#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oo0 h GLY -8 N 0.00 0.95 1.00 0.00 0.00 -2.05 -2.66 103.07 100.31 2oo0 h GLY -8 Ca 0.00 -1.07 -0.00 0.00 0.00 0.00 0.00 47.33 46.26 2oo0 h GLY -8 CO 0.00 0.96 0.35 -2.09 0.00 0.00 0.00 176.54 175.76 2oo0 h GLU -7 N 0.66 0.78 -0.26 4.80 4.81 -2.06 -1.76 114.58 121.54 2oo0 h GLU -7 Ca 0.03 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 2oo0 h GLU -7 Cb 1.08 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2oo0 h GLU -7 CO 0.11 0.56 0.09 -0.91 -0.73 0.00 0.00 179.01 178.12 2oo0 h ASN -6 N 0.78 0.38 0.39 1.04 2.35 -2.00 -1.89 115.58 116.63 2oo0 h ASN -6 Ca 0.21 -0.20 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 2oo0 h ASN -6 Cb -0.02 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 2oo0 h ASN -6 CO -0.04 0.48 -0.17 -0.07 -1.65 0.00 0.00 177.43 175.98 2oo0 h LEU -5 N 0.26 0.00 0.17 1.61 3.38 -1.40 -0.84 115.31 118.50 2oo0 h LEU -5 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2oo0 h LEU -5 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2oo0 h LEU -5 CO -0.00 0.17 -0.08 0.22 0.09 0.00 0.00 178.44 178.83 2oo0 h TYR -4 N 0.00 -0.22 -0.70 1.13 3.20 -1.01 -1.95 116.97 117.41 2oo0 h TYR -4 Ca -0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2oo0 h TYR -4 Cb 0.41 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 2oo0 h TYR -4 CO 0.00 0.15 0.46 0.74 -1.64 0.00 0.00 178.16 177.86 2oo0 h PHE -3 N -0.63 0.86 -0.69 -3.82 0.04 -1.09 -2.36 116.94 109.25 2oo0 h PHE -3 Ca -0.02 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.79 2oo0 h PHE -3 Cb 0.46 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 38.29 2oo0 h PHE -3 CO 0.04 0.52 0.44 0.37 -0.60 0.00 0.00 178.31 179.09 2oo0 h GLN -2 N 0.91 0.85 -0.46 1.51 5.75 -1.21 -0.21 115.11 122.25 2oo0 h GLN -2 Ca 0.27 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.78 2oo0 h GLN -2 Cb -0.05 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 28.25 2oo0 h GLN -2 CO -0.08 0.56 0.15 0.77 -2.65 0.00 0.00 178.83 177.59 2oo0 h SER -1 N 0.88 0.15 -0.06 -0.69 0.02 -1.00 0.21 113.55 113.06 2oo0 h SER -1 Ca 0.27 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 61.17 2oo0 h SER -1 Cb -0.03 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2oo0 h SER -1 CO -0.09 0.12 -0.28 -0.07 -1.14 0.00 0.00 176.83 175.36 2oo0 h LEU 0 N 0.32 0.52 -0.86 5.07 3.38 -0.99 -1.93 115.31 120.81 2oo0 h LEU 0 Ca 0.22 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2oo0 h LEU 0 Cb 0.22 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2oo0 h LEU 0 CO -0.23 0.78 -0.57 0.24 0.09 0.00 0.00 178.44 178.76 2oo0 h MET 1 N 0.44 0.01 -0.60 1.13 2.86 -0.55 -1.24 114.93 116.98 2oo0 h MET 1 Ca 0.06 -0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.61 2oo0 h MET 1 Cb 0.72 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 2oo0 h MET 1 CO 0.06 0.57 0.03 -0.91 1.06 0.00 0.00 176.91 177.72 2oo0 h ASN 2 N 0.00 1.01 -0.42 1.22 2.35 -0.23 -0.43 115.58 119.08 2oo0 h ASN 2 Ca -0.01 -0.29 -0.04 0.00 -0.55 0.00 0.00 56.30 55.42 2oo0 h ASN 2 Cb 1.00 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 2oo0 h ASN 2 CO 0.07 1.05 0.12 0.78 -1.65 0.00 0.00 177.43 177.80 2oo0 h ASN 3 N 0.93 0.62 -0.39 5.81 -0.26 -1.16 -1.61 115.58 119.52 2oo0 h ASN 3 Ca 0.17 -0.22 0.04 0.00 -0.56 0.00 0.00 56.30 55.74 2oo0 h ASN 3 Cb 0.51 -0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.57 2oo0 h ASN 3 CO 0.02 0.68 0.14 0.15 -1.06 0.00 0.00 177.43 177.37 2oo0 h PHE 4 N 0.54 0.26 -1.00 1.19 3.57 -1.14 -2.42 116.94 117.94 2oo0 h PHE 4 Ca 0.13 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.69 2oo0 h PHE 4 Cb 0.29 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.91 2oo0 h PHE 4 CO 0.01 0.11 0.66 0.78 -2.23 0.00 0.00 178.31 177.64 2oo0 h GLY 5 N 0.31 1.46 -4.35 2.40 0.00 -0.95 -3.47 103.07 98.46 2oo0 h GLY 5 Ca 0.18 -0.50 -0.40 0.00 0.00 0.00 0.00 47.33 46.61 2oo0 h GLY 5 CO -0.17 0.44 -0.57 -2.01 0.00 0.00 0.00 176.54 174.22 2oo0 n ASN 6 N -4.44 -5.65 -0.48 0.19 5.15 -0.62 -1.33 115.26 108.09 2oo0 n ASN 6 Ca 0.13 -0.23 -0.06 0.00 -0.60 0.00 0.00 54.58 53.82 2oo0 n ASN 6 Cb 0.09 -4.61 -0.03 0.00 -0.53 0.00 0.00 39.78 34.70 2oo0 n ASN 6 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2oo0 n GLU 7 N -3.77 -1.62 -0.11 1.20 -0.58 -1.26 -4.80 120.64 109.70 2oo0 n GLU 7 Ca -0.12 0.68 -0.15 0.00 -0.42 0.00 0.00 57.16 57.15 2oo0 n GLU 7 Cb 0.62 -5.00 -0.10 0.00 -0.57 0.00 0.00 31.44 26.38 2oo0 n GLU 7 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2oo0 n GLU 8 N -0.45 0.56 -4.12 3.49 1.02 -0.44 -5.03 120.64 115.67 2oo0 n GLU 8 Ca -0.06 0.13 -0.09 0.00 -0.02 0.00 0.00 57.16 57.11 2oo0 n GLU 8 Cb 0.50 -1.44 -0.10 0.00 -0.02 0.00 0.00 31.44 30.38 2oo0 n GLU 8 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2oo0 s PHE 9 N -2.44 0.70 -0.28 -0.32 -0.71 -0.97 -5.08 117.98 108.88 2oo0 s PHE 9 Ca -0.30 -0.94 -0.13 0.00 -1.04 0.00 0.00 56.93 54.53 2oo0 s PHE 9 Cb 0.08 -0.45 -0.04 0.00 -1.21 0.00 0.00 43.02 41.40 2oo0 s PHE 9 CO 0.51 -0.24 0.26 0.34 -1.34 0.00 0.00 175.22 174.75 2oo0 s ASP 10 N -2.85 6.11 -0.28 1.98 -1.08 -1.26 -4.44 116.67 114.86 2oo0 s ASP 10 Ca 0.08 0.06 -0.02 0.00 -0.52 0.00 0.00 52.55 52.14 2oo0 s ASP 10 Cb 0.05 -2.16 0.04 0.00 -1.46 0.00 0.00 42.92 39.39 2oo0 s ASP 10 CO -0.06 -0.12 -0.02 0.00 0.52 0.00 0.00 175.17 175.48 2oo0 s HIS 12 N 1.29 3.36 0.11 0.00 2.46 0.62 -4.53 115.29 118.60 2oo0 s HIS 12 Ca -0.03 0.36 -0.31 0.00 0.47 0.00 0.00 55.06 55.55 2oo0 s HIS 12 Cb -0.18 -2.31 -0.09 0.00 -0.13 0.00 0.00 32.58 