ca 0.29 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.29 1y4s h TYR 250 Cb 0.42 -0.01 -0.11 0.00 1.54 0.00 0.00 36.73 38.57 1y4s h TYR 250 CO -0.00 0.27 0.02 0.87 -1.64 0.00 0.00 178.16 177.68 1y4s h LYS 251 N -0.20 0.13 0.05 1.82 1.57 -0.59 0.15 116.57 119.50 1y4s h LYS 251 Ca 0.01 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1y4s h LYS 251 Cb 0.25 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 1y4s h LYS 251 CO 0.00 0.08 -0.50 1.25 -0.57 0.00 0.00 179.45 179.71 1y4s h HIS 252 N 0.13 -1.46 0.00 -1.35 2.76 -0.52 0.17 115.15 114.88 1y4s h HIS 252 Ca 0.34 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 1y4s h HIS 252 Cb 0.55 0.63 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1y4s h HIS 252 CO -0.36 -0.57 0.00 -0.84 -1.30 0.00 0.00 177.93 174.86 1y4s h ILE 253 N -0.69 0.00 0.00 6.26 3.07 -0.80 -3.26 117.51 122.09 1y4s h ILE 253 Ca 0.01 -0.67 0.00 0.00 1.55 0.00 0.00 64.86 65.76 1y4s h ILE 253 Cb 0.73 1.63 0.00 0.00 -0.27 0.00 0.00 36.82 38.91 1y4s h ILE 253 CO -0.32 0.00 -1.15 0.00 -1.05 0.00 0.00 178.15 175.64 1y4s n ALA 254 N -2.00 3.28 -3.48 0.16 0.00 0.48 -4.92 120.51 114.03 1y4s n ALA 254 Ca 0.03 -0.41 -0.20 0.00 0.00 0.00 0.00 53.44 52.86 1y4s n ALA 254 Cb 0.41 -0.95 0.06 0.00 0.00 0.00 0.00 19.45 18.97 1y4s n ALA 254 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1y4s n HIS 255 N -2.06 -2.17 -3.81 0.00 8.25 0.56 -5.01 115.22 110.98 1y4s n HIS 255 Ca 0.01 0.80 -0.13 0.00 -0.26 0.00 0.00 57.72 58.14 1y4s n HIS 255 Cb 0.46 -4.28 -0.12 0.00 1.12 0.00 0.00 29.99 27.17 1y4s n HIS 255 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1y4s s ASP 256 N -3.86 -0.19 0.12 0.41 2.15 -1.17 -4.99 116.67 109.14 1y4s s ASP 256 Ca 0.25 0.36 -0.15 0.00 0.43 0.00 0.00 52.55 53.44 1y4s s ASP 256 Cb -0.05 0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.90 1y4s s ASP 256 CO 0.78 -0.06 1.54 0.15 -0.17 0.00 0.00 175.17 177.41 1y4s h PHE 257 N 5.89 0.76 -3.40 -5.34 3.57 -1.94 -3.42 116.94 113.06 1y4s h PHE 257 Ca -0.26 -0.15 -0.43 0.00 3.53 0.00 0.00 57.97 60.67 1y4s h PHE 257 Cb 1.20 -0.19 0.20 0.00 2.79 0.00 0.00 35.95 39.94 1y4s h PHE 257 CO 0.40 0.80 0.05 -0.80 -2.23 0.00 0.00 178.31 176.54 1y4s s ASN 258 N -6.24 1.15 0.51 0.41 0.01 -1.26 -5.02 114.94 104.50 1y4s s ASN 258 Ca -0.13 1.26 0.04 0.00 -0.71 0.00 0.00 52.86 53.33 1y4s s ASN 258 Cb 0.10 -1.95 0.03 0.00 0.41 0.00 0.00 41.25 39.83 1y4s s ASN 258 CO 0.79 -4.06 0.71 -1.81 -1.51 0.00 0.00 177.10 171.22 1y4s s ASP 259 N -2.94 5.36 0.36 -1.22 1.01 -1.26 -4.73 116.67 113.24 1y4s s ASP 259 Ca 0.68 -0.24 0.07 0.00 0.71 0.00 0.00 52.55 53.77 1y4s s ASP 259 Cb -0.21 -0.67 -0.00 0.00 1.01 0.00 0.00 42.92 43.04 1y4s s ASP 259 CO 0.62 -1.05 0.49 -2.16 0.21 0.00 0.00 175.17 173.27 1y4s s PRO 260 N -4.62 3.04 -0.10 8.23 0.04 -1.26 -4.06 135.00 136.27 1y4s s PRO 260 Ca 0.57 -1.07 -0.11 0.00 0.04 0.00 0.00 61.00 60.43 1y4s s PRO 260 Cb -0.10 -2.80 -0.27 0.00 0.04 0.00 0.00 34.50 31.37 1y4s s PRO 260 CO 0.37 -0.02 0.49 -0.07 0.04 0.00 0.00 177.00 177.81 1y4s h LEU 261 N 0.84 0.45 0.00 -3.56 3.38 0.20 -3.47 115.31 113.14 1y4s h LEU 261 Ca -0.44 -0.91 -0.06 0.00 0.09 0.00 0.00 57.88 56.56 1y4s h LEU 261 Cb 1.26 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1y4s h LEU 261 CO 0.51 1.77 0.21 0.35 0.09 0.00 0.00 178.44 181.38 1y4s n THR 262 N -3.66 0.00 -3.56 0.22 -2.24 -1.23 -5.05 114.28 98.76 1y4s n THR 262 Ca -0.28 -1.03 -0.16 0.00 -2.27 0.00 0.00 64.05 60.30 1y4s n THR 262 Cb 1.01 0.95 -0.06 0.00 -2.10 0.00 0.00 70.33 70.13 1y4s n THR 262 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1y4s s TRP 263 N -2.57 -0.53 -0.38 4.78 -2.14 -1.26 -2.54 118.94 114.30 1y4s s TRP 263 Ca 0.17 0.79 0.02 0.00 2.66 0.00 0.00 56.10 59.74 1y4s s TRP 263 Cb -0.04 0.36 0.11 0.00 -3.10 0.00 0.00 33.47 30.80 1y4s s TRP 263 CO 0.12 -0.61 0.14 0.45 -2.66 0.00 0.00 176.95 174.40 1y4s s SER 264 N -1.51 4.25 -0.25 -2.66 0.15 -0.90 -5.03 113.70 107.74 1y4s s SER 264 Ca -0.09 -2.27 -0.20 0.00 0.70 0.00 0.00 55.95 54.09 1y4s s SER 264 Cb -0.01 -1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 62.99 1y4s s SER 264 CO 0.05 -0.34 0.61 -2.28 1.20 0.00 0.00 173.24 172.48 1y4s s HIS 265 N 0.77 3.28 -0.00 3.44 5.04 -1.26 -3.03 115.29 123.52 1y4s s HIS 265 Ca 0.13 0.79 0.00 0.00 -1.54 0.00 0.00 55.06 54.44 1y4s s HIS 265 Cb -0.21 -2.82 0.00 0.00 0.04 0.00 0.00 32.58 29.60 1y4s s HIS 265 CO -0.09 -0.31 -0.01 -0.80 -2.34 0.00 0.00 174.74 171.18 1y4s s ASN 266 N 1.48 0.13 0.10 9.88 0.01 -0.78 -5.01 114.94 120.75 1y4s s ASN 266 Ca 0.25 -0.02 0.07 0.00 -0.71 0.00 0.00 52.86 52.46 1y4s s ASN 266 Cb -0.16 -0.02 -0.04 0.00 0.41 0.00 0.00 41.25 41.44 1y4s s ASN 266 CO 0.09 0.00 -0.09 -0.60 -1.51 0.00 0.00 177.10 174.99 1y4s s ARG 267 N 0.07 2.16 -0.16 -0.60 3.52 -1.26 -1.76 118.95 120.92 1y4s s ARG 267 Ca -0.00 -1.01 -0.09 0.00 -0.13 0.00 0.00 55.73 54.50 1y4s s ARG 267 Cb -0.02 -2.32 0.05 0.00 -1.56 0.00 0.00 34.95 31.10 1y4s s ARG 267 CO -0.00 0.51 0.38 0.08 -0.81 0.00 0.00 175.30 175.45 1y4s s VAL 268 N -1.23 -0.03 -0.21 7.11 1.01 -1.15 -4.98 120.40 120.93 1y4s s VAL 268 Ca 0.22 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.26 1y4s s VAL 268 Cb -0.11 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.78 1y4s s VAL 268 CO 0.14 0.04 0.09 -1.61 0.00 0.00 0.00 175.10 173.76 1y4s s GLU 269 N 1.30 0.26 0.00 2.72 2.02 -1.26 -2.79 118.70 120.94 1y4s s GLU 269 Ca -0.09 -0.31 0.00 0.00 0.02 0.00 0.00 54.97 54.59 1y4s s GLU 269 Cb -0.08 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.39 1y4s s GLU 269 CO -0.11 -0.76 0.00 0.41 0.02 0.00 0.00 175.26 174.82 1y4s n GLY 270 N 5.20 -1.29 0.06 -1.39 0.00 -1.26 -4.99 105.19 101.52 1y4s n GLY 270 Ca -0.07 0.64 -0.03 0.00 0.00 0.00 0.00 46.02 46.56 1y4s n GLY 270 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y4s n LYS 271 N 0.00 0.95 -3.74 1.61 5.02 -1.26 -4.70 118.16 116.03 1y4s n LYS 271 Ca 0.00 -0.06 -0.28 0.00 -2.02 0.00 0.00 58.31 55.95 1y4s n LYS 271 Cb 0.00 -1.45 -0.12 0.00 -0.02 0.00 0.00 35.03 33.44 1y4s n LYS 271 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1y4s s GLN 272 N -2.70 1.84 -0.75 1.97 -0.21 -1.26 -5.07 119.66 113.47 1y4s s GLN 272 Ca -0.08 -2.77 -0.26 0.00 0.02 0.00 0.00 55.36 52.27 1y4s s GLN 272 Cb 0.07 -2.72 0.02 0.00 1.00 0.00 0.00 33.01 31.38 1y4s s GLN 272 CO 0.75 -1.28 1.42 -2.00 -2.12 0.00 0.00 175.29 172.06 1y4s s GLU 273 N -0.70 3.11 0.00 2.91 2.12 -1.26 -4.60 118.70 120.29 1y4s s GLU 273 Ca 0.25 -0.18 0.00 0.00 0.36 0.00 0.00 54.97 55.40 1y4s s GLU 273 Cb -0.07 -4.37 0.00 0.00 0.26 0.00 0.00 34.13 29.95 1y4s s GLU 273 CO -0.14 -2.30 0.00 2.48 -0.54 0.00 0.00 175.26 174.76 1y4s n TYR 274 N 10.08 0.00 -2.79 5.30 0.18 -1.12 -2.02 117.16 126.79 1y4s n TYR 274 Ca 0.11 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.90 1y4s n TYR 274 Cb 0.50 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.46 1y4s n TYR 274 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1y4s s THR 275 N -0.13 -0.27 0.75 -3.48 2.01 -1.22 -2.91 115.64 110.38 1y4s s THR 275 Ca 0.00 -0.03 -0.09 0.00 0.31 0.00 0.00 61.69 61.88 1y4s s THR 275 Cb 0.00 0.00 0.07 0.00 0.01 0.00 0.00 72.50 72.58 1y4s s THR 275 CO 0.00 0.00 1.08 -0.94 -0.69 0.00 0.00 174.62 174.07 1y4s s SER 276 N 1.85 4.66 -0.47 3.53 1.04 -0.72 -1.95 113.70 121.63 1y4s s SER 276 Ca 0.16 0.55 0.05 0.00 0.48 0.00 0.00 55.95 57.19 1y4s s SER 276 Cb 0.04 -1.13 0.24 0.00 0.10 0.00 0.00 66.02 65.26 1y4s s SER 276 CO -0.14 -1.73 0.92 -0.11 0.98 0.00 0.00 173.24 173.16 1y4s n LEU 277 N -3.08 -2.75 -4.86 2.42 7.94 -1.14 -1.86 117.00 113.67 1y4s n LEU 277 Ca 0.08 -3.04 -0.31 0.00 -1.11 0.00 0.00 56.01 51.63 1y4s n LEU 277 Cb 0.61 0.79 -0.02 0.00 0.53 0.00 0.00 43.42 45.33 1y4s n LEU 277 CO 0.54 1.93 0.66 -0.76 -1.11 0.00 0.00 177.39 178.65 1y4s s LEU 278 N -0.43 3.51 0.06 -1.96 1.02 -1.17 -3.16 118.68 116.56 1y4s s LEU 278 Ca 0.31 1.45 0.04 0.00 0.02 0.00 0.00 54.13 55.95 1y4s s LEU 278 Cb 0.20 -4.43 -0.03 0.00 0.02 0.00 0.00 46.19 41.96 1y4s s LEU 278 CO -0.21 -0.67 -0.12 -0.31 0.02 0.00 0.00 176.35 175.07 1y4s s TYR 279 N -2.79 1.01 -0.31 0.29 1.51 0.58 -2.11 117.35 115.52 1y4s s TYR 279 Ca 0.56 -0.46 -0.01 0.00 -1.01 0.00 0.00 57.07 56.16 1y4s s TYR 279 Cb -0.10 -0.58 0.06 0.00 -0.11 0.00 0.00 41.96 41.23 1y4s s TYR 279 CO 0.39 0.00 0.01 0.42 -1.11 0.00 0.00 175.55 175.27 1y4s s ILE 280 N -1.25 2.90 0.00 2.71 1.01 -1.05 -2.34 121.20 123.17 1y4s s ILE 280 Ca -0.04 -1.53 0.00 0.00 0.00 0.00 0.00 60.65 59.07 1y4s s ILE 280 Cb -0.10 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.65 1y4s s ILE 280 CO 0.01 -0.19 0.00 -0.81 0.00 0.00 0.00 174.94 173.96 1y4s n PRO 281 N 4.58 3.93 0.00 2.79 -0.04 -1.26 -0.44 135.00 144.56 1y4s n PRO 281 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1y4s n PRO 281 Cb 0.43 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.89 1y4s n PRO 281 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1y4s n SER 282 N 0.00 0.00 -3.92 3.54 2.88 -1.26 -0.45 113.62 114.41 1y4s n SER 282 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1y4s n SER 282 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1y4s n SER 282 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1y4s s GLN 283 N 0.00 0.14 0.06 -1.46 2.00 -1.26 -4.91 119.66 114.23 1y4s s GLN 283 Ca 0.00 -0.24 -0.23 0.00 -2.00 0.00 0.00 55.36 52.89 1y4s s GLN 283 Cb 0.00 0.01 -0.06 0.00 0.80 0.00 0.00 33.01 33.76 1y4s s GLN 283 CO 0.00 -0.01 0.69 0.00 -0.50 0.00 0.00 175.29 175.47 1y4s s ALA 284 N -0.55 3.45 0.25 1.58 0.00 -1.26 -4.99 121.76 120.23 1y4s s ALA 284 Ca -0.06 0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.78 1y4s s ALA 284 Cb -0.04 -2.86 -0.13 0.00 0.00 0.00 0.00 23.12 20.09 1y4s s ALA 284 CO -0.00 0.20 1.53 -0.35 0.00 0.00 0.00 175.76 177.13 1y4s n PRO 285 N 2.33 2.36 0.17 0.00 -0.04 -1.26 -4.85 135.00 133.71 1y4s n PRO 285 Ca -0.06 0.84 0.19 0.00 -0.04 0.00 0.00 63.50 64.43 1y4s n PRO 285 Cb 0.50 -2.58 0.79 0.00 -0.04 0.00 0.00 33.50 32.18 1y4s n PRO 285 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 1y4s h TRP 286 N 4.89 0.00 -0.62 0.54 7.01 -1.98 -0.76 115.95 125.03 1y4s h TRP 286 Ca -0.45 0.00 -0.21 0.00 2.11 0.00 0.00 58.89 60.34 1y4s h TRP 286 Cb 1.25 0.00 -0.12 0.00 -2.10 0.00 0.00 29.16 28.18 1y4s h TRP 286 CO 0.59 0.00 0.20 -0.25 -2.79 0.00 0.00 178.44 176.19 1y4s n ASP 287 N -3.60 4.14 0.00 2.65 8.00 -1.26 -4.68 116.55 121.79 1y4s n ASP 287 Ca 0.04 -3.33 0.09 0.00 0.71 0.00 0.00 54.79 52.30 1y4s n ASP 287 Cb 0.48 -0.70 0.50 0.00 -0.02 0.00 0.00 41.12 41.37 1y4s n ASP 287 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1y4s n MET 288 N -0.50 0.36 -1.52 -1.24 1.56 -0.29 -3.81 117.12 111.67 1y4s n MET 288 Ca 0.38 0.08 -0.09 0.00 -0.27 0.00 0.00 57.70 57.80 1y4s n MET 288 Cb 1.27 -1.50 0.09 0.00 2.15 0.00 0.00 33.22 35.24 1y4s n MET 288 CO 0.00 0.00 0.00 0.91 -0.73 0.00 0.00 175.97 176.15 1y4s n TRP 289 N -1.21 1.46 -3.78 1.12 7.02 -1.26 -5.00 117.44 115.78 1y4s n TRP 289 Ca 0.10 -1.85 -0.14 0.00 -1.02 0.00 0.00 57.50 54.59 1y4s n TRP 289 Cb 0.13 -0.29 -0.15 0.00 -2.42 0.00 0.00 31.31 28.58 1y4s n TRP 289 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1y4s s ASN 290 N -3.39 0.02 0.00 -0.99 2.20 -1.25 -5.10 114.94 106.42 1y4s s ASN 290 Ca 0.43 0.09 0.00 0.00 -0.94 0.00 0.00 52.86 52.45 1y4s s ASN 290 Cb 0.39 0.00 0.00 0.00 -2.00 0.00 0.00 41.25 39.64 1y4s s ASN 290 CO -0.02 -0.11 0.04 0.54 -2.94 0.00 0.00 177.10 174.61 1y4s n ARG 291 N 3.96 0.00 -1.53 3.55 3.00 -1.26 -3.45 116.66 120.92 1y4s n ARG 291 Ca -0.24 0.04 -0.13 0.00 -0.01 0.00 0.00 57.85 57.50 1y4s n ARG 291 Cb 0.52 -0.16 -0.10 0.00 0.00 0.00 0.00 32.46 32.73 1y4s n ARG 291 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1y4s n ASP 292 N -0.21 1.18 -3.71 0.55 8.00 -1.26 -4.86 116.55 116.24 1y4s n ASP 292 Ca 0.00 -1.90 -0.18 0.00 0.71 0.00 0.00 54.79 53.42 1y4s n ASP 292 Cb 0.00 -1.57 -0.17 0.00 -0.02 0.00 0.00 41.12 39.35 1y4s n ASP 292 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1y4s s HIS 293 N 14.42 0.05 0.22 1.24 2.46 -1.22 -5.11 115.29 127.34 1y4s s HIS 293 Ca 0.85 0.21 -0.32 0.00 0.47 0.00 0.00 55.06 56.27 1y4s s HIS 293 Cb -0.13 -0.39 -0.14 0.00 -0.13 0.00 0.00 32.58 31.79 1y4s s HIS 293 CO 0.15 -0.15 1.34 0.36 -2.47 0.00 0.00 174.74 173.97 1y4s n LYS 294 N 4.90 1.79 -3.53 2.88 2.85 -1.26 -4.99 118.16 120.79 1y4s n LYS 294 Ca -0.12 0.64 -0.14 0.00 -1.05 0.00 0.00 58.31 57.64 1y4s n LYS 294 Cb 0.50 -2.25 -0.05 0.00 -0.65 0.00 0.00 35.03 32.58 1y4s n LYS 294 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 177.40 173.97 1y4s s HIS 295 N -0.09 -0.51 0.00 5.58 -3.43 -1.26 -5.07 115.29 110.51 1y4s s HIS 295 Ca 0.70 0.76 0.00 0.00 -0.80 0.00 0.00 55.06 55.72 1y4s s HIS 295 Cb -0.71 0.46 0.00 0.00 -1.43 0.00 0.00 32.58 30.90 1y4s s HIS 295 CO 0.50 -0.54 0.00 0.41 -2.00 0.00 0.00 174.74 173.11 1y4s n GLY 296 N 0.56 3.30 3.90 -1.38 0.00 -1.26 -3.65 105.19 106.66 1y4s n GLY 296 Ca -0.15 -1.85 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 1y4s n GLY 296 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y4s s LEU 297 N 0.00 4.28 -0.35 0.99 1.02 -0.94 -4.52 118.68 119.17 1y4s s LEU 297 Ca 0.00 0.52 -0.29 0.00 0.02 0.00 0.00 54.13 54.38 1y4s s LEU 297 Cb 0.00 -3.24 0.01 0.00 0.02 0.00 0.00 46.19 42.98 1y4s s LEU 297 CO 0.00 0.07 1.29 -0.75 0.02 0.00 0.00 176.35 176.98 1y4s s LYS 298 N -2.65 3.82 -0.05 1.70 2.20 0.96 -2.83 119.74 122.90 1y4s s LYS 298 Ca 0.40 1.07 -0.24 0.00 -0.36 0.00 0.00 55.97 56.84 1y4s s LYS 298 Cb -0.12 -3.90 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 1y4s s LYS 298 CO 0.25 -1.24 0.71 -1.17 -0.36 0.00 0.00 175.35 173.54 1y4s s LEU 299 N 4.57 4.34 0.37 5.43 0.20 -0.92 -2.13 118.68 130.53 1y4s s LEU 299 Ca 0.55 1.23 0.04 0.00 0.69 0.00 0.00 54.13 56.65 1y4s s LEU 299 Cb -0.14 -3.10 -0.06 0.00 -0.43 0.00 0.00 46.19 42.45 1y4s s LEU 299 CO 0.26 -0.09 0.05 -0.31 -0.29 0.00 0.00 176.35 175.97 1y4s s TYR 300 N 0.64 2.09 -0.30 5.38 1.51 -0.10 -2.80 117.35 123.77 1y4s s TYR 300 Ca 0.38 -0.91 -0.11 0.00 -1.01 0.00 0.00 57.07 55.42 1y4s s TYR 300 Cb -0.18 -1.43 0.12 0.00 -0.11 0.00 0.00 41.96 40.36 1y4s s TYR 300 CO 0.19 0.11 0.65 0.08 -1.11 0.00 0.00 175.55 175.47 1y4s s VAL 301 N -3.10 -0.89 -1.46 0.71 1.01 -0.98 -3.28 120.40 112.41 1y4s s VAL 301 Ca 0.32 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.21 1y4s s VAL 301 Cb 0.08 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.52 1y4s s VAL 301 CO 0.15 0.00 0.86 0.00 0.00 0.00 0.00 175.10 176.11 1y4s n GLN 302 N 5.34 -5.57 -1.25 2.72 6.02 -0.98 -0.40 117.38 123.26 1y4s n GLN 302 Ca -0.13 0.70 -0.09 0.00 -0.01 0.00 0.00 57.00 57.48 1y4s n GLN 302 Cb 0.50 -5.59 -0.04 0.00 1.02 0.00 0.00 30.24 26.13 1y4s n GLN 302 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1y4s n ARG 303 N -4.45 -1.54 -3.59 -1.09 1.74 -1.26 -4.95 116.66 101.51 1y4s n ARG 303 Ca -0.01 0.77 -0.40 0.00 -0.77 0.00 0.00 57.85 57.44 1y4s n ARG 303 Cb 0.56 -5.07 -0.11 0.00 -1.02 0.00 0.00 32.46 26.82 1y4s n ARG 303 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1y4s s VAL 304 N -1.84 4.78 0.27 1.55 1.01 0.46 -5.06 120.40 121.56 1y4s s VAL 304 Ca 0.00 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1y4s s VAL 304 Cb 0.00 -3.56 -0.13 0.00 0.00 0.00 0.00 36.38 32.70 1y4s s VAL 304 CO 0.00 -0.11 1.42 0.33 0.00 0.00 0.00 175.10 176.74 1y4s n PHE 305 N 5.03 2.30 0.00 5.22 7.35 -1.26 -2.31 117.46 133.79 1y4s n PHE 305 Ca -0.12 0.43 0.00 0.00 -0.76 0.00 0.00 57.45 56.99 1y4s n PHE 305 Cb 0.48 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 37.83 1y4s n PHE 305 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1y4s n ILE 306 N 1.65 0.00 -4.39 -2.13 5.41 -1.12 -4.49 119.36 114.29 1y4s n ILE 306 Ca 0.10 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.65 1y4s n ILE 306 Cb 0.33 -0.69 -0.10 0.00 -0.71 0.00 0.00 39.64 38.47 1y4s n ILE 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1y4s s MET 307 N -0.64 1.60 0.51 0.38 0.23 -1.21 -5.05 119.30 115.12 1y4s s MET 307 Ca 0.00 -1.90 0.01 0.00 -1.03 0.00 0.00 55.69 52.77 1y4s s MET 307 Cb 0.00 -0.50 -0.01 0.00 -1.53 0.00 0.00 34.83 32.79 1y4s s MET 307 CO 0.00 -0.31 0.00 0.34 -2.03 0.00 0.00 175.02 173.03 1y4s s ASP 308 N -3.42 4.11 -1.34 -1.18 2.15 -1.26 -2.17 116.67 113.55 1y4s s ASP 308 Ca 0.35 -1.66 -0.14 0.00 0.43 0.00 0.00 52.55 51.54 1y4s s ASP 308 Cb 0.07 0.53 0.14 0.00 -0.30 0.00 0.00 42.92 43.35 1y4s s ASP 308 CO 0.15 -0.86 0.34 0.47 -0.17 0.00 0.00 175.17 175.10 1y4s n ASP 309 N -1.27 -0.86 -4.53 -0.34 10.43 -1.26 -4.78 116.55 