29.87 2oo0 s HIS 12 CO -0.02 0.10 1.57 0.12 -2.47 0.00 0.00 174.74 174.04 2oo0 s PHE 13 N 0.94 2.82 -0.28 3.88 5.36 -1.26 -1.64 117.98 127.80 2oo0 s PHE 13 Ca 0.11 0.56 -0.19 0.00 -0.96 0.00 0.00 56.93 56.45 2oo0 s PHE 13 Cb -0.13 -3.90 -0.02 0.00 -0.34 0.00 0.00 43.02 38.63 2oo0 s PHE 13 CO 0.04 -3.41 0.56 -0.51 -1.46 0.00 0.00 175.22 170.44 2oo0 s LEU 14 N 1.79 4.12 0.74 6.12 1.43 0.29 -4.87 118.68 128.30 2oo0 s LEU 14 Ca 0.70 0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 54.13 2oo0 s LEU 14 Cb -0.41 -2.72 0.04 0.00 0.03 0.00 0.00 46.19 43.14 2oo0 s LEU 14 CO 0.31 -0.38 1.11 -1.81 0.23 0.00 0.00 176.35 175.81 2oo0 s ASP 15 N 1.59 4.58 0.06 2.29 1.01 -1.26 -3.87 116.67 121.07 2oo0 s ASP 15 Ca 0.23 1.93 -0.37 0.00 0.71 0.00 0.00 52.55 55.05 2oo0 s ASP 15 Cb -0.15 -2.54 -0.17 0.00 1.01 0.00 0.00 42.92 41.07 2oo0 s ASP 15 CO 0.10 -1.99 1.36 -0.62 0.21 0.00 0.00 175.17 174.24 2oo0 n GLU 16 N -3.16 1.15 -0.08 8.23 1.02 -1.26 -1.93 120.64 124.60 2oo0 n GLU 16 Ca 0.10 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.65 2oo0 n GLU 16 Cb 0.52 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.88 2oo0 n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oo0 n GLY 17 N 2.62 1.81 3.72 0.62 0.00 -1.26 -5.02 105.19 107.67 2oo0 n GLY 17 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2oo0 n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oo0 s PHE 18 N -2.73 3.29 0.42 1.61 0.40 -0.81 -5.09 117.98 115.07 2oo0 s PHE 18 Ca 0.00 0.24 0.07 0.00 -0.60 0.00 0.00 56.93 56.64 2oo0 s PHE 18 Cb 0.00 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 2oo0 s PHE 18 CO 0.00 0.45 0.21 0.95 0.70 0.00 0.00 175.22 177.53 2oo0 s THR 19 N -0.58 2.27 0.42 0.64 -4.23 -1.26 -4.62 115.64 108.28 2oo0 s THR 19 Ca 0.11 -1.65 0.13 0.00 -1.18 0.00 0.00 61.69 59.10 2oo0 s THR 19 Cb -0.12 -2.93 0.34 0.00 1.34 0.00 0.00 72.50 71.13 2oo0 s THR 19 CO 0.02 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 176.04 2oo0 h ALA 20 N 1.34 2.01 -0.78 3.99 0.00 -1.99 -1.92 119.26 121.91 2oo0 h ALA 20 Ca -0.42 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 2oo0 h ALA 20 Cb 1.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2oo0 h ALA 20 CO 0.68 -0.18 0.31 0.87 0.00 0.00 0.00 179.25 180.93 2oo0 h LYS 21 N 0.47 1.16 -0.68 0.00 1.57 -1.98 -2.29 116.57 114.82 2oo0 h LYS 21 Ca 0.33 -0.21 -0.07 0.00 -1.87 0.00 0.00 60.65 58.83 2oo0 h LYS 21 Cb 0.66 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 2oo0 h LYS 21 CO -0.11 0.95 0.16 -0.44 -0.57 0.00 0.00 179.45 179.44 2oo0 h ASP 22 N 1.13 1.04 -0.73 0.86 3.45 -1.75 -2.08 116.42 118.33 2oo0 h ASP 22 Ca 0.26 -0.24 -0.05 0.00 0.43 0.00 0.00 57.03 57.43 2oo0 h ASP 22 Cb 0.22 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.68 2oo0 h ASP 22 CO -0.02 1.01 0.25 0.40 -1.57 0.00 0.00 179.24 179.30 2oo0 h ILE 23 N 1.02 1.26 0.00 0.35 1.08 -1.28 -0.28 117.51 119.66 2oo0 h ILE 23 Ca 0.21 -0.87 0.01 0.00 -0.39 0.00 0.00 64.86 63.82 2oo0 h ILE 23 Cb 0.38 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 2oo0 h ILE 23 CO 0.00 0.35 -0.05 0.25 -0.69 0.00 0.00 178.15 178.01 2oo0 h LEU 24 N 1.09 -0.13 -0.70 1.44 6.46 -1.21 -0.77 115.31 121.49 2oo0 h LEU 24 Ca 0.24 0.02 0.06 0.00 -0.12 0.00 0.00 57.88 58.08 2oo0 h LEU 24 Cb 0.28 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 40.21 2oo0 h LEU 24 CO -0.01 -0.07 0.40 0.44 -0.62 0.00 0.00 178.44 178.58 2oo0 h ASP 25 N -0.08 0.61 -0.47 1.25 3.32 -1.05 -2.26 116.42 117.75 2oo0 h ASP 25 Ca 0.02 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2oo0 h ASP 25 Cb 0.11 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2oo0 h ASP 25 CO -0.05 0.40 0.27 1.56 -1.72 0.00 0.00 179.24 179.70 2oo0 h GLN 26 N 0.75 0.64 -0.76 3.56 4.20 -0.77 0.54 115.11 123.27 2oo0 h GLN 26 Ca 0.31 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 2oo0 h GLN 26 Cb 0.16 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 2oo0 h GLN 26 CO -0.17 0.48 0.38 0.87 -0.67 0.00 0.00 178.83 179.73 2oo0 h LYS 27 N 0.62 1.06 -0.28 1.46 1.57 -0.93 -0.92 116.57 119.15 2oo0 h LYS 27 Ca 0.17 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2oo0 h LYS 27 Cb 0.02 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 2oo0 h LYS 27 CO -0.03 0.80 -0.03 0.82 -0.57 0.00 0.00 179.45 180.45 2oo0 h ILE 28 N 1.06 1.27 -0.93 1.86 2.04 -1.08 -3.15 117.51 118.58 2oo0 h ILE 28 Ca 0.26 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 2oo0 h ILE 28 Cb 0.07 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2oo0 h ILE 28 CO -0.04 0.32 0.57 0.78 0.00 0.00 0.00 178.15 179.78 2oo0 h ASN 29 N 0.28 1.11 -0.23 1.72 2.35 -0.58 -2.48 115.58 117.74 2oo0 h ASN 29 Ca 0.08 -0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.83 2oo0 h ASN 29 Cb 0.48 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2oo0 h ASN 29 CO 0.02 0.84 0.20 -0.33 -1.65 0.00 0.00 177.43 176.52 2oo0 h GLU 30 N 1.27 0.00 -0.34 0.81 5.08 -1.14 -2.22 114.58 118.05 2oo0 h GLU 30 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2oo0 h GLU 30 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2oo0 h GLU 30 CO -0.06 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.28 2oo0 n VAL 31 N -4.09 1.53 -0.35 3.13 0.24 -0.96 -4.74 118.33 113.09 2oo0 n VAL 31 Ca 0.03 -1.34 0.03 0.00 -2.04 0.00 0.00 64.34 61.02 2oo0 n VAL 31 Cb 0.34 0.20 0.20 0.00 -1.47 0.00 0.00 33.84 33.11 2oo0 n VAL 31 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2oo0 h SER 32 N 2.08 0.99 -0.93 -1.34 4.64 -1.13 -1.13 113.55 116.74 2oo0 h SER 32 Ca 0.00 0.01 -0.51 0.00 -0.47 0.00 0.00 61.79 60.82 2oo0 h SER 32 Cb 1.04 -0.20 -0.29 0.00 -0.31 0.00 0.00 62.40 62.64 2oo0 h SER 32 CO 0.10 0.63 0.60 -1.54 -0.87 0.00 0.00 176.83 175.74 2oo0 n SER 33 N -4.50 4.17 -4.29 4.97 3.41 -1.26 -4.95 113.62 111.17 2oo0 n SER 33 Ca 0.15 -3.66 -0.16 0.00 -0.26 0.00 0.00 58.87 54.95 2oo0 n SER 33 Cb 0.20 -0.83 -0.10 0.00 -0.26 0.00 0.00 64.21 63.22 2oo0 n SER 33 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2oo0 s SER 34 N -1.52 1.82 0.00 4.04 0.15 -0.43 -5.04 113.70 112.72 2oo0 s SER 34 Ca 0.57 -1.11 0.23 0.00 0.70 0.00 0.00 55.95 56.34 2oo0 s SER 34 Cb 0.48 -0.00 0.47 0.00 -1.71 0.00 0.00 66.02 65.25 2oo0 s SER 34 CO 0.08 -0.42 1.42 0.47 1.20 0.00 0.00 173.24 176.00 2oo0 n ASP 35 N -0.31 3.38 -4.13 5.45 8.00 -1.26 -4.75 116.55 122.93 2oo0 n ASP 35 Ca -0.08 -1.98 -0.42 0.00 0.71 0.00 0.00 54.79 53.02 2oo0 n ASP 35 Cb 0.62 -0.26 -0.00 0.00 -0.02 0.00 0.00 41.12 41.46 2oo0 n ASP 35 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2oo0 n ASP 36 N 1.43 4.37 -2.46 -2.24 8.00 -1.26 -4.71 116.55 119.68 2oo0 n ASP 36 Ca 0.20 -2.88 -0.22 0.00 0.71 0.00 0.00 54.79 52.60 2oo0 n ASP 36 Cb 0.59 -1.70 0.01 0.00 -0.02 0.00 0.00 41.12 40.00 2oo0 n ASP 36 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2oo0 n LYS 37 N 7.17 2.93 -1.96 -1.24 5.02 -1.26 -4.92 118.16 123.89 2oo0 n LYS 37 Ca 0.51 -4.15 -0.38 0.00 -2.02 0.00 0.00 58.31 52.26 2oo0 n LYS 37 Cb 0.42 -2.03 0.02 0.00 -0.02 0.00 0.00 35.03 33.43 2oo0 n LYS 37 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oo0 s ASP 38 N -3.49 5.66 0.54 4.39 1.01 -1.26 -4.53 116.67 118.99 2oo0 s ASP 38 Ca 0.43 2.60 -0.21 0.00 0.71 0.00 0.00 52.55 56.09 2oo0 s ASP 38 Cb 0.41 -2.62 -0.06 0.00 1.01 0.00 0.00 42.92 41.65 2oo0 s ASP 38 CO -0.10 -1.29 1.09 0.00 0.21 0.00 0.00 175.17 175.08 2oo0 n ALA 39 N -0.75 0.60 -3.08 5.23 0.00 -1.26 -4.87 120.51 116.38 2oo0 n ALA 39 Ca 0.09 0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.51 2oo0 n ALA 39 Cb 0.46 -2.18 -0.06 0.00 0.00 0.00 0.00 19.45 17.68 2oo0 n ALA 39 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2oo0 s PHE 40 N -1.39 -0.23 0.05 0.00 -0.71 -0.78 -3.95 117.98 110.97 2oo0 s PHE 40 Ca 0.71 0.07 0.01 0.00 -1.04 0.00 0.00 56.93 56.69 2oo0 s PHE 40 Cb -0.45 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.55 2oo0 s PHE 40 CO 0.50 -0.63 0.11 0.71 -1.34 0.00 0.00 175.22 174.58 2oo0 s TYR 41 N -3.06 3.29 -0.20 3.49 2.02 -0.15 -0.81 117.35 121.93 2oo0 s TYR 41 Ca -0.02 0.15 -0.04 0.00 -0.37 0.00 0.00 57.07 56.79 2oo0 s TYR 41 Cb 0.00 -1.68 -0.02 0.00 -0.40 0.00 0.00 41.96 39.87 2oo0 s TYR 41 CO -0.07 0.55 -0.03 0.08 -1.57 0.00 0.00 175.55 174.51 2oo0 s VAL 42 N -1.37 3.65 -0.23 0.71 1.01 -0.64 -1.09 120.40 122.44 2oo0 s VAL 42 Ca 0.29 -0.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.82 2oo0 s VAL 42 Cb -0.12 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.62 2oo0 s VAL 42 CO 0.21 0.43 -0.05 0.00 0.00 0.00 0.00 175.10 175.70 2oo0 s ALA 43 N 1.12 2.78 -0.58 5.51 0.00 -0.31 -1.61 121.76 128.67 2oo0 s ALA 43 Ca 0.02 -1.26 -0.22 0.00 0.00 0.00 0.00 51.96 50.50 2oo0 s ALA 43 Cb -0.15 -1.70 0.06 0.00 0.00 0.00 0.00 23.12 21.33 2oo0 s ALA 43 CO 0.00 -0.55 0.83 0.34 0.00 0.00 0.00 175.76 176.39 2oo0 s ASP 44 N 1.44 6.24 0.51 0.00 -1.08 -0.08 -1.18 116.67 122.52 2oo0 s ASP 44 Ca 0.04 -0.83 0.28 0.00 -0.52 0.00 0.00 52.55 51.53 2oo0 s ASP 44 Cb -0.15 -2.37 1.37 0.00 -1.46 0.00 0.00 42.92 40.31 2oo0 s ASP 44 CO -0.04 -1.19 2.02 -0.07 0.52 0.00 0.00 175.17 176.42 2oo0 h LEU 45 N 10.62 0.00 -1.44 -1.34 3.38 -1.39 -1.81 115.31 123.33 2oo0 h LEU 45 Ca -0.28 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 2oo0 h LEU 45 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2oo0 h LEU 45 CO 1.08 0.13 -0.11 1.23 0.09 0.00 0.00 178.44 180.86 2oo0 h GLY 46 N 1.23 0.24 1.27 0.83 0.00 -1.91 -2.45 103.07 102.29 2oo0 h GLY 46 Ca -0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.09 2oo0 h GLY 46 CO 0.02 0.14 -0.09 -1.80 0.00 0.00 0.00 176.54 174.80 2oo0 h ASP 47 N 0.22 0.86 -0.59 0.19 3.58 -1.69 -1.73 116.42 117.26 2oo0 h ASP 47 Ca 0.05 -0.26 -0.04 0.00 0.42 0.00 0.00 57.03 57.19 2oo0 h ASP 47 Cb 0.34 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 2oo0 h ASP 47 CO 0.02 0.97 0.20 0.40 -2.88 0.00 0.00 179.24 177.95 2oo0 h ILE 48 N 0.78 1.24 -0.72 2.25 2.04 -1.43 -1.35 117.51 120.32 2oo0 h ILE 48 Ca 0.13 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 2oo0 h ILE 48 Cb 0.60 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2oo0 h ILE 48 CO 0.04 0.30 0.39 -0.07 0.00 0.00 0.00 178.15 178.81 2oo0 h LEU 49 N 0.83 0.91 -0.85 1.44 -0.00 -1.36 -1.51 115.31 114.76 2oo0 h LEU 49 Ca 0.19 -0.10 0.01 0.00 -0.00 0.00 0.00 57.88 57.98 2oo0 h LEU 49 Cb 0.26 -0.23 -0.04 0.00 -0.00 0.00 0.00 40.66 40.65 2oo0 h LEU 49 CO -0.01 0.75 0.56 0.11 -0.00 0.00 0.00 178.44 179.85 2oo0 h LYS 50 N 1.00 1.10 -0.95 1.13 1.57 -1.05 -1.82 116.57 117.55 2oo0 h LYS 50 Ca 0.25 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2oo0 h LYS 50 Cb 0.05 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.07 2oo0 h LYS 50 CO -0.04 0.73 0.60 0.87 -0.57 0.00 0.00 179.45 181.04 2oo0 h LYS 51 N 1.13 1.27 -0.06 3.15 1.79 -0.70 -1.50 116.57 121.65 2oo0 h LYS 51 Ca 0.32 -0.09 -0.00 0.00 -2.18 0.00 0.00 60.65 58.69 2oo0 h LYS 51 Cb -0.10 -0.28 -0.00 0.00 -1.58 0.00 0.00 32.23 30.27 2oo0 h LYS 51 CO -0.08 0.86 0.03 1.25 -1.08 0.00 0.00 179.45 180.43 2oo0 h HIS 52 N 1.30 0.10 -0.43 -1.35 2.76 -0.75 -0.00 115.15 116.78 2oo0 h HIS 52 Ca 