113.95 1y4s n ASP 309 Ca -0.19 -0.93 -0.42 0.00 2.57 0.00 0.00 54.79 55.82 1y4s n ASP 309 Cb 0.67 -1.19 -0.03 0.00 1.84 0.00 0.00 41.12 42.41 1y4s n ASP 309 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1y4s s ALA 310 N -3.00 2.88 -0.74 2.24 0.00 -1.13 -4.63 121.76 117.38 1y4s s ALA 310 Ca 0.47 -2.20 0.18 0.00 0.00 0.00 0.00 51.96 50.41 1y4s s ALA 310 Cb -0.28 -4.35 0.78 0.00 0.00 0.00 0.00 23.12 19.28 1y4s s ALA 310 CO 0.76 -3.39 1.57 -0.85 0.00 0.00 0.00 175.76 173.85 1y4s n GLU 311 N 8.41 0.09 -0.07 0.00 0.00 -1.24 -2.21 120.64 125.63 1y4s n GLU 311 Ca 0.24 0.35 0.00 0.00 0.00 0.00 0.00 57.16 57.75 1y4s n GLU 311 Cb 0.50 -1.69 0.00 0.00 0.00 0.00 0.00 31.44 30.25 1y4s n GLU 311 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1y4s n GLN 312 N -1.87 0.82 0.00 3.44 1.13 -1.26 -2.55 117.38 117.09 1y4s n GLN 312 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1y4s n GLN 312 Cb 0.19 -1.09 0.00 0.00 0.11 0.00 0.00 30.24 29.45 1y4s n GLN 312 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1y4s n PHE 313 N 0.76 0.00 -3.72 1.08 3.01 -1.26 -4.78 117.46 112.56 1y4s n PHE 313 Ca 0.00 -0.01 -0.17 0.00 1.01 0.00 0.00 57.45 58.28 1y4s n PHE 313 Cb 0.41 -0.00 -0.17 0.00 -0.01 0.00 0.00 39.48 39.71 1y4s n PHE 313 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1y4s s MET 314 N -0.02 -0.04 0.54 -1.08 -1.94 -1.06 -4.42 119.30 111.29 1y4s s MET 314 Ca 0.00 0.32 -0.21 0.00 -1.71 0.00 0.00 55.69 54.09 1y4s s MET 314 Cb 0.00 -0.36 -0.05 0.00 2.01 0.00 0.00 34.83 36.43 1y4s s MET 314 CO 0.00 -0.25 1.27 -1.25 -0.01 0.00 0.00 175.02 174.78 1y4s s PRO 315 N 1.67 3.25 0.24 2.03 0.04 -1.26 -4.87 135.00 136.10 1y4s s PRO 315 Ca -0.02 2.00 -0.13 0.00 0.04 0.00 0.00 61.00 62.89 1y4s s PRO 315 Cb -0.12 -2.21 0.32 0.00 0.04 0.00 0.00 34.50 32.53 1y4s s PRO 315 CO -0.04 -1.03 1.58 -0.97 0.04 0.00 0.00 177.00 176.58 1y4s h ASN 316 N 1.46 -0.99 0.00 6.66 -0.73 -2.00 -1.00 115.58 118.97 1y4s h ASN 316 Ca -0.50 0.27 0.00 0.00 1.87 0.00 0.00 56.30 57.93 1y4s h ASN 316 Cb 1.29 0.59 0.00 0.00 0.27 0.00 0.00 38.32 40.47 1y4s h ASN 316 CO 0.57 -0.29 0.00 0.00 -0.37 0.00 0.00 177.43 177.34 1y4s n TYR 317 N -5.53 0.00 -1.66 0.67 0.18 -1.26 -1.06 117.16 108.50 1y4s n TYR 317 Ca 0.11 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.90 1y4s n TYR 317 Cb 0.42 -0.01 0.01 0.00 -0.38 0.00 0.00 39.34 39.38 1y4s n TYR 317 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1y4s n LEU 318 N 0.13 0.30 -0.30 -3.48 4.77 -0.38 -4.30 117.00 113.73 1y4s n LEU 318 Ca 0.00 -1.05 -0.04 0.00 -0.03 0.00 0.00 56.01 54.89 1y4s n LEU 318 Cb 0.03 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.09 1y4s n LEU 318 CO 0.00 0.26 0.59 0.03 -1.33 0.00 0.00 177.39 176.94 1y4s h ARG 319 N 0.00 -0.08 0.00 3.23 -0.00 -1.20 0.98 114.38 117.30 1y4s h ARG 319 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1y4s h ARG 319 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 29.97 31.25 1y4s h ARG 319 CO 0.00 -0.05 0.57 1.97 0.00 0.00 0.00 179.97 182.46 1y4s n PHE 320 N -5.44 0.05 -1.50 3.04 1.16 -1.26 -4.40 117.46 109.11 1y4s n PHE 320 Ca 0.07 0.02 -0.31 0.00 -1.87 0.00 0.00 57.45 55.37 1y4s n PHE 320 Cb 0.37 -0.09 0.08 0.00 -1.61 0.00 0.00 39.48 38.22 1y4s n PHE 320 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1y4s s VAL 321 N -2.65 3.49 0.06 1.97 1.01 0.33 -4.60 120.40 120.02 1y4s s VAL 321 Ca -0.00 0.48 -0.14 0.00 0.00 0.00 0.00 61.98 62.33 1y4s s VAL 321 Cb 0.00 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.23 1y4s s VAL 321 CO 0.01 -0.63 0.31 -0.13 0.00 0.00 0.00 175.10 174.66 1y4s s ARG 322 N -5.06 0.86 0.00 2.72 1.81 -0.99 -4.48 118.95 113.81 1y4s s ARG 322 Ca 0.60 -0.58 0.00 0.00 -1.72 0.00 0.00 55.73 54.02 1y4s s ARG 322 Cb -0.15 0.37 0.00 0.00 -0.45 0.00 0.00 34.95 34.72 1y4s s ARG 322 CO 0.55 -0.29 0.00 0.41 -0.68 0.00 0.00 175.30 175.29 1y4s n GLY 323 N 0.37 0.97 2.79 -3.53 0.00 -1.26 0.21 105.19 104.74 1y4s n GLY 323 Ca -0.18 -2.04 -0.19 0.00 0.00 0.00 0.00 46.02 43.61 1y4s n GLY 323 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1y4s n LEU 324 N 0.00 0.00 -3.38 0.99 -0.00 -1.19 -0.03 117.00 113.40 1y4s n LEU 324 Ca 0.00 -2.10 -0.07 0.00 -0.00 0.00 0.00 56.01 53.84 1y4s n LEU 324 Cb 0.00 -0.03 -0.07 0.00 -0.00 0.00 0.00 43.42 43.32 1y4s n LEU 324 CO 0.00 -0.50 -0.01 -0.63 -0.00 0.00 0.00 177.39 176.25 1y4s s ILE 325 N -2.00 -0.66 -1.09 1.47 1.01 -0.91 -2.90 121.20 116.12 1y4s s ILE 325 Ca 0.23 -0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 1y4s s ILE 325 Cb -0.02 -0.82 0.30 0.00 0.01 0.00 0.00 42.46 41.94 1y4s s ILE 325 CO 0.14 -0.08 1.46 -0.67 0.00 0.00 0.00 174.94 175.80 1y4s n ASP 326 N 5.38 6.33 -4.64 3.58 2.03 -0.83 -0.93 116.55 127.48 1y4s n ASP 326 Ca -0.04 -3.37 -0.30 0.00 0.52 0.00 0.00 54.79 51.60 1y4s n ASP 326 Cb 0.50 -1.29 0.18 0.00 -0.72 0.00 0.00 41.12 39.79 1y4s n ASP 326 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1y4s s SER 327 N -1.44 2.60 0.00 1.67 0.15 -1.21 -3.46 113.70 112.02 1y4s s SER 327 Ca 0.31 1.73 0.00 0.00 0.70 0.00 0.00 55.95 58.69 1y4s s SER 327 Cb 0.03 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 62.00 1y4s s SER 327 CO 0.09 -3.22 0.01 -1.20 1.20 0.00 0.00 173.24 170.11 1y4s n SER 328 N -4.28 0.02 0.11 5.45 7.64 -0.86 -2.31 113.62 119.38 1y4s n SER 328 Ca 0.07 -0.36 0.07 0.00 1.01 0.00 0.00 58.87 59.66 1y4s n SER 328 Cb 0.54 0.03 0.01 0.00 -1.01 0.00 0.00 64.21 63.78 1y4s n SER 328 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1y4s h ASP 329 N 0.00 0.00 -3.78 6.43 3.32 -1.94 -3.46 116.42 116.99 1y4s h ASP 329 Ca 0.00 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.56 1y4s h ASP 329 Cb 0.16 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1y4s h ASP 329 CO 0.00 0.23 0.19 -0.76 -1.72 0.00 0.00 179.24 177.18 1y4s s LEU 330 N -5.78 4.17 0.38 1.55 1.43 -1.26 -5.03 118.68 114.14 1y4s s LEU 330 Ca 0.01 1.50 -0.26 0.00 -1.03 0.00 0.00 54.13 54.35 1y4s s LEU 330 Cb 0.08 -4.02 -0.09 0.00 0.03 0.00 0.00 46.19 42.20 1y4s s LEU 330 CO 0.77 -0.14 1.20 -2.16 0.23 0.00 0.00 176.35 176.25 1y4s s PRO 331 N -2.56 4.14 0.16 1.29 0.04 -1.26 -4.87 135.00 131.94 1y4s s PRO 331 Ca 0.52 1.94 0.10 0.00 0.04 0.00 0.00 61.00 63.60 1y4s s PRO 331 Cb -0.13 -2.80 0.57 0.00 0.04 0.00 0.00 34.50 32.18 1y4s s PRO 331 CO 0.19 -0.28 1.31 -0.11 0.04 0.00 0.00 177.00 178.15 1y4s n LEU 332 N 0.30 0.27 -1.72 -3.56 0.00 -1.26 -1.23 117.00 109.79 1y4s n LEU 332 Ca 0.03 0.62 0.07 0.00 0.00 0.00 0.00 56.01 56.73 1y4s n LEU 332 Cb 0.45 -0.65 0.37 0.00 0.00 0.00 0.00 43.42 43.59 1y4s n LEU 332 CO 0.53 -0.71 0.82 0.59 0.00 0.00 0.00 177.39 178.62 1y4s n ASN 333 N -1.86 5.17 -4.62 1.96 3.02 -1.26 -5.00 115.26 112.66 1y4s n ASN 333 Ca -0.01 -2.74 -0.50 0.00 -0.03 0.00 0.00 54.58 51.30 1y4s n ASN 333 Cb 0.04 -0.64 -0.05 0.00 -0.61 0.00 0.00 39.78 38.51 1y4s n ASN 333 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1y4s n VAL 334 N 0.72 0.03 -4.00 2.41 0.31 -0.37 -4.97 118.33 112.45 1y4s n VAL 334 Ca 0.25 -0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.33 1y4s n VAL 334 Cb 1.05 -1.11 -0.04 0.00 -0.91 0.00 0.00 33.84 32.83 1y4s n VAL 334 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1y4s s SER 335 N 0.83 4.58 0.26 4.52 0.01 -1.26 -5.00 113.70 117.64 1y4s s SER 335 Ca 0.83 -1.14 0.05 0.00 1.31 0.00 0.00 55.95 57.00 1y4s s SER 335 Cb -0.85 -0.08 0.35 0.00 0.21 0.00 0.00 66.02 65.64 1y4s s SER 335 CO 0.44 -0.79 1.63 -0.09 0.41 0.00 0.00 173.24 174.84 1y4s h ARG 336 N 1.11 0.27 0.35 12.44 9.65 -2.01 -2.88 114.38 133.31 1y4s h ARG 336 Ca -0.40 -0.15 -0.02 0.00 -1.10 0.00 0.00 59.98 58.31 1y4s h ARG 336 Cb 1.28 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 1y4s h ARG 336 CO 0.64 0.70 -0.17 0.93 2.80 0.00 0.00 179.97 184.87 1y4s h GLU 337 N 0.22 -0.45 -0.68 0.20 5.08 -2.00 -3.33 114.58 113.62 1y4s h GLU 337 Ca 0.01 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1y4s h GLU 337 Cb 0.94 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 30.21 1y4s h GLU 337 CO 0.08 -0.30 -0.40 -0.89 -1.00 0.00 0.00 179.01 176.49 1y4s n ILE 338 N -4.66 -0.46 -0.34 3.13 5.41 -1.23 -1.94 119.36 119.27 1y4s n ILE 338 Ca -0.06 2.08 0.18 0.00 1.00 0.00 0.00 62.75 65.95 1y4s n ILE 338 Cb 0.18 -2.61 0.34 0.00 -0.71 0.00 0.00 39.64 36.84 1y4s n ILE 338 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1y4s h LEU 339 N 0.00 -0.36 -0.76 1.39 3.38 -1.66 -0.11 115.31 117.19 1y4s h LEU 339 Ca 0.11 0.28 -0.03 0.00 0.09 0.00 0.00 57.88 58.33 1y4s h LEU 339 Cb 0.28 0.46 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1y4s h LEU 339 CO -0.64 -0.38 0.38 -0.61 0.09 0.00 0.00 178.44 177.28 1y4s h GLN 340 N 0.00 1.09 -2.02 1.13 4.15 -1.49 -2.89 115.11 115.08 1y4s h GLN 340 Ca 0.65 -0.16 -0.77 0.00 0.77 0.00 0.00 58.65 59.14 1y4s h GLN 340 Cb 1.41 -0.20 -0.27 0.00 0.21 0.00 0.00 27.48 28.64 1y4s h GLN 340 CO -0.91 0.84 1.06 -0.25 -1.93 0.00 0.00 178.83 177.64 1y4s n ASP 341 N -4.39 7.50 -4.35 -0.69 9.92 -0.06 -4.94 116.55 119.54 1y4s n ASP 341 Ca 0.07 -3.81 -0.28 0.00 -0.53 0.00 0.00 54.79 50.24 1y4s n ASP 341 Cb 0.13 -1.08 -0.13 0.00 -0.64 0.00 0.00 41.12 39.39 1y4s n ASP 341 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1y4s s SER 342 N -1.07 3.06 -0.13 -2.24 0.15 -1.09 -5.00 113.70 107.39 1y4s s SER 342 Ca 0.51 -0.71 -0.02 0.00 0.70 0.00 0.00 55.95 56.43 1y4s s SER 342 Cb 0.42 -0.20 -0.25 0.00 -1.71 0.00 0.00 66.02 64.28 1y4s s SER 342 CO -0.39 0.15 0.34 0.41 1.20 0.00 0.00 173.24 174.95 1y4s n THR 343 N 1.08 1.71 0.31 6.45 -1.04 -1.26 -3.17 114.28 118.36 1y4s n THR 343 Ca -0.18 -0.68 0.20 0.00 -2.04 0.00 0.00 64.05 61.35 1y4s n THR 343 Cb 0.53 -1.55 1.00 0.00 -1.82 0.00 0.00 70.33 68.50 1y4s n THR 343 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1y4s h VAL 344 N 0.05 0.12 0.07 12.58 2.07 -1.96 0.21 116.25 129.39 1y4s h VAL 344 Ca -0.42 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1y4s h VAL 344 Cb 2.02 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.96 1y4s h VAL 344 CO 0.06 0.02 -0.03 0.74 0.02 0.00 0.00 177.57 178.38 1y4s h THR 345 N 0.00 0.00 -1.16 2.57 2.02 -1.86 -1.37 112.91 113.10 1y4s h THR 345 Ca -0.00 -0.35 0.38 0.00 0.77 0.00 0.00 66.41 67.20 1y4s h THR 345 Cb 0.17 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.45 1y4s h THR 345 CO 0.00 0.00 0.72 -0.09 0.37 0.00 0.00 175.52 176.52 1y4s h ARG 346 N -0.44 0.19 0.39 6.66 2.43 -1.43 1.42 114.38 123.59 1y4s h ARG 346 Ca -0.01 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1y4s h ARG 346 Cb 0.07 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1y4s h ARG 346 CO 0.01 0.12 -0.19 -0.91 -1.51 0.00 0.00 179.97 177.50 1y4s h ASN 347 N 0.19 -0.44 -0.77 -3.80 2.35 -0.65 -2.66 115.58 109.80 1y4s h ASN 347 Ca 0.76 0.02 0.18 0.00 -0.55 0.00 0.00 56.30 56.71 1y4s h ASN 347 Cb 2.13 0.11 -0.12 0.00 0.05 0.00 0.00 38.32 40.49 1y4s h ASN 347 CO -0.47 -0.19 0.13 0.25 -1.65 0.00 0.00 177.43 175.50 1y4s h LEU 348 N -0.79 -0.11 -0.16 1.61 5.85 0.23 0.23 115.31 122.17 1y4s h LEU 348 Ca -0.05 0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1y4s h LEU 348 Cb 0.40 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 1y4s h LEU 348 CO 0.09 -0.11 -0.22 -0.09 -0.34 0.00 0.00 178.44 177.77 1y4s h ARG 349 N 0.20 -0.15 -0.77 1.25 2.43 0.18 0.76 114.38 118.29 1y4s h ARG 349 Ca 0.45 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.61 1y4s h ARG 349 Cb 0.81 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 1y4s h ARG 349 CO -0.59 -0.10 0.43 -0.91 -1.51 0.00 0.00 179.97 177.28 1y4s h ASN 350 N -0.16 0.94 -0.09 -3.80 2.35 -1.01 0.15 115.58 113.98 1y4s h ASN 350 Ca 0.03 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1y4s h ASN 350 Cb 0.23 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1y4s h ASN 350 CO -0.23 0.75 0.04 0.00 -1.65 0.00 0.00 177.43 176.34 1y4s h ALA 351 N 1.40 1.84 0.12 -0.83 0.00 -0.35 -2.50 119.26 118.95 1y4s h ALA 351 Ca 0.27 -0.04 -0.33 0.00 0.00 0.00 0.00 54.91 54.81 1y4s h ALA 351 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1y4s h ALA 351 CO -0.05 0.13 -1.69 -0.07 0.00 0.00 0.00 179.25 177.58 1y4s h LEU 352 N 0.17 0.41 -0.80 0.00 3.38 -0.14 -3.28 115.31 115.04 1y4s h LEU 352 Ca 0.04 -0.66 0.19 0.00 0.09 0.00 0.00 57.88 57.55 1y4s h LEU 352 Cb 0.05 -0.13 -0.13 0.00 0.09 0.00 0.00 40.66 40.54 1y4s h LEU 352 CO -0.00 1.56 0.15 0.74 0.09 0.00 0.00 178.44 180.97 1y4s h THR 353 N 0.07 0.38 -0.38 0.22 2.02 -0.54 0.20 112.91 114.88 1y4s h THR 353 Ca -0.30 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 66.78 1y4s h THR 353 Cb 2.04 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 1y4s h THR 353 CO 0.14 0.04 0.12 0.11 0.37 0.00 0.00 175.52 176.30 1y4s h LYS 354 N 0.19 0.60 -0.22 6.66 1.57 -1.65 -2.94 116.57 120.78 1y4s h LYS 354 Ca 0.47 -0.13 0.06 0.00 -1.87 0.00 0.00 60.65 59.18 1y4s h LYS 354 Cb 0.87 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1y4s h LYS 354 CO -0.62 0.61 0.23 0.00 -0.57 0.00 0.00 179.45 179.09 1y4s h ARG 355 N 0.47 0.00 0.17 3.15 3.08 -0.68 0.13 114.38 120.70 1y4s h ARG 355 Ca 0.12 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.90 1y4s h ARG 355 Cb 0.26 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.34 1y4s h ARG 355 CO -0.00 0.00 -1.19 0.28 -1.07 0.00 0.00 179.97 177.98 1y4s h VAL 356 N 0.00 1.35 -0.59 2.04 2.07 -1.22 -1.39 116.25 118.50 1y4s h VAL 356 Ca 0.10 -2.55 -0.07 0.00 0.82 0.00 0.00 66.70 65.00 1y4s h VAL 356 Cb 0.55 2.96 -0.02 0.00 -1.52 0.00 0.00 31.29 33.26 1y4s h VAL 356 CO -0.00 0.76 0.10 -0.07 0.02 0.00 0.00 177.57 178.37 1y4s h LEU 357 N 0.04 0.94 -0.69 2.57 3.38 -1.16 0.22 115.31 120.61 1y4s h LEU 357 Ca -0.20 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 1y4s h LEU 357 Cb 1.91 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 42.38 1y4s h LEU 357 CO 0.23 0.96 0.27 1.56 0.09 0.00 0.00 178.44 181.55 1y4s h GLN 358 N 0.88 1.04 -0.75 1.13 4.20 -0.84 0.40 115.11 121.17 1y4s h GLN 358 Ca 0.18 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 1y4s h GLN 358 Cb 0.42 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 1y4s h GLN 358 CO 0.01 0.86 0.31 1.98 -0.67 0.00 0.00 178.83 181.32 1y4s h MET 359 N 0.99 1.11 -0.39 1.46 4.05 -0.82 -1.72 114.93 119.61 1y4s h MET 359 Ca 0.23 -0.20 -0.08 0.00 -0.28 0.00 0.00 59.70 59.37 1y4s h MET 359 Cb 0.21 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 1y4s h MET 359 CO -0.02 0.90 -0.09 -0.07 0.23 0.00 0.00 176.91 177.86 1y4s h LEU 360 N 1.07 0.75 -0.07 3.39 3.38 0.13 -1.75 115.31 122.21 1y4s h LEU 360 Ca 0.25 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1y4s h LEU 360 Cb 0.20 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1y4s h LEU 360 CO -0.02 0.94 0.02 -0.08 0.09 0.00 0.00 178.44 179.39 1y4s h GLU 361 N 0.55 0.06 -0.78 1.13 4.57 -0.04 -0.88 114.58 119.19 1y4s h GLU 361 Ca 0.10 -0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.33 1y4s h GLU 361 Cb 0.61 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.14 1y4s h GLU 361 CO 0.04 0.04 0.51 -0.22 -1.18 0.00 0.00 179.01 178.20 1y4s h LYS 362 N 0.06 0.85 0.67 1.92 3.64 -1.28 -2.93 116.57 119.50 1y4s h LYS 362 Ca 0.03 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1y4s h LYS 362 Cb 0.02 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 31.65 1y4s h LYS 362 CO -0.03 0.56 -0.32 1.25 -2.27 0.00 0.00 179.45 178.64 1y4s h LEU 363 N 0.87 -0.76 -1.53 5.20 5.85 -0.64 -2.70 115.31 121.60 1y4s h LEU 363 Ca 0.33 0.03 0.16 0.00 0.84 0.00 0.00 57.88 59.23 1y4s h LEU 363 Cb 0.18 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1y4s h LEU 363 CO -0.11 -0.41 0.74 0.00 -0.34 0.00 0.00 178.44 178.32 1y4s h ALA 364 N -1.31 2.31 0.03 1.25 0.00 -1.05 -1.03 119.26 119.45 1y4s h ALA 364 Ca -0.09 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1y4s h ALA 364 Cb 0.69 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1y4s h ALA 364 CO 0.15 -1.02 -0.96 0.87 0.00 0.00 0.00 179.25 178.30 1y4s h LYS 365 N 0.00 0.06 -0.25 0.00 1.57 -1.48 -3.38 116.57 113.10 1y4s h LYS 365 Ca 0.26 -0.11 -0.10 0.00 -1.87 0.00 0.00 60.65 58.83 1y4s h LYS 365 Cb 1.73 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 34.07 1y4s h LYS 365 CO -0.00 1.05 -0.23 -0.44 -0.57 0.00 0.00 179.45 179.26 1y4s h ASP 366 N -0.82 0.64 -2.77 0.86 5.19 -0.92 -3.42 116.42 115.18 1y4s h ASP 366 Ca -0.24 -0.46 -0.50 0.00 -0.62 0.00 0.00 57.03 55.21 1y4s h ASP 366 Cb 1.34 -0.18 -0.39 0.00 0.18 0.00 0.00 39.33 40.28 1y4s h ASP 366 CO -0.08 0.97 -0.76 -0.62 -3.12 0.00 0.00 179.24 175.63 1y4s s ASP 367 N -6.40 3.13 0.16 6.45 2.15 -0.50 -5.00 116.67 116.66 1y4s s ASP 367 Ca -0.13 -1.10 -0.07 0.00 0.43 0.00 0.00 52.55 51.68 1y4s s ASP 367 Cb 0.08 -0.24 0.03 0.00 -0.30 0.00 0.00 42.92 42.48 1y4s s ASP 367 CO 0.80 -0.42 1.47 0.00 -0.17 0.00 0.00 175.17 176.86 1y4s h ALA 368 N 8.40 0.60 -0.31 3.66 0.00 -1.78 -1.00 119.26 128.83 1y4s h ALA 368 Ca -0.19 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.20 1y4s h ALA 368 Cb 1.