0.35 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.59 2oo0 h HIS 52 Cb -0.11 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 28.75 2oo0 h HIS 52 CO 0.00 0.22 -0.01 -0.07 -1.30 0.00 0.00 177.93 176.77 2oo0 h LEU 53 N -0.05 -0.20 -1.14 0.26 3.38 -1.20 -0.37 115.31 115.99 2oo0 h LEU 53 Ca 0.02 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2oo0 h LEU 53 Cb 0.16 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2oo0 h LEU 53 CO -0.00 -0.06 0.32 -0.09 0.09 0.00 0.00 178.44 178.70 2oo0 h ARG 54 N 0.10 0.92 -0.06 1.13 2.43 -1.16 -2.12 114.38 115.63 2oo0 h ARG 54 Ca 0.21 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2oo0 h ARG 54 Cb 0.31 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2oo0 h ARG 54 CO -0.36 0.71 0.00 2.35 -1.51 0.00 0.00 179.97 181.16 2oo0 h TRP 55 N 0.92 0.11 -1.00 2.20 2.91 -0.04 -1.25 115.95 119.81 2oo0 h TRP 55 Ca 0.23 -0.02 0.15 0.00 1.13 0.00 0.00 58.89 60.38 2oo0 h TRP 55 Cb 0.08 -0.03 -0.10 0.00 -0.51 0.00 0.00 29.16 28.61 2oo0 h TRP 55 CO 0.01 0.36 0.62 -0.07 -1.03 0.00 0.00 178.44 178.33 2oo0 h LEU 56 N -0.17 0.86 -0.07 0.65 3.38 -0.79 0.35 115.31 119.53 2oo0 h LEU 56 Ca 0.02 0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 2oo0 h LEU 56 Cb 0.31 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.98 2oo0 h LEU 56 CO 0.00 0.39 -0.49 0.11 0.09 0.00 0.00 178.44 178.55 2oo0 h LYS 57 N 0.89 0.45 0.03 1.13 1.57 -1.30 -3.16 116.57 116.18 2oo0 h LYS 57 Ca 0.54 -0.39 -0.22 0.00 -1.87 0.00 0.00 60.65 58.70 2oo0 h LYS 57 Cb 0.68 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 2oo0 h LYS 57 CO -0.32 1.04 -0.98 0.00 -0.57 0.00 0.00 179.45 178.61 2oo0 h ALA 58 N 0.42 0.37 -2.15 3.86 0.00 -0.86 -3.37 119.26 117.53 2oo0 h ALA 58 Ca -0.04 -0.76 -0.56 0.00 0.00 0.00 0.00 54.91 53.55 2oo0 h ALA 58 Cb 1.15 -0.04 -0.41 0.00 0.00 0.00 0.00 17.79 18.49 2oo0 h ALA 58 CO 0.10 0.91 -0.84 1.28 0.00 0.00 0.00 179.25 180.70 2oo0 n LEU 59 N -3.65 2.76 0.32 0.00 4.77 0.08 -4.88 117.00 116.41 2oo0 n LEU 59 Ca -0.05 -5.32 0.20 0.00 -0.03 0.00 0.00 56.01 50.81 2oo0 n LEU 59 Cb 0.87 -0.08 1.06 0.00 -2.33 0.00 0.00 43.42 42.94 2oo0 n LEU 59 CO 0.50 2.24 1.13 1.55 -1.33 0.00 0.00 177.39 181.48 2oo0 h PRO 60 N 3.39 0.00 -0.03 3.23 0.13 -1.73 -1.40 132.00 135.59 2oo0 h PRO 60 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2oo0 h PRO 60 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2oo0 h PRO 60 CO 0.69 0.01 0.00 0.54 -0.23 0.00 0.00 178.00 179.01 2oo0 n ARG 61 N -3.23 1.88 -4.05 0.86 1.74 -1.26 -4.89 116.66 107.71 2oo0 n ARG 61 Ca -0.02 -1.28 -0.33 0.00 -0.77 0.00 0.00 57.85 55.44 2oo0 n ARG 61 Cb 0.12 -1.47 -0.15 0.00 -1.02 0.00 0.00 32.46 29.94 2oo0 n ARG 61 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2oo0 s VAL 62 N -1.99 2.42 -0.18 1.55 1.01 -0.53 -4.16 120.40 118.52 2oo0 s VAL 62 Ca 0.35 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.05 2oo0 s VAL 62 Cb 0.21 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 2oo0 s VAL 62 CO 0.32 0.36 0.92 -0.89 0.00 0.00 0.00 175.10 175.82 2oo0 s THR 63 N 1.29 4.80 -0.01 3.92 2.01 -0.43 -4.87 115.64 122.36 2oo0 s THR 63 Ca 0.02 1.81 -0.30 0.00 0.31 0.00 0.00 61.69 63.53 2oo0 s THR 63 Cb -0.15 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 2oo0 s THR 63 CO -0.09 -0.05 1.02 -2.16 -0.69 0.00 0.00 174.62 172.66 2oo0 s PRO 64 N 2.51 4.52 -0.37 4.92 0.04 -1.26 -1.60 135.00 143.76 2oo0 s PRO 64 Ca 0.41 1.48 -0.04 0.00 0.04 0.00 0.00 61.00 62.89 2oo0 s PRO 64 Cb -0.16 -3.46 0.07 0.00 0.04 0.00 0.00 34.50 31.00 2oo0 s PRO 64 CO 0.11 -0.13 0.14 -0.06 0.04 0.00 0.00 177.00 177.10 2oo0 s PHE 65 N 1.18 3.39 0.18 0.56 0.40 0.23 -1.14 117.98 122.79 2oo0 s PHE 65 Ca 0.53 -1.94 -0.32 0.00 -0.60 0.00 0.00 56.93 54.60 2oo0 s PHE 65 Cb -0.22 -2.69 -0.11 0.00 0.51 0.00 0.00 43.02 40.51 2oo0 s PHE 65 CO 0.27 -0.86 1.65 -0.47 0.70 0.00 0.00 175.22 176.51 2oo0 s TYR 66 N 1.27 2.94 -0.86 0.36 5.04 -0.30 -3.52 117.35 122.28 2oo0 s TYR 66 Ca 0.02 0.46 -0.25 0.00 -2.44 0.00 0.00 57.07 54.86 2oo0 s TYR 66 Cb -0.21 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.06 2oo0 s TYR 66 CO -0.01 -3.89 1.65 0.00 -1.34 0.00 0.00 175.55 171.96 2oo0 s ALA 67 N 1.26 2.29 0.30 3.97 0.00 -0.43 -0.35 121.76 128.80 2oo0 s ALA 67 Ca 0.73 -1.57 0.06 0.00 0.00 0.00 0.00 51.96 51.18 2oo0 s ALA 67 Cb -0.46 -4.45 0.79 0.00 0.00 0.00 0.00 23.12 18.99 2oo0 s ALA 67 CO 0.32 -3.99 1.72 0.28 0.00 0.00 0.00 175.76 174.09 2oo0 h VAL 68 N 6.82 0.54 -0.55 0.00 2.07 -1.74 -1.75 116.25 121.64 2oo0 h VAL 68 Ca -0.00 -0.18 0.16 0.00 0.82 0.00 0.00 66.70 67.50 2oo0 h VAL 68 Cb 1.04 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2oo0 h VAL 68 CO 1.30 0.10 0.43 0.07 0.02 0.00 0.00 177.57 179.48 2oo0 h LYS 69 N 0.53 0.00 -0.78 1.57 2.10 -1.89 -2.00 116.57 116.09 2oo0 h LYS 69 Ca 0.59 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 59.20 2oo0 h LYS 69 Cb 1.09 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.39 2oo0 h LYS 69 CO -0.48 0.00 0.34 0.00 -2.00 0.00 0.00 179.45 177.31 2oo0 s ASN 71 N -6.37 -1.13 -0.11 0.00 3.84 -0.79 -1.60 114.94 108.79 2oo0 s ASN 71 Ca -0.12 0.26 0.08 0.00 0.21 0.00 0.00 52.86 53.29 2oo0 s ASN 71 Cb 0.16 1.77 0.41 0.00 -0.55 0.00 0.00 41.25 43.04 2oo0 s ASN 71 CO 0.83 -0.21 1.16 -0.90 -2.79 0.00 0.00 177.10 175.19 2oo0 n ASP 72 N 5.34 3.25 -4.71 -4.21 5.75 -0.96 -4.81 116.55 116.20 2oo0 n ASP 72 Ca 0.04 -2.41 -0.43 0.00 -0.01 0.00 0.00 54.79 51.97 2oo0 n ASP 72 Cb 0.55 -0.55 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 2oo0 n ASP 72 