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1y4s h ALA 368 CO 0.40 0.68 0.10 1.05 0.00 0.00 0.00 179.25 181.48 1y4s h GLU 369 N 0.55 0.44 0.01 0.00 4.11 -1.94 0.79 114.58 118.54 1y4s h GLU 369 Ca 0.02 -0.06 -0.18 0.00 0.07 0.00 0.00 59.36 59.21 1y4s h GLU 369 Cb 1.10 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.28 1y4s h GLU 369 CO 0.11 0.40 -0.70 0.87 0.07 0.00 0.00 179.01 179.75 1y4s h LYS 370 N 0.44 0.47 -0.92 1.06 1.57 -1.92 -3.01 116.57 114.25 1y4s h LYS 370 Ca 0.11 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 1y4s h LYS 370 Cb 0.14 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 1y4s h LYS 370 CO -0.01 1.16 0.55 -0.92 -0.57 0.00 0.00 179.45 179.66 1y4s h TYR 371 N -0.01 1.23 -0.46 -1.35 3.20 -0.30 -0.60 116.97 118.68 1y4s h TYR 371 Ca -0.09 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.76 1y4s h TYR 371 Cb 1.41 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 1y4s h TYR 371 CO 0.14 0.82 0.23 1.96 -1.64 0.00 0.00 178.16 179.67 1y4s h GLN 372 N 1.28 0.63 0.21 1.82 1.08 0.52 0.38 115.11 121.04 1y4s h GLN 372 Ca 0.33 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.45 1y4s h GLN 372 Cb -0.04 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.27 1y4s h GLN 372 CO -0.06 0.48 -0.10 1.15 -0.95 0.00 0.00 178.83 179.35 1y4s h THR 373 N 0.64 0.85 -0.47 -0.54 2.02 -1.11 -1.93 112.91 112.37 1y4s h THR 373 Ca 0.16 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 67.07 1y4s h THR 373 Cb 0.05 1.07 -0.10 0.00 -1.74 0.00 0.00 68.15 67.43 1y4s h THR 373 CO -0.02 0.08 -0.28 0.15 0.37 0.00 0.00 175.52 175.82 1y4s h PHE 374 N -0.47 -0.75 -0.57 3.16 3.57 0.36 -1.35 116.94 120.89 1y4s h PHE 374 Ca -0.03 0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.62 1y4s h PHE 374 Cb 0.35 0.40 -0.07 0.00 2.79 0.00 0.00 35.95 39.43 1y4s h PHE 374 CO -0.01 -0.35 0.20 2.35 -2.23 0.00 0.00 178.31 178.27 1y4s h TRP 375 N -0.18 0.35 0.22 0.41 2.91 -0.10 -0.08 115.95 119.49 1y4s h TRP 375 Ca 0.21 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.26 1y4s h TRP 375 Cb 0.51 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.08 1y4s h TRP 375 CO -0.54 0.09 -0.18 1.96 -1.03 0.00 0.00 178.44 178.74 1y4s h GLN 376 N 0.38 -0.40 -0.05 2.65 4.20 -0.46 0.16 115.11 121.58 1y4s h GLN 376 Ca 0.29 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.02 1y4s h GLN 376 Cb 0.35 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1y4s h GLN 376 CO -0.30 -0.27 0.02 1.96 -0.67 0.00 0.00 178.83 179.58 1y4s h GLN 377 N -0.42 0.08 -0.92 1.46 1.08 -1.10 -3.31 115.11 111.97 1y4s h GLN 377 Ca -0.01 -0.01 -0.59 0.00 -1.45 0.00 0.00 58.65 56.59 1y4s h GLN 377 Cb 0.38 -0.01 -0.39 0.00 -0.05 0.00 0.00 27.48 27.40 1y4s h GLN 377 CO -0.02 0.19 -0.36 1.19 -0.95 0.00 0.00 178.83 178.89 1y4s n PHE 378 N -4.98 2.93 0.24 2.96 3.01 -0.07 -4.77 117.46 116.79 1y4s n PHE 378 Ca -0.06 -2.50 -0.11 0.00 1.01 0.00 0.00 57.45 55.79 1y4s n PHE 378 Cb 0.10 -0.60 -0.06 0.00 -0.01 0.00 0.00 39.48 38.91 1y4s n PHE 378 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1y4s h GLY 379 N 2.20 -0.69 1.79 1.37 0.00 -0.77 -3.25 103.07 103.72 1y4s h GLY 379 Ca 0.43 0.26 0.00 0.00 0.00 0.00 0.00 47.33 48.01 1y4s h GLY 379 CO 0.99 -0.25 0.00 1.04 0.00 0.00 0.00 176.54 178.31 1y4s n LEU 380 N -5.22 0.00 -0.01 3.11 4.32 -1.26 -2.65 117.00 115.28 1y4s n LEU 380 Ca -0.09 0.39 -0.11 0.00 -0.02 0.00 0.00 56.01 56.19 1y4s n LEU 380 Cb 0.28 -0.39 -0.14 0.00 -1.62 0.00 0.00 43.42 41.54 1y4s n LEU 380 CO 0.22 -0.20 -0.55 0.58 -1.22 0.00 0.00 177.39 176.22 1y4s h VAL 381 N 0.00 0.84 0.00 4.08 2.07 -1.93 -3.30 116.25 118.02 1y4s h VAL 381 Ca 0.00 -2.66 -0.12 0.00 0.82 0.00 0.00 66.70 64.73 1y4s h VAL 381 Cb 0.19 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 1y4s h VAL 381 CO 0.00 0.58 -0.67 0.25 0.02 0.00 0.00 177.57 177.75 1y4s h LEU 382 N 0.01 0.00 -0.54 2.57 5.85 -1.56 -3.32 115.31 118.33 1y4s h LEU 382 Ca -0.30 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.29 1y4s h LEU 382 Cb 2.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.03 1y4s h LEU 382 CO 0.09 0.56 -0.23 0.11 -0.34 0.00 0.00 178.44 178.63 1y4s h LYS 383 N 0.00 0.94 0.00 1.25 1.57 -1.62 -1.67 116.57 117.04 1y4s h LYS 383 Ca -0.03 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1y4s h LYS 383 Cb 1.45 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.73 1y4s h LYS 383 CO 0.07 1.06 0.00 -0.85 -0.57 0.00 0.00 179.45 179.16 1y4s n GLU 384 N -4.11 0.63 0.00 3.15 0.28 -1.24 -4.00 120.64 115.35 1y4s n GLU 384 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1y4s n GLU 384 Cb 0.46 -1.10 0.00 0.00 1.43 0.00 0.00 31.44 32.23 1y4s n GLU 384 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1y4s n GLY 385 N 0.15 -1.43 2.02 -1.84 0.00 -0.63 -3.77 105.19 99.69 1y4s n GLY 385 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 1y4s n GLY 385 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1y4s n PRO 386 N -1.65 0.63 0.00 1.61 -0.04 -1.26 -2.07 135.00 132.21 1y4s n PRO 386 Ca 0.00 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1y4s n PRO 386 Cb 0.00 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1y4s n PRO 386 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y4s n ALA 387 N 2.25 1.57 -1.81 0.55 0.00 -1.25 -4.46 120.51 117.36 1y4s n ALA 387 Ca 0.09 -0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.17 1y4s n ALA 387 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.73 1y4s n ALA 387 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1y4s n GLU 388 N -0.02 0.00 -2.72 0.00 2.13 -0.88 -5.03 120.64 114.12 1y4s n GLU 388 Ca 0.00 -0.26 -0.07 0.00 0.66 0.00 0.00 57.16 57.49 1y4s n GLU 388 Cb 0.11 0.17 0.06 0.00 0.27 0.00 0.00 31.44 32.05 1y4s n GLU 388 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1y4s n ASP 389 N 0.00 -2.39 0.08 4.31 -0.08 -1.23 -4.99 116.55 112.25 1y4s n ASP 389 Ca -0.07 -2.95 0.09 0.00 -1.51 0.00 0.00 54.79 50.35 1y4s n ASP 389 Cb 0.46 1.57 0.40 0.00 2.34 0.00 0.00 41.12 45.89 1y4s n ASP 389 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1y4s n PHE 390 N 1.38 0.47 -0.27 -0.67 1.16 -1.26 -3.55 117.46 114.72 1y4s n PHE 390 Ca 0.06 0.20 -0.06 0.00 -1.87 0.00 0.00 57.45 55.78 1y4s n PHE 390 Cb 0.66 -0.82 -0.01 0.00 -1.61 0.00 0.00 39.48 37.71 1y4s n PHE 390 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1y4s h ALA 391 N 2.29 -0.13 -0.64 1.98 0.00 -2.00 -1.64 119.26 119.13 1y4s h ALA 391 Ca 0.00 0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1y4s h ALA 391 Cb 0.26 0.96 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 1y4s h ALA 391 CO 0.00 -0.74 0.16 0.09 0.00 0.00 0.00 179.25 178.76 1y4s n ASN 392 N -5.42 4.94 -0.42 0.00 3.02 -1.23 -4.81 115.26 111.33 1y4s n ASN 392 Ca 0.05 -3.15 0.35 0.00 -0.03 0.00 0.00 54.58 51.80 1y4s n ASN 392 Cb 0.36 -0.71 0.62 0.00 -0.61 0.00 0.00 39.78 39.44 1y4s n ASN 392 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 1y4s h GLN 393 N 2.91 0.11 0.26 3.52 4.15 -1.44 -2.24 115.11 122.38 1y4s h GLN 393 Ca 0.17 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 1y4s h GLN 393 Cb 2.14 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.81 1y4s h GLN 393 CO 0.61 0.07 -0.12 1.49 -1.93 0.00 0.00 178.83 178.95 1y4s h GLU 394 N 0.11 -0.33 -0.82 1.69 4.81 -1.87 -2.18 114.58 115.99 1y4s h GLU 394 Ca 0.80 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 60.26 1y4s h GLU 394 Cb 2.42 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 31.83 1y4s h GLU 394 CO -0.45 0.02 0.56 0.00 -0.73 0.00 0.00 179.01 178.41 1y4s h ALA 395 N -0.40 2.42 0.00 2.92 0.00 -1.82 0.26 119.26 122.64 1y4s h ALA 395 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1y4s h ALA 395 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1y4s h ALA 395 CO 0.06 -0.66 0.00 0.82 0.00 0.00 0.00 179.25 179.47 1y4s h ILE 396 N 0.23 0.00 0.12 0.00 2.04 -1.43 -2.53 117.51 115.93 1y4s h ILE 396 Ca 0.41 -0.67 -0.35 0.00 1.00 0.00 0.00 64.86 65.24 1y4s h ILE 396 Cb 1.24 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.97 1y4s h ILE 396 CO -0.09 0.00 -1.92 0.00 0.00 0.00 0.00 178.15 176.14 1y4s h ALA 397 N 2.31 0.43 -0.79 1.87 0.00 0.12 -3.26 119.26 119.93 1y4s h ALA 397 Ca 0.00 -1.36 -0.02 0.00 0.00 0.00 0.00 54.91 53.53 1y4s h ALA 397 Cb 0.82 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 1y4s h ALA 397 CO 0.00 1.30 0.40 0.87 0.00 0.00 0.00 179.25 181.82 1y4s h LYS 398 N 0.07 1.12 0.00 0.00 1.57 -1.20 -2.23 116.57 115.90 1y4s h LYS 398 Ca -0.39 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.17 1y4s h LYS 398 Cb 2.04 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 34.13 1y4s h LYS 398 CO 0.10 0.85 -0.34 -0.07 -0.57 0.00 0.00 179.45 179.42 1y4s h LEU 399 N 1.12 0.00 -9.91 2.94 3.38 -1.59 -3.44 115.31 107.81 1y4s h LEU 399 Ca 0.27 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.71 1y4s h LEU 399 Cb 0.08 0.00 0.09 0.00 0.09 0.00 0.00 40.66 40.93 1y4s h LEU 399 CO -0.04 0.34 0.76 -0.76 0.09 0.00 0.00 178.44 178.83 1y4s s LEU 400 N -7.97 4.35 0.11 1.67 1.43 -0.84 -5.05 118.68 112.38 1y4s s LEU 400 Ca -0.03 2.94 0.08 0.00 -1.03 0.00 0.00 54.13 56.10 1y4s s LEU 400 Cb 0.14 -3.66 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 1y4s s LEU 400 CO 0.70 -0.79 -0.19 -0.13 0.23 0.00 0.00 176.35 176.17 1y4s s ARG 401 N -1.79 1.11 0.31 1.70 1.81 -1.26 -4.24 118.95 116.60 1y4s s ARG 401 Ca 0.53 -1.19 0.04 0.00 -1.72 0.00 0.00 55.73 53.39 1y4s s ARG 401 Cb -0.45 -1.29 -0.03 0.00 -0.45 0.00 0.00 34.95 32.73 1y4s s ARG 401 CO 0.58 0.29 0.19 -0.06 -0.68 0.00 0.00 175.30 175.63 1y4s s PHE 402 N -1.41 1.63 -0.22 -0.53 0.08 0.53 -4.93 117.98 113.13 1y4s s PHE 402 Ca 0.07 -1.46 -0.07 0.00 0.12 0.00 0.00 56.93 55.60 1y4s s PHE 402 Cb -0.09 -0.82 -0.03 0.00 -0.57 0.00 0.00 43.02 41.51 1y4s s PHE 402 CO 0.04 -0.63 0.05 0.00 -0.10 0.00 0.00 175.22 174.59 1y4s s ALA 403 N -3.56 3.21 0.46 5.36 0.00 -1.26 -1.77 121.76 124.20 1y4s s ALA 403 Ca 0.36 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.41 1y4s s ALA 403 Cb 0.04 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 1y4s s ALA 403 CO 0.20 -0.19 0.22 0.45 0.00 0.00 0.00 175.76 176.45 1y4s s SER 404 N 1.06 4.47 0.26 0.00 0.15 -1.26 0.39 113.70 118.77 1y4s s SER 404 Ca 0.04 -1.19 0.25 0.00 0.70 0.00 0.00 55.95 55.74 1y4s s SER 404 Cb -0.14 -0.09 0.52 0.00 -1.71 0.00 0.00 66.02 64.59 1y4s s SER 404 CO 0.03 -0.75 1.58 0.74 1.20 0.00 0.00 173.24 176.04 1y4s h THR 405 N 1.21 0.00 -0.36 6.45 2.02 -1.78 -3.18 112.91 117.28 1y4s h THR 405 Ca -0.41 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 1y4s h THR 405 Cb 1.28 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 69.23 1y4s h THR 405 CO 0.67 0.00 0.20 -0.74 0.37 0.00 0.00 175.52 176.02 1y4s h HIS 406 N 0.00 0.49 -3.68 3.16 6.17 -1.96 -3.41 115.15 115.93 1y4s h HIS 406 Ca 0.00 -0.01 -0.50 0.00 0.71 0.00 0.00 60.37 60.57 1y4s h HIS 406 Cb 0.84 -0.16 -0.02 0.00 2.52 0.00 0.00 27.41 30.59 1y4s h HIS 406 CO 0.00 0.38 0.27 0.95 0.71 0.00 0.00 177.93 180.25 1y4s s THR 407 N -5.88 4.22 -1.00 6.26 -4.23 -1.20 -4.94 115.64 108.87 1y4s s THR 407 Ca -0.13 1.87 -0.02 0.00 -1.18 0.00 0.00 61.69 62.22 1y4s s THR 407 Cb 0.10 -4.19 0.26 0.00 1.34 0.00 0.00 72.50 70.01 1y4s s THR 407 CO 0.73 0.44 2.08 0.47 -0.54 0.00 0.00 174.62 177.80 1y4s n ASP 408 N 1.35 7.46 -3.24 3.99 9.92 -1.26 -4.79 116.55 129.98 1y4s n ASP 408 Ca -0.03 -3.56 -0.10 0.00 -0.53 0.00 0.00 54.79 50.57 1y4s n ASP 408 Cb 0.48 -1.19 -0.01 0.00 -0.64 0.00 0.00 41.12 39.76 1y4s n ASP 408 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1y4s s SER 409 N -0.76 0.24 0.00 -2.24 1.04 -1.26 -5.00 113.70 105.72 1y4s s SER 409 Ca 0.47 -1.17 0.21 0.00 0.48 0.00 0.00 55.95 55.95 1y4s s SER 409 Cb 0.26 0.75 0.21 0.00 0.10 0.00 0.00 66.02 67.35 1y4s s SER 409 CO -0.19 -1.47 1.21 -0.24 0.98 0.00 0.00 173.24 173.53 1y4s n SER 410 N -1.19 2.90 -4.65 7.02 2.88 -1.26 -4.77 113.62 114.54 1y4s n SER 410 Ca -0.04 -1.91 -0.42 0.00 -1.33 0.00 0.00 58.87 55.17 1y4s n SER 410 Cb 0.60 -0.05 -0.03 0.00 -0.75 0.00 0.00 64.21 63.99 1y4s n SER 410 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y4s s ALA 411 N -1.71 3.48 -1.29 -1.46 0.00 -1.26 -4.81 121.76 114.71 1y4s s ALA 411 Ca 0.27 1.23 -0.09 0.00 0.00 0.00 0.00 51.96 53.38 1y4s s ALA 411 Cb 0.18 -3.87 -0.12 0.00 0.00 0.00 0.00 23.12 19.32 1y4s s ALA 411 CO 0.27 -1.70 3.02 1.04 0.00 0.00 0.00 175.76 178.39 1y4s n GLN 412 N 7.66 3.29 -0.37 0.00 6.02 -1.26 -4.38 117.38 128.35 1y4s n GLN 412 Ca 0.21 -1.93 0.08 0.00 -0.01 0.00 0.00 57.00 55.34 1y4s n GLN 412 Cb 0.42 -2.63 0.25 0.00 1.02 0.00 0.00 30.24 29.29 1y4s n GLN 412 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 1y4s n THR 413 N 3.42 1.04 -4.92 5.09 5.66 -1.11 -4.22 114.28 119.23 1y4s n THR 413 Ca 0.70 -0.78 -0.32 0.00 -3.05 0.00 0.00 64.05 60.60 1y4s n THR 413 Cb 0.34 0.17 -0.16 0.00 -1.55 0.00 0.00 70.33 69.13 1y4s n THR 413 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1y4s s VAL 414 N -1.55 2.23 0.42 1.08 1.01 -0.73 -4.95 120.40 117.91 1y4s s VAL 414 Ca 0.36 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.36 1y4s s VAL 414 Cb 0.21 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1y4s s VAL 414 CO 0.21 0.55 0.69 -0.94 0.00 0.00 0.00 175.10 175.60 1y4s s SER 415 N 0.55 6.30 0.36 3.32 1.04 -1.26 -0.35 113.70 123.66 1y4s s SER 415 Ca -0.13 0.77 0.06 0.00 0.48 0.00 0.00 55.95 57.13 1y4s s SER 415 Cb -0.17 -2.17 0.70 0.00 0.10 0.00 0.00 66.02 64.48 1y4s s SER 415 CO 0.04 -0.45 1.92 -0.07 0.98 0.00 0.00 173.24 175.66 1y4s h LEU 416 N 0.57 0.42 -1.71 2.42 3.38 -1.84 0.43 115.31 118.97 1y4s h LEU 416 Ca -0.48 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.39 1y4s h LEU 416 Cb 1.21 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1y4s h LEU 416 CO 0.62 0.48 -0.18 -0.33 0.09 0.00 0.00 178.44 179.12 1y4s h GLU 417 N 0.44 0.00 -0.23 1.13 5.08 -1.93 0.87 114.58 119.93 1y4s h GLU 417 Ca 0.10 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.28 1y4s h GLU 417 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1y4s h GLU 417 CO 0.01 0.18 -0.57 -0.44 -1.00 0.00 0.00 179.01 177.19 1y4s h ASP 418 N 0.00 0.82 -0.50 1.42 3.32 -1.32 -2.31 116.42 117.85 1y4s h ASP 418 Ca -0.00 -0.45 -0.11 0.00 0.02 0.00 0.00 57.03 56.49 1y4s h ASP 418 Cb 0.39 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1y4s h ASP 418 CO 0.02 1.22 -0.11 0.22 -1.72 0.00 0.00 179.24 178.87 1y4s h TYR 419 N 0.56 1.09 0.33 4.55 3.20 -0.19 -3.21 116.97 123.31 1y4s h TYR 419 Ca 0.01 -0.22 -0.02 0.00 3.14 0.00 0.00 58.73 61.64 1y4s h TYR 419 Cb 1.15 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.16 1y4s h TYR 419 CO 0.06 1.02 -0.16 0.28 -1.64 0.00 0.00 178.16 177.72 1y4s h VAL 420 N 0.87 0.62 0.00 1.81 2.07 -0.91 -3.11 116.25 117.61 1y4s h VAL 420 Ca 0.14 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1y4s h VAL 420 Cb 0.66 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1y4s h VAL 420 CO 0.05 0.11 0.00 -1.20 0.02 0.00 0.00 177.57 176.55 1y4s n SER 421 N -5.13 0.00 -1.06 0.57 7.64 -0.87 -0.89 113.62 113.88 1y4s n SER 421 Ca -0.09 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.83 1y4s n SER 421 Cb 0.27 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.56 1y4s n SER 421 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1y4s n ARG 422 N -0.87 0.59 -0.05 1.43 1.74 -1.18 -5.07 116.66 113.26 1y4s n ARG 422 Ca 0.00 -2.39 0.00 0.00 -0.77 0.00 0.00 57.85 54.69 1y4s n ARG 422 Cb 0.00 -0.