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2oo0 n SER 73 N 0.36 3.51 -0.28 -1.12 7.64 -1.26 -4.89 113.62 117.58 2oo0 n SER 73 Ca 0.14 1.11 -0.05 0.00 1.01 0.00 0.00 58.87 61.08 2oo0 n SER 73 Cb 0.68 -1.52 0.06 0.00 -1.01 0.00 0.00 64.21 62.43 2oo0 n SER 73 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2oo0 h LYS 74 N 5.44 1.03 -0.96 1.43 3.64 -2.00 -2.34 116.57 122.82 2oo0 h LYS 74 Ca -0.45 -0.09 0.13 0.00 -1.27 0.00 0.00 60.65 58.97 2oo0 h LYS 74 Cb 1.23 -0.22 -0.08 0.00 -0.41 0.00 0.00 32.23 32.76 2oo0 h LYS 74 CO 0.85 0.73 0.61 0.00 -2.27 0.00 0.00 179.45 179.37 2oo0 h ALA 75 N 1.24 1.65 0.01 5.00 0.00 -1.98 0.16 119.26 125.34 2oo0 h ALA 75 Ca 0.27 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2oo0 h ALA 75 Cb -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2oo0 h ALA 75 CO -0.05 0.09 -0.00 0.82 0.00 0.00 0.00 179.25 180.11 2oo0 h ILE 76 N 0.86 1.28 -0.69 0.00 1.08 -1.80 -1.30 117.51 116.95 2oo0 h ILE 76 Ca 0.48 -0.86 -0.02 0.00 -0.39 0.00 0.00 64.86 64.07 2oo0 h ILE 76 Cb 0.60 1.86 -0.03 0.00 -3.07 0.00 0.00 36.82 36.18 2oo0 h ILE 76 CO -0.25 0.22 0.34 0.58 -0.69 0.00 0.00 178.15 178.36 2oo0 h VAL 77 N -0.38 1.23 -0.49 1.67 2.07 -1.14 -1.31 116.25 117.90 2oo0 h VAL 77 Ca -0.00 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 2oo0 h VAL 77 Cb 0.37 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2oo0 h VAL 77 CO 0.00 0.26 0.22 0.50 0.02 0.00 0.00 177.57 178.57 2oo0 h LYS 78 N 0.95 0.72 -0.10 1.57 3.64 -0.68 0.20 116.57 122.87 2oo0 h LYS 78 Ca 0.24 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.53 2oo0 h LYS 78 Cb 0.10 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2oo0 h LYS 78 CO -0.03 0.62 -0.08 1.15 -2.27 0.00 0.00 179.45 178.84 2oo0 h THR 79 N 0.65 0.77 -0.10 1.00 2.02 -1.05 -1.58 112.91 114.63 2oo0 h THR 79 Ca 0.17 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 2oo0 h THR 79 Cb 0.15 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 2oo0 h THR 79 CO -0.02 0.00 -0.44 -0.07 0.37 0.00 0.00 175.52 175.37 2oo0 h LEU 80 N -0.09 0.23 -0.44 2.58 3.38 -1.04 -1.64 115.31 118.29 2oo0 h LEU 80 Ca 0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2oo0 h LEU 80 Cb 0.18 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2oo0 h LEU 80 CO -0.15 0.64 0.22 0.00 0.09 0.00 0.00 178.44 179.23 2oo0 h ALA 81 N 1.37 0.57 -0.52 1.53 0.00 -0.36 -1.42 119.26 120.43 2oo0 h ALA 81 Ca 0.01 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2oo0 h ALA 81 Cb 0.85 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2oo0 h ALA 81 CO 0.07 0.13 0.02 0.00 0.00 0.00 0.00 179.25 179.46 2oo0 h ALA 82 N 1.06 1.04 0.00 0.00 0.00 -1.10 -2.57 119.26 117.69 2oo0 h ALA 82 Ca 0.15 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2oo0 h ALA 82 Cb 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2oo0 h ALA 82 CO -0.02 0.60 -0.21 1.15 0.00 0.00 0.00 179.25 180.77 2oo0 h THR 83 N 0.82 1.04 0.00 0.00 2.02 -1.06 -3.26 112.91 112.47 2oo0 h THR 83 Ca 0.16 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.60 2oo0 h THR 83 Cb 0.46 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2oo0 h THR 83 CO 0.02 0.20 0.00 0.61 0.37 0.00 0.00 175.52 176.72 2oo0 n GLY 84 N -0.84 1.12 3.75 2.16 0.00 -0.58 -4.59 105.19 106.21 2oo0 n GLY 84 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 2oo0 n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2oo0 s THR 85 N -2.00 3.03 0.57 2.61 -4.23 -0.92 -5.03 115.64 109.66 2oo0 s THR 85 Ca 0.00 0.35 -0.09 0.00 -1.18 0.00 0.00 61.69 60.77 2oo0 s THR 85 Cb 0.00 -2.75 0.13 0.00 1.34 0.00 0.00 72.50 71.22 2oo0 s THR 85 CO 0.00 -0.42 0.77 0.61 -0.54 0.00 0.00 174.62 175.04 2oo0 n GLY 86 N -0.80 -1.27 2.84 3.99 0.00 -0.29 -4.76 105.19 104.89 2oo0 n GLY 86 Ca 0.10 -1.71 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 2oo0 n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oo0 s PHE 87 N -2.66 -0.07 -0.37 1.61 0.08 0.84 -1.15 117.98 116.28 2oo0 s PHE 87 Ca 0.44 0.32 -0.20 0.00 0.12 0.00 0.00 56.93 57.61 2oo0 s PHE 87 Cb -0.01 -0.19 0.00 0.00 -0.57 0.00 0.00 43.02 42.26 2oo0 s PHE 87 CO 0.31 -0.14 0.60 0.34 -0.10 0.00 0.00 175.22 176.22 2oo0 s ASP 88 N 1.25 6.37 -0.10 1.36 2.15 0.52 -0.92 116.67 127.31 2oo0 s ASP 88 Ca -0.08 0.01 -0.02 0.00 0.43 0.00 0.00 52.55 52.90 2oo0 s ASP 88 Cb -0.12 -2.31 -0.03 0.00 -0.30 0.00 0.00 42.92 40.16 2oo0 s ASP 88 CO -0.04 -0.59 -0.03 0.00 -0.17 0.00 0.00 175.17 174.34 2oo0 n ALA 90 N 2.55 3.51 -3.82 0.00 0.00 -1.26 -2.51 120.51 118.97 2oo0 n ALA 90 Ca -0.18 -0.52 -0.06 0.00 0.00 0.00 0.00 53.44 52.69 2oo0 n ALA 90 Cb 0.53 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 2oo0 n ALA 90 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2oo0 s SER 91 N -3.98 -0.20 0.21 0.00 1.04 -1.26 -4.73 113.70 104.77 2oo0 s SER 91 Ca -0.01 -0.58 -0.11 0.00 0.48 0.00 0.00 55.95 55.73 2oo0 s SER 91 Cb 0.15 0.64 0.28 0.00 0.10 0.00 0.00 66.02 67.19 2oo0 s SER 91 CO 0.88 -1.20 1.69 0.50 0.98 0.00 0.00 173.24 176.08 2oo0 h LYS 92 N 2.00 0.19 -0.31 4.02 3.64 -1.96 -1.68 116.57 122.47 2oo0 h LYS 92 Ca -0.22 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.09 2oo0 h LYS 92 Cb 1.24 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 2oo0 h LYS 92 CO 0.26 0.12 -0.05 1.79 -2.27 0.00 0.00 179.45 179.30 2oo0 h THR 93 N 0.19 1.20 -0.32 1.00 1.35 -1.98 0.11 112.91 114.47 2oo0 h THR 93 Ca 0.31 -0.85 -0.14 0.00 -0.55 0.00 0.00 66.41 65.18 2oo0 h THR 93 Cb 0.48 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.92 2oo0 h THR 93 CO -0.44 0.29 -0.35 -0.33 -0.25 0.00 0.00 175.52 174.43 2oo0 h GLU 94 N 0.47 0.79 -0.45 4.72 5.08 -1.90 -0.69 114.58 122.60 2oo0 h GLU 94 Ca 0.10 -0.43 0.04 0.00 -1.00 0.00 0.00 59.36 58.06 2oo0 h GLU 94 Cb 0.38 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 2oo0 h GLU 94 CO 0.02 1.06 0.22 0.82 -1.00 0.00 0.00 179.01 180.13 2oo0 h ILE 95 N 0.56 0.96 -0.53 3.13 2.04 -0.83 -1.65 117.51 121.19 2oo0 h ILE 95 Ca 0.05 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 2oo0 h ILE 95 Cb 0.94 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 2oo0 h ILE 95 CO 0.09 0.08 0.33 1.56 0.00 0.00 0.00 178.15 180.20 2oo0 h GLN 96 N 0.44 0.71 -0.11 2.37 4.20 -0.62 0.46 115.11 122.56 2oo0 h GLN 96 Ca 0.20 -0.06 0.03 0.00 0.06 0.00 0.00 58.65 58.88 2oo0 h GLN 96 Cb 0.11 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2oo0 h GLN 96 CO -0.14 0.50 -0.09 1.25 -0.67 0.00 0.00 178.83 179.68 2oo0 h LEU 97 N 0.71 -0.29 -0.42 1.46 5.85 -0.91 -0.69 115.31 121.02 2oo0 h LEU 97 Ca 0.19 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.93 2oo0 h LEU 97 Cb -0.03 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2oo0 h LEU 97 CO -0.04 -0.13 0.11 0.58 -0.34 0.00 0.00 178.44 178.63 2oo0 h VAL 98 N -0.11 1.23 0.00 1.05 2.07 -1.02 -2.85 116.25 116.62 2oo0 h VAL 98 Ca 0.08 -0.78 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 2oo0 h VAL 98 Cb 0.22 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2oo0 h VAL 98 CO -0.18 0.27 -0.33 1.56 0.02 0.00 0.00 177.57 178.91 2oo0 h GLN 99 N 0.54 0.00 0.00 1.57 4.20 -0.76 -2.45 115.11 118.21 2oo0 h GLN 99 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2oo0 h GLN 99 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2oo0 h GLN 99 CO -0.00 0.33 0.00 0.66 -0.67 0.00 0.00 178.83 179.15 2oo0 h SER 100 N 0.00 0.00 -0.52 1.46 4.64 -0.89 -2.31 113.55 115.94 2oo0 h SER 100 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oo0 h SER 100 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2oo0 h SER 100 CO 0.04 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 2oo0 n LEU 101 N -2.68 3.29 0.00 5.97 4.77 -0.93 -4.93 117.00 122.48 2oo0 n LEU 101 Ca 0.01 -1.55 0.00 0.00 -0.03 0.00 0.00 56.01 54.44 2oo0 n LEU 101 Cb 0.26 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2oo0 n LEU 101 CO 0.23 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 2oo0 n GLY 102 N 1.48 0.71 3.70 -0.72 0.00 -0.87 -5.01 105.19 104.49 2oo0 n GLY 102 Ca 0.20 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2oo0 n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oo0 s VAL 103 N -2.00 4.50 0.65 1.61 1.01 -1.18 -5.02 120.40 119.98 2oo0 s VAL 103 Ca 0.00 1.80 -0.15 0.00 0.00 0.00 0.00 61.98 63.62 2oo0 s VAL 103 Cb 0.00 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 2oo0 s VAL 103 CO 0.00 0.05 1.12 -2.16 0.00 0.00 0.00 175.10 174.12 2oo0 s PRO 104 N 1.71 2.78 0.56 2.72 0.04 -1.26 -4.50 135.00 137.05 2oo0 s PRO 104 Ca 0.53 1.46 0.27 0.00 0.04 0.00 0.00 61.00 63.31 2oo0 s PRO 104 Cb -0.23 -1.94 1.66 0.00 0.04 0.00 0.00 34.50 34.03 2oo0 s PRO 104 CO 0.23 -1.28 2.20 -1.35 0.04 0.00 0.00 177.00 176.84 2oo0 h PRO 105 N 0.12 0.00 0.00 0.56 0.11 -1.90 -1.48 132.00 129.41 2oo0 h PRO 105 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2oo0 h PRO 105 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2oo0 h PRO 105 CO 0.54 0.03 0.00 -0.85 -0.21 0.00 0.00 178.00 177.51 2oo0 n GLU 106 N -3.88 0.09 -0.83 1.05 0.00 -1.26 -2.35 120.64 113.46 2oo0 n GLU 106 Ca -0.03 0.12 0.07 0.00 0.00 0.00 0.00 57.16 57.33 2oo0 n GLU 106 Cb 0.12 -1.50 0.39 0.00 0.00 0.00 0.00 31.44 30.45 2oo0 n GLU 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2oo0 n ARG 107 N -1.44 4.60 -4.93 3.44 1.74 -0.56 -4.91 116.66 114.60 2oo0 n ARG 107 Ca 0.07 -3.11 -0.28 0.00 -0.77 0.00 0.00 57.85 53.75 2oo0 n ARG 107 Cb 0.22 -2.19 -0.17 0.00 -1.02 0.00 0.00 32.46 29.31 2oo0 n ARG 107 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2oo0 s ILE 108 N -2.70 1.62 -0.12 0.55 1.01 -0.99 -0.11 121.20 120.45 2oo0 s ILE 108 Ca 0.53 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 60.41 2oo0 s ILE 108 Cb 0.40 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.45 2oo0 s ILE 108 CO 0.16 0.46 -0.15 -0.51 0.00 0.00 0.00 174.94 174.90 2oo0 s ILE 109 N 0.37 2.90 -1.12 2.92 2.07 -0.09 -4.60 121.20 123.64 2oo0 s ILE 109 Ca -0.14 -0.72 -0.15 0.00 -1.41 0.00 0.00 60.65 58.23 2oo0 s ILE 109 Cb -0.16 -2.20 0.15 0.00 0.13 0.00 0.00 42.46 40.39 2oo0 s ILE 109 CO 0.06 0.53 1.35 -0.47 -1.91 0.00 0.00 174.94 174.49 2oo0 s TYR 110 N 0.33 3.36 -0.54 3.50 6.14 -0.57 -0.74 117.35 128.83 2oo0 s TYR 110 Ca -0.12 -1.88 -0.02 0.00 0.64 0.00 0.00 57.07 55.69 2oo0 s TYR 110 Cb -0.16 -4.32 0.32 0.00 0.42 0.00 0.00 41.96 38.22 2oo0 s TYR 110 CO 0.06 -1.44 2.10 0.00 0.64 0.00 0.00 175.55 176.91 2oo0 n ALA 111 N 6.02 5.93 -3.08 3.97 0.00 -1.04 -1.94 120.51 130.37 2oo0 n ALA 111 Ca 0.33 -2.84 -0.38 0.00 0.00 0.00 0.00 53.44 50.55 2oo0 n ALA 111 Cb 0.45 -1.69 -0.12 0.00 0.00 0.00 0.00 19.45 18.09 2oo0 n ALA 111 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2oo0 s ASN 112 N -0.82 5.35 0.17 0.00 3.84 -1.26 -4.89 114.94 117.33 2oo0 s ASN 112 Ca 0.51 -0.86 0.21 0.00 0.21 0.00 0.00 52.86 52.93 2oo0 s ASN 112 Cb 0.39 -1.92 0.86 0.00 -0.55 0.00 0.00 41.25 40.04 2oo0 s ASN 112 CO -0.07 -0.27 1.64 -2.65 -2.79 0.00 0.00 177.10 172.96 2oo0 n PRO 113 N 4.89 0.13 -3.49 0.43 -0.02 -1.26 -4.36 135.00 131.32 2oo0 n PRO 113 Ca -0.13 0.35 -0.28 0.00 -2.02 0.00 0.00 63.50 61.42 2oo0 n PRO 113 Cb 0.47 -1.74 -0.11 0.00 -0.02 0.00 0.00 33.50 32.10 2oo0 n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oo0 s LYS 115 N 0.12 3.35 0.21 0.00 1.02 -1.26 -5.06 119.74 118.13 2oo0 s LYS 115 Ca 0.28 -0.27 -0.32 0.00 0.02 0.00 0.00 55.97 55.68 2oo0 s LYS 115 Cb -0.05 -3.04 -0.12 0.00 -0.52 0.00 0.00 37.83 34.10 2oo0 s LYS 115 CO -0.14 0.67 1.72 0.94 -0.92 0.00 0.00 175.35 177.62 2oo0 n GLN 116 N 2.30 2.79 -0.30 1.68 7.27 -1.26 -4.82 117.38 125.04 2oo0 n GLN 116 Ca -0.19 1.01 0.12 0.00 0.07 0.00 0.00 57.00 58.01 2oo0 n GLN 116 Cb 0.54 -2.85 0.29 0.00 2.41 0.00 0.00 30.24 30.63 2oo0 n GLN 116 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2oo0 h VAL 117 N 3.78 0.48 -0.21 1.69 2.07 -1.97 0.33 116.25 122.42 2oo0 h VAL 117 Ca -0.43 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 2oo0 h VAL 117 Cb 1.20 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2oo0 h VAL 117 CO 0.95 0.07 -0.02 0.77 0.02 0.00 0.00 177.57 179.37 2oo0 h SER 118 N 0.39 0.29 0.60 0.57 4.64 -1.99 -0.18 113.55 117.87 2oo0 h SER 118 Ca 0.54 -0.04 -0.20 0.00 -0.47 0.00 0.00 61.79 61.63 2oo0 h SER 118 Cb 1.02 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2oo0 h SER 118 CO -0.52 0.36 -0.88 1.56 -0.87 0.00 0.00 176.83 176.48 2oo0 h GLN 119 N 0.31 0.18 -0.34 4.77 4.20 -1.34 -1.54 115.11 121.35 2oo0 h GLN 119 Ca 0.07 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.58 2oo0 h GLN 119 Cb 0.24 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 2oo0 h GLN 119 CO 0.01 0.95 0.22 0.82 -0.67 0.00 0.00 178.83 180.15 2oo0 h ILE 120 N 0.10 1.07 -0.75 2.54 2.04 -0.49 -2.09 117.51 119.94 2oo0 h ILE 120 Ca -0.04 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.67 2oo0 h ILE 120 Cb 1.51 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 2oo0 h ILE 120 CO 0.13 0.08 0.49 0.11 0.00 0.00 0.00 178.15 178.97 2oo0 h LYS 121 N 0.45 0.98 -0.40 2.37 1.57 -0.97 -1.19 116.57 119.37 2oo0 h LYS 121 Ca 0.13 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 2oo0 h LYS 121 Cb -0.04 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 32.00 2oo0 h LYS 121 CO -0.04 0.65 0.07 -0.92 -0.57 0.00 0.00 179.45 178.64 2oo0 h TYR 122 N 1.01 0.11 -0.39 -1.35 3.20 -1.11 0.73 116.97 119.18 2oo0 h TYR 122 Ca 0.28 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.21 2oo0 h TYR 122 Cb -0.11 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 2oo0 h TYR 122 CO -0.02 0.00 0.17 0.00 -1.64 0.00 0.00 178.16 176.67 2oo0 h ALA 123 N 1.31 0.47 -0.36 1.82 0.00 -0.92 -1.43 119.26 120.15 2oo0 h ALA 123 Ca 0.19 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2oo0 h ALA 123 Cb 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2oo0 h ALA 123 CO -0.26 -0.20 0.21 0.00 0.00 0.00 0.00 179.25 179.00 2oo0 h ALA 124 N 1.22 0.45 0.00 0.00 0.00 -0.71 -0.34 119.26 119.89 2oo0 h ALA 124 Ca 0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2oo0 h ALA 124 Cb 0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2oo0 h ALA 124 CO -0.13 -0.04 -0.07 -0.91 0.00 0.00 0.00 179.25 178.10 2oo0 h ASN 125 N 0.46 0.00 -0.33 0.00 -0.26 -0.64 -2.81 115.58 112.00 2oo0 h ASN 125 Ca 0.13 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2oo0 h ASN 125 Cb 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 2oo0 h ASN 125 CO -0.02 0.07 0.00 0.59 -1.06 0.00 0.00 177.43 177.00 2oo0 n ASN 126 N -3.54 3.60 -0.01 5.81 3.02 -0.56 -4.98 115.26 118.60 2oo0 n ASN 126 Ca -0.02 -2.56 -0.00 0.00 -0.03 0.00 0.00 54.58 51.97 2oo0 n ASN 126 Cb 0.19 -0.42 -0.00 0.00 -0.61 0.00 0.00 39.78 38.93 2oo0 n ASN 126 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oo0 n GLY 127 N 0.06 0.48 3.56 7.41 0.00 -0.72 -4.89 105.19 111.09 2oo0 n GLY 127 Ca 0.18 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2oo0 n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oo0 s VAL 128 N -1.98 4.15 -0.11 1.61 1.01 -0.22 -4.77 120.40 120.10 2oo0 s VAL 128 Ca 0.00 0.68 0.07 0.00 0.00 0.00 0.00 61.98 62.73 2oo0 s VAL 128 Cb 0.00 -4.66 -0.24 0.00 0.00 0.00 0.00 36.38 31.48 2oo0 s VAL 128 CO 0.00 -1.26 0.41 0.00 0.00 0.00 0.00 175.10 174.25 2oo0 n GLN 129 N 8.09 0.68 -3.27 2.72 1.13 -1.26 -4.22 117.38 121.25 2oo0 n GLN 129 Ca 0.06 0.23 -0.39 0.00 -1.94 0.00 0.00 57.00 54.96 2oo0 n GLN 129 Cb 0.48 -1.70 -0.07 0.00 0.11 0.00 0.00 30.24 29.06 2oo0 n GLN 129 CO 0.00 0.00 0.00 1.41 -1.44 0.00 0.00 177.06 177.03 2oo0 s MET 130 N -2.56 4.15 0.06 -1.09 1.75 -1.26 -0.72 119.30 119.62 2oo0 s MET 130 Ca -0.13 0.35 0.01 0.00 -1.25 0.00 0.00 55.69 54.67 2oo0 s MET 130 Cb 0.07 -3.58 -0.03 0.00 2.84 0.00 0.00 34.83 34.13 2oo0 s MET 130 CO 0.79 -0.19 -0.06 -1.64 -0.65 0.00 0.00 175.02 173.27 2oo0 s MET 131 N 1.77 0.59 0.49 4.11 -1.94 -1.04 -1.51 119.30 121.76 2oo0 s MET 131 Ca 0.22 -0.96 -0.01 0.00 -1.71 0.00 0.00 55.69 53.23 2oo0 s MET 131 Cb -0.15 -0.12 0.00 0.00 2.01 0.00 0.00 34.83 36.57 2oo0 s MET 131 CO 0.09 -0.01 0.72 0.95 -0.01 0.00 0.00 175.02 176.77 2oo0 s THR 132 N -2.41 3.83 0.17 2.05 -4.23 -0.82 -0.93 115.64 113.31 2oo0 s THR 132 Ca -0.02 -0.41 -0.23 0.00 -1.18 0.00 0.00 61.69 59.85 2oo0 s THR 132 Cb -0.03 -3.44 0.06 0.00 1.34 0.00 0.00 72.50 70.43 2oo0 s THR 132 CO -0.03 -0.34 0.66 0.72 -0.54 0.00 0.00 174.62 175.10 2oo0 s PHE 133 N -2.66 -0.43 0.00 3.99 -0.71 -0.66 -4.39 117.98 113.12 2oo0 s PHE 133 Ca 0.50 0.17 0.01 0.00 -1.04 0.00 0.00 56.93 56.57 2oo0 s PHE 133 Cb -0.10 0.59 0.02 0.00 -1.21 0.00 0.00 43.02 42.33 2oo0 s PHE 133 CO 0.39 -0.91 0.75 -0.40 -1.34 0.00 0.00 175.22 173.71 2oo0 n ASP 134 N -0.39 -0.03 -3.73 1.98 5.75 -1.26 -0.69 