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.79 1y4s n ARG 422 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1y4s n MET 423 N -0.17 0.84 0.00 5.56 2.81 -0.06 -4.77 117.12 121.32 1y4s n MET 423 Ca 0.10 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1y4s n MET 423 Cb 0.94 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.45 1y4s n MET 423 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1y4s n LYS 424 N -0.37 0.00 -3.70 0.03 5.02 -1.26 -5.09 118.16 112.79 1y4s n LYS 424 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1y4s n LYS 424 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.84 1y4s n LYS 424 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1y4s s GLU 425 N 2.37 -0.03 0.00 1.97 -1.05 -1.26 -4.69 118.70 116.01 1y4s s GLU 425 Ca 0.00 0.36 0.00 0.00 -0.15 0.00 0.00 54.97 55.18 1y4s s GLU 425 Cb 0.00 -0.36 0.00 0.00 -0.44 0.00 0.00 34.13 33.33 1y4s s GLU 425 CO 0.00 -0.27 0.00 0.41 0.95 0.00 0.00 175.26 176.35 1y4s n GLY 426 N 4.90 1.36 0.00 -3.83 0.00 -1.26 -5.11 105.19 101.26 1y4s n GLY 426 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1y4s n GLY 426 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y4s n GLN 427 N -0.24 0.00 0.00 1.61 6.02 -1.26 -4.82 117.38 118.69 1y4s n GLN 427 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1y4s n GLN 427 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1y4s n GLN 427 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1y4s n GLU 428 N 0.00 0.00 -3.88 -1.09 1.02 -1.26 -4.94 120.64 110.49 1y4s n GLU 428 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1y4s n GLU 428 Cb 0.00 -1.91 -0.07 0.00 -0.02 0.00 0.00 31.44 29.45 1y4s n GLU 428 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1y4s s LYS 429 N 0.00 0.96 -0.33 3.49 1.02 -1.26 -3.41 119.74 120.21 1y4s s LYS 429 Ca 0.00 -1.01 -0.01 0.00 0.02 0.00 0.00 55.97 54.97 1y4s s LYS 429 Cb 0.00 0.36 0.07 0.00 -0.52 0.00 0.00 37.83 37.75 1y4s s LYS 429 CO 0.00 -0.33 0.06 0.42 -0.92 0.00 0.00 175.35 174.58 1y4s s ILE 430 N -3.89 2.92 -0.05 2.17 1.01 -0.94 -4.99 121.20 117.43 1y4s s ILE 430 Ca 0.09 -1.72 -0.18 0.00 0.00 0.00 0.00 60.65 58.84 1y4s s ILE 430 Cb 0.04 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 1y4s s ILE 430 CO -0.07 -0.33 0.50 -0.31 0.00 0.00 0.00 174.94 174.73 1y4s s TYR 431 N 1.16 3.62 0.48 3.97 1.51 -1.26 -1.94 117.35 124.90 1y4s s TYR 431 Ca 0.00 1.02 0.01 0.00 -1.01 0.00 0.00 57.07 57.10 1y4s s TYR 431 Cb -0.21 -2.51 -0.01 0.00 -0.11 0.00 0.00 41.96 39.13 1y4s s TYR 431 CO -0.03 0.34 0.05 2.48 -1.11 0.00 0.00 175.55 177.28 1y4s n TYR 432 N 2.92 0.83 -3.70 2.71 0.18 -1.11 -1.21 117.16 117.78 1y4s n TYR 432 Ca -0.09 -2.55 -0.11 0.00 1.88 0.00 0.00 57.90 57.04 1y4s n TYR 432 Cb 0.52 -0.22 -0.12 0.00 -0.38 0.00 0.00 39.34 39.13 1y4s n TYR 432 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1y4s s ILE 433 N -2.92 -0.14 -0.53 -3.48 1.01 -0.66 -3.18 121.20 111.29 1y4s s ILE 433 Ca 0.07 0.14 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 1y4s s ILE 433 Cb 0.00 -0.51 0.14 0.00 0.01 0.00 0.00 42.46 42.10 1y4s s ILE 433 CO 0.05 0.06 0.37 -0.89 0.00 0.00 0.00 174.94 174.53 1y4s s THR 434 N 1.60 3.85 0.00 2.92 2.01 -1.26 -1.88 115.64 122.89 1y4s s THR 434 Ca -0.07 -2.34 0.00 0.00 0.31 0.00 0.00 61.69 59.59 1y4s s THR 434 Cb -0.10 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 68.87 1y4s s THR 434 CO -0.11 -0.81 0.00 0.00 -0.69 0.00 0.00 174.62 173.02 1y4s n ALA 435 N 4.24 0.00 -0.00 7.40 0.00 -1.04 -5.04 120.51 126.07 1y4s n ALA 435 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.45 1y4s n ALA 435 Cb 0.40 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.85 1y4s n ALA 435 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1y4s n ASP 436 N 0.00 0.03 -4.91 0.00 8.00 -1.26 -4.63 116.55 113.78 1y4s n ASP 436 Ca 0.00 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.18 1y4s n ASP 436 Cb 0.00 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.12 40.70 1y4s n ASP 436 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1y4s s SER 437 N -4.33 6.34 0.42 -2.24 0.15 -1.26 -4.50 113.70 108.27 1y4s s SER 437 Ca -0.00 0.30 0.28 0.00 0.70 0.00 0.00 55.95 57.23 1y4s s SER 437 Cb 0.00 -1.97 1.41 0.00 -1.71 0.00 0.00 66.02 63.76 1y4s s SER 437 CO 0.00 0.22 1.60 0.22 1.20 0.00 0.00 173.24 176.48 1y4s h TYR 438 N 3.49 0.61 -0.21 3.44 3.20 -1.94 0.84 116.97 126.40 1y4s h TYR 438 Ca -0.47 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.41 1y4s h TYR 438 Cb 1.17 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 1y4s h TYR 438 CO 0.64 -0.30 0.08 0.00 -1.64 0.00 0.00 178.16 176.94 1y4s h ALA 439 N 1.71 0.28 0.00 1.82 0.00 -1.99 -1.85 119.26 119.23 1y4s h ALA 439 Ca 0.85 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.64 1y4s h ALA 439 Cb 2.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.25 1y4s h ALA 439 CO -0.53 -0.12 0.00 0.00 0.00 0.00 0.00 179.25 178.60 1y4s n ALA 440 N -2.25 1.78 0.00 0.00 0.00 0.29 -2.48 120.51 117.85 1y4s n ALA 440 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1y4s n ALA 440 Cb 0.13 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1y4s n ALA 440 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y4s n ALA 441 N -0.89 0.96 0.55 0.00 0.00 -1.03 -4.41 120.51 115.69 1y4s n ALA 441 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.59 1y4s n ALA 441 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.42 1y4s n ALA 441 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1y4s n LYS 442 N -0.57 0.30 0.00 0.00 4.81 -0.72 -4.73 118.16 117.24 1y4s n LYS 442 Ca 0.00 -0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 1y4s n LYS 442 Cb 0.00 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 33.50 1y4s n LYS 442 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1y4s n SER 443 N -1.91 0.00 0.00 3.14 7.64 -1.16 -4.92 113.62 116.41 1y4s n SER 443 Ca 0.01 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.93 1y4s n SER 443 Cb 0.44 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 63.87 1y4s n SER 443 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1y4s n SER 444 N -0.26 0.00 0.00 6.43 2.88 -1.25 -4.87 113.62 116.56 1y4s n SER 444 Ca 0.00 -1.24 0.00 0.00 -1.33 0.00 0.00 58.87 56.30 1y4s n SER 444 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1y4s n SER 444 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1y4s n PRO 445 N -0.66 0.00 -1.51 -1.46 -0.04 -1.26 -4.98 135.00 125.08 1y4s n PRO 445 Ca 0.06 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.54 1y4s n PRO 445 Cb 0.03 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 33.55 1y4s n PRO 445 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1y4s n HIS 446 N 0.00 0.29 0.31 0.54 8.25 -1.26 -4.79 115.22 118.55 1y4s n HIS 446 Ca 0.00 -1.01 0.17 0.00 -0.26 0.00 0.00 57.72 56.62 1y4s n HIS 446 Cb 0.00 -0.19 0.76 0.00 1.12 0.00 0.00 29.99 31.68 1y4s n HIS 446 CO 0.00 0.00 0.00 1.37 0.64 0.00 0.00 176.34 178.35 1y4s h LEU 447 N 1.27 0.00 -2.01 2.41 8.10 -1.95 -2.66 115.31 120.46 1y4s h LEU 447 Ca -0.14 0.00 0.10 0.00 0.11 0.00 0.00 57.88 57.94 1y4s h LEU 447 Cb 1.61 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.82 1y4s h LEU 447 CO 0.12 0.00 0.24 -0.08 -4.11 0.00 0.00 178.44 174.61 1y4s h GLU 448 N 0.00 0.00 -0.80 0.17 4.81 -1.97 0.79 114.58 117.58 1y4s h GLU 448 Ca 0.00 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1y4s h GLU 448 Cb 0.32 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.65 1y4s h GLU 448 CO 0.00 0.00 0.53 -0.07 -0.73 0.00 0.00 179.01 178.74 1y4s h LEU 449 N 0.00 0.75 0.17 1.64 3.38 -1.88 -1.50 115.31 117.87 1y4s h LEU 449 Ca 0.16 0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.80 1y4s h LEU 449 Cb 0.64 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1y4s h LEU 449 CO -0.00 0.48 -1.63 -0.07 0.09 0.00 0.00 178.44 177.31 1y4s h LEU 450 N 0.85 0.56 -2.02 1.67 3.38 0.27 -3.35 115.31 116.67 1y4s h LEU 450 Ca 0.35 -0.78 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 1y4s h LEU 450 Cb 0.27 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1y4s h LEU 450 CO -0.13 1.65 -0.07 -0.09 0.09 0.00 0.00 178.44 179.89 1y4s h ARG 451 N 0.10 0.00 0.00 1.13 1.12 -0.37 -0.13 114.38 116.23 1y4s h ARG 451 Ca -0.29 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.56 1y4s h ARG 451 Cb 2.08 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 32.04 1y4s h ARG 451 CO 0.19 0.07 -0.08 -0.22 -3.11 0.00 0.00 179.97 176.82 1y4s h LYS 452 N 0.00 0.00 0.00 0.20 3.64 -1.42 -3.07 116.57 115.92 1y4s h LYS 452 Ca -0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1y4s h LYS 452 Cb 0.13 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1y4s h LYS 452 CO 0.01 0.08 -1.91 1.63 -2.27 0.00 0.00 179.45 176.99 1y4s n LYS 453 N -3.21 0.63 -0.94 1.90 5.02 -0.20 -5.03 118.16 116.33 1y4s n LYS 453 Ca 0.00 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.13 1y4s n LYS 453 Cb 0.34 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1y4s n LYS 453 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y4s n GLY 454 N 1.46 0.76 3.49 0.72 0.00 -0.38 -5.10 105.19 106.14 1y4s n GLY 454 Ca -0.06 -0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1y4s n GLY 454 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y4s s ILE 455 N -2.15 3.16 0.25 -0.61 1.01 -1.13 -4.95 121.20 116.78 1y4s s ILE 455 Ca 0.00 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.67 1y4s s ILE 455 Cb 0.00 -2.25 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 1y4s s ILE 455 CO 0.00 0.59 1.12 -0.70 0.00 0.00 0.00 174.94 175.95 1y4s s GLU 456 N -0.72 4.60 -0.08 2.79 2.12 -1.26 -4.55 118.70 121.60 1y4s s GLU 456 Ca 0.11 1.81 0.02 0.00 0.36 0.00 0.00 54.97 57.28 1y4s s GLU 456 Cb -0.11 -3.21 0.01 0.00 0.26 0.00 0.00 34.13 31.09 1y4s s GLU 456 CO 0.01 0.13 -0.15 0.08 -0.54 0.00 0.00 175.26 174.79 1y4s s VAL 457 N -0.85 1.36 -0.38 3.70 1.01 -1.26 -4.41 120.40 119.57 1y4s s VAL 457 Ca 0.47 -0.60 -0.25 0.00 0.00 0.00 0.00 61.98 61.60 1y4s s VAL 457 Cb -0.32 -1.23 0.02 0.00 0.00 0.00 0.00 36.38 34.85 1y4s s VAL 457 CO 0.40 0.41 0.89 -0.76 0.00 0.00 0.00 175.10 176.03 1y4s s LEU 458 N 0.68 4.04 -0.91 3.92 1.43 -0.35 -1.97 118.68 125.52 1y4s s LEU 458 Ca -0.14 0.46 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 1y4s s LEU 458 Cb -0.16 -3.19 0.13 0.00 0.03 0.00 0.00 46.19 43.00 1y4s s LEU 458 CO 0.04 -0.85 1.11 -0.76 0.23 0.00 0.00 176.35 176.11 1y4s s LEU 459 N 3.41 5.08 -0.05 1.79 1.43 0.16 -1.66 118.68 128.85 1y4s s LEU 459 Ca 0.36 -2.01 -0.19 0.00 -1.03 0.00 0.00 54.13 51.26 1y4s s LEU 459 Cb -0.12 -2.39 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 1y4s s LEU 459 CO 0.19 -1.07 0.51 -0.76 0.23 0.00 0.00 176.35 175.46 1y4s s LEU 460 N 2.67 4.38 -0.01 1.79 1.43 -0.79 -4.26 118.68 123.89 1y4s s LEU 460 Ca 0.32 0.99 0.17 0.00 -1.03 0.00 0.00 54.13 54.58 1y4s s LEU 460 Cb -0.06 -2.77 0.29 0.00 0.03 0.00 0.00 46.19 43.69 1y4s s LEU 460 CO -0.09 0.11 1.12 -1.54 0.23 0.00 0.00 176.35 176.18 1y4s n SER 461 N 2.90 0.34 -4.44 2.29 3.41 -1.26 -2.48 113.62 114.37 1y4s n SER 461 Ca -0.08 -2.00 -0.35 0.00 -0.26 0.00 0.00 58.87 56.17 1y4s n SER 461 Cb 0.51 -0.10 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 1y4s n SER 461 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1y4s s ASP 462 N -1.72 4.85 0.03 4.04 1.01 -1.26 -4.57 116.67 119.04 1y4s s ASP 462 Ca 0.22 -0.21 0.01 0.00 0.71 0.00 0.00 52.55 53.29 1y4s s ASP 462 Cb 0.26 -1.84 0.10 0.00 1.01 0.00 0.00 42.92 42.46 1y4s s ASP 462 CO -0.11 0.05 0.14 -1.14 0.21 0.00 0.00 175.17 174.31 1y4s n ARG 463 N 4.37 -0.01 0.10 8.23 3.00 -1.26 0.47 116.66 131.56 1y4s n ARG 463 Ca -0.17 0.12 0.02 0.00 -0.00 0.00 0.00 57.85 57.83 1y4s n ARG 463 Cb 0.52 -0.21 -0.01 0.00 0.00 0.00 0.00 32.46 32.75 1y4s n ARG 463 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 1y4s h ILE 464 N 0.00 0.65 -0.91 5.15 2.10 -1.97 -3.40 117.51 119.14 1y4s h ILE 464 Ca 0.07 -2.02 0.17 0.00 1.08 0.00 0.00 64.86 64.15 1y4s h ILE 464 Cb 0.16 2.21 -0.17 0.00 -1.09 0.00 0.00 36.82 37.94 1y4s h ILE 464 CO -0.07 0.37 -0.26 0.47 -1.08 0.00 0.00 178.15 177.58 1y4s n ASP 465 N -3.07 -0.39 -0.14 2.19 8.00 0.18 -1.36 116.55 121.96 1y4s n ASP 465 Ca -0.02 1.57 -0.05 0.00 0.71 0.00 0.00 54.79 57.00 1y4s n ASP 465 Cb 0.75 -0.44 0.04 0.00 -0.02 0.00 0.00 41.12 41.45 1y4s n ASP 465 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1y4s h GLU 466 N 0.00 0.33 0.00 -1.24 4.81 -1.78 -1.76 114.58 114.94 1y4s h GLU 466 Ca 0.41 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 1y4s h GLU 466 Cb 0.63 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1y4s h GLU 466 CO -0.93 0.22 -0.29 2.35 -0.73 0.00 0.00 179.01 179.63 1y4s h TRP 467 N 0.34 0.00 -0.25 0.92 7.01 -1.51 -3.05 115.95 119.42 1y4s h TRP 467 Ca 0.20 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 61.10 1y4s h TRP 467 Cb 0.19 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 1y4s h TRP 467 CO -0.15 0.29 -0.24 1.98 -2.79 0.00 0.00 178.44 177.54 1y4s h MET 468 N 0.00 0.60 -0.02 2.65 4.05 -0.68 -3.17 114.93 118.36 1y4s h MET 468 Ca -0.00 -0.31 0.00 0.00 -0.28 0.00 0.00 59.70 59.10 1y4s h MET 468 Cb 0.54 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 1y4s h MET 468 CO 0.04 0.91 0.00 -1.33 0.23 0.00 0.00 176.91 176.76 1y4s n MET 469 N -4.35 0.26 0.00 0.39 2.81 -0.80 -1.32 117.12 114.10 1y4s n MET 469 Ca -0.04 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.94 1y4s n MET 469 Cb 0.43 -1.01 -0.00 0.00 -0.71 0.00 0.00 33.22 31.93 1y4s n MET 469 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1y4s n ASN 470 N -0.42 1.92 0.00 7.83 3.02 -1.20 -4.35 115.26 122.06 1y4s n ASN 470 Ca 0.00 -1.46 0.00 0.00 -0.03 0.00 0.00 54.58 53.09 1y4s n ASN 470 Cb 0.01 0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 1y4s n ASN 470 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1y4s n TYR 471 N -0.01 0.00 -3.07 3.10 4.02 -0.44 -4.86 117.16 115.90 1y4s n TYR 471 Ca 0.08 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.52 1y4s n TYR 471 Cb 0.42 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.72 1y4s n TYR 471 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1y4s s LEU 472 N -3.37 5.64 -0.41 7.72 0.20 -1.01 -4.87 118.68 122.58 1y4s s LEU 472 Ca 0.00 -2.20 0.05 0.00 0.69 0.00 0.00 54.13 52.67 1y4s s LEU 472 Cb 0.00 -2.33 0.56 0.00 -0.43 0.00 0.00 46.19 43.99 1y4s s LEU 472 CO 0.00 -0.91 1.72 0.35 -0.29 0.00 0.00 176.35 177.22 1y4s n THR 473 N 4.99 2.99 0.00 3.68 -2.24 -1.26 -4.77 114.28 117.67 1y4s n THR 473 Ca 0.18 -2.55 0.00 0.00 -2.27 0.00 0.00 64.05 59.41 1y4s n THR 473 Cb 0.48 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 1y4s n THR 473 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1y4s n GLU 474 N -1.08 0.00 -3.68 -0.78 2.13 -1.26 -4.39 120.64 111.59 1y4s n GLU 474 Ca 0.50 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 58.02 1y4s n GLU 474 Cb 1.24 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.80 1y4s n GLU 474 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1y4s s PHE 475 N -1.74 1.25 -0.65 4.31 5.36 -0.96 -4.92 117.98 120.62 1y4s s PHE 475 Ca 0.00 -1.42 -0.13 0.00 -0.96 0.00 0.00 56.93 54.41 1y4s s PHE 475 Cb 0.00 -1.43 0.02 0.00 -0.34 0.00 0.00 43.02 41.27 1y4s s PHE 475 CO 0.00 -0.84 0.64 -0.25 -1.46 0.00 0.00 175.22 173.30 1y4s n ASP 476 N 4.98 -6.00 0.00 6.13 9.92 -1.26 -3.68 116.55 126.64 1y4s n ASP 476 Ca -0.04 -0.37 0.00 0.00 -0.53 0.00 0.00 54.79 53.85 1y4s n ASP 476 Cb 0.42 -2.85 0.00 0.00 -0.64 0.00 0.00 41.12 38.05 1y4s n ASP 476 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1y4s n GLY 477 N -1.07 1.79 2.99 0.44 0.00 -1.26 -4.95 105.19 103.13 1y4s n GLY 477 Ca -0.14 -0.22 -0.47 0.00 0.00 0.00 0.00 46.02 45.20 1y4s n GLY 477 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y4s n LYS 478 N 0.00 0.00 -1.46 1.61 4.76 -1.24 -4.90 118.16 116.93 1y4s n LYS 478 Ca 0.00 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.13 1y4s n LYS 478 Cb 0.00 -1.34 0.07 0.00 -1.84 0.00 0.00 35.03 31.92 1y4s n LYS 478 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1y4s s PRO 479 N 6.41 2.54 -0.06 1.97 0.04 -1.22 -2.28 135.00 142.40 1y4s s PRO 479 Ca 1.13 0.97 -0.14 0.00 0.04 0.00 0.00 61.00 62.99 1y4s s PRO 479 Cb -1.25 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 31.29 1y4s s PRO 479 CO 0.53 -1.39 0.37 -0.06 0.04 0.00 0.00 177.00 176.49 1y4s s PHE 480 N -3.01 3.63 -0.09 0.56 0.40 -1.26 -2.21 117.98 116.00 1y4s s PHE 480 Ca 0.60 0.86 -0.06 0.00 -0.60 0.00 0.00 56.93 57.73 1y4s s PHE 480 Cb -0.15 -2.31 0.04 0.00 0.51 0.00 0.00 43.02 41.11 1y4s s PHE 480 CO 0.55 0.51 0.22 -1.14 0.70 0.00 0.00 175.22 176.06 1y4s s GLN 481 N -0.53 0.20 1.13 0.44 0.74 -0.82 -4.91 119.66 115.92 1y4s s GLN 481 Ca 0.22 0.41 -0.19 0.00 0.05 0.00 0.00 55.36 55.85 1y4s s GLN 481 Cb -0.15 -0.04 0.29 0.00 1.10 0.00 0.00 33.01 34.21 1y4s s GLN 481 CO 0.10 -0.11 0.84 0.43 -0.55 0.00 0.00 175.29 176.00 1y4s n SER 482 N 3.73 -2.76 0.00 6.67 7.64 -1.26 -2.77 113.62 124.87 1y4s n SER 482 Ca -0.21 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.75 1y4s n SER 482 Cb 0.55 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1y4s n SER 482 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55