116.55 118.18 2oo0 n ASP 134 Ca -0.13 -1.48 -0.12 0.00 -0.01 0.00 0.00 54.79 53.05 2oo0 n ASP 134 Cb 0.63 -0.06 -0.07 0.00 -1.03 0.00 0.00 41.12 40.59 2oo0 n ASP 134 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2oo0 s SER 135 N -0.54 -0.17 0.20 -1.12 1.04 -1.26 -4.46 113.70 107.39 2oo0 s SER 135 Ca 0.02 -0.13 -0.06 0.00 0.48 0.00 0.00 55.95 56.26 2oo0 s SER 135 Cb 0.02 0.37 0.14 0.00 0.10 0.00 0.00 66.02 66.66 2oo0 s SER 135 CO -0.01 -0.62 1.64 -0.08 0.98 0.00 0.00 173.24 175.15 2oo0 h GLU 136 N 3.20 0.90 -0.88 4.02 4.81 -1.97 -2.73 114.58 121.92 2oo0 h GLU 136 Ca -0.31 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 58.57 2oo0 h GLU 136 Cb 1.20 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.48 2oo0 h GLU 136 CO 0.45 0.97 0.49 0.28 -0.73 0.00 0.00 179.01 180.47 2oo0 h VAL 137 N 0.80 1.25 -0.99 0.32 2.07 -2.00 -2.08 116.25 115.63 2oo0 h VAL 137 Ca 0.12 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 67.07 2oo0 h VAL 137 Cb 0.66 0.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 2oo0 h VAL 137 CO 0.05 0.28 0.65 -0.08 0.02 0.00 0.00 177.57 178.49 2oo0 h GLU 138 N 1.23 1.20 -0.73 1.57 4.57 -1.84 -0.87 114.58 119.70 2oo0 h GLU 138 Ca 0.31 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.41 2oo0 h GLU 138 Cb 0.02 -0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 28.30 2oo0 h GLU 138 CO -0.05 0.79 0.43 -0.07 -1.18 0.00 0.00 179.01 178.93 2oo0 h LEU 139 N 1.23 0.88 -0.59 1.64 3.38 -1.20 -0.23 115.31 120.42 2oo0 h LEU 139 Ca 0.40 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 2oo0 h LEU 139 Cb 0.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2oo0 h LEU 139 CO -0.14 0.69 0.30 0.24 0.09 0.00 0.00 178.44 179.63 2oo0 h MET 140 N 0.99 0.83 -0.43 1.13 2.86 -0.63 0.28 114.93 119.96 2oo0 h MET 140 Ca 0.26 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2oo0 h MET 140 Cb -0.02 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 2oo0 h MET 140 CO -0.05 0.65 0.26 0.87 1.06 0.00 0.00 176.91 179.70 2oo0 h LYS 141 N 0.79 0.58 -0.60 1.72 1.57 -0.89 -2.84 116.57 116.90 2oo0 h LYS 141 Ca 0.20 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.85 2oo0 h LYS 141 Cb 0.08 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2oo0 h LYS 141 CO -0.03 0.43 0.05 0.28 -0.57 0.00 0.00 179.45 179.61 2oo0 h VAL 142 N 0.57 1.26 -0.49 0.50 2.07 -0.80 -0.15 116.25 119.20 2oo0 h VAL 142 Ca 0.15 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.66 2oo0 h VAL 142 Cb -0.00 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2oo0 h VAL 142 CO -0.03 0.39 0.33 0.00 0.02 0.00 0.00 177.57 178.28 2oo0 h ALA 143 N 1.11 1.81 0.14 1.67 0.00 -0.79 0.63 119.26 123.83 2oo0 h ALA 143 Ca 0.18 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.78 2oo0 h ALA 143 Cb 0.47 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2oo0 h ALA 143 CO 0.02 0.13 -1.44 -0.09 0.00 0.00 0.00 179.25 177.86 2oo0 h ARG 144 N 0.52 0.30 0.00 0.00 2.43 -1.25 -3.39 114.38 112.99 2oo0 h ARG 144 Ca 0.20 -0.52 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2oo0 h ARG 144 Cb 0.16 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2oo0 h ARG 144 CO -0.05 1.25 -1.62 0.00 -1.51 0.00 0.00 179.97 178.03 2oo0 n ALA 145 N -2.90 2.75 -2.86 2.80 0.00 -0.10 -4.75 120.51 115.45 2oo0 n ALA 145 Ca -0.23 -0.39 -0.12 0.00 0.00 0.00 0.00 53.44 52.70 2oo0 n ALA 145 Cb 0.95 -0.55 0.05 0.00 0.00 0.00 0.00 19.45 19.90 2oo0 n ALA 145 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2oo0 n HIS 146 N -1.98 -2.06 0.32 0.00 -0.00 0.17 -4.41 115.22 107.26 2oo0 n HIS 146 Ca -0.02 -2.58 0.20 0.00 0.46 0.00 0.00 57.72 55.79 2oo0 n HIS 146 Cb 0.40 1.05 1.06 0.00 -0.12 0.00 0.00 29.99 32.37 2oo0 n HIS 146 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2oo0 h PRO 147 N 3.11 0.00 -0.66 1.57 0.13 -1.63 -1.78 132.00 132.73 2oo0 h PRO 147 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2oo0 h PRO 147 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2oo0 h PRO 147 CO 0.25 0.01 0.00 1.63 -0.23 0.00 0.00 178.00 179.66 2oo0 n LYS 148 N -3.18 2.69 -1.30 0.86 5.02 -1.26 -4.74 118.16 116.25 2oo0 n LYS 148 Ca -0.02 -2.59 -0.34 0.00 -2.02 0.00 0.00 58.31 53.34 2oo0 n LYS 148 Cb 0.13 -1.56 0.11 0.00 -0.02 0.00 0.00 35.03 33.70 2oo0 n LYS 148 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oo0 s ALA 149 N -1.10 2.00 -0.40 7.82 0.00 -0.67 -4.96 121.76 124.45 2oo0 s ALA 149 Ca 0.47 0.91 -0.11 0.00 0.00 0.00 0.00 51.96 53.23 2oo0 s ALA 149 Cb 0.25 -3.50 0.05 0.00 0.00 0.00 0.00 23.12 19.92 2oo0 s ALA 149 CO 0.33 -2.07 0.24 0.15 0.00 0.00 0.00 175.76 174.41 2oo0 s LYS 150 N -3.96 2.75 0.11 0.00 -0.14 0.10 -4.11 119.74 114.49 2oo0 s LYS 150 Ca 0.75 -1.25 -0.11 0.00 -1.36 0.00 0.00 55.97 54.00 2oo0 s LYS 150 Cb -0.30 -3.78 -0.06 0.00 -1.68 0.00 0.00 37.83 32.00 2oo0 s LYS 150 CO 0.47 -0.83 0.45 -0.51 -0.76 0.00 0.00 175.35 174.18 2oo0 s LEU 151 N 1.51 4.33 -0.17 3.17 1.43 0.15 -2.51 118.68 126.59 2oo0 s LEU 151 Ca 0.02 0.87 0.01 0.00 -1.03 0.00 0.00 54.13 54.00 2oo0 s LEU 151 Cb -0.21 -3.12 0.02 0.00 0.03 0.00 0.00 46.19 42.91 2oo0 s LEU 151 CO 0.05 0.13 -0.17 -0.69 0.23 0.00 0.00 176.35 175.90 2oo0 s VAL 152 N -1.46 1.88 -0.26 -1.59 1.01 -0.11 -0.32 120.40 119.56 2oo0 s VAL 152 Ca 0.36 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 61.23 2oo0 s VAL 152 Cb -0.14 -1.74 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 2oo0 s VAL 152 CO 0.19 0.47 0.81 -0.22 0.00 0.00 0.00 175.10 176.35 2oo0 s LEU 153 N 1.35 4.08 -0.12 3.92 0.20 -0.40 -1.66 118.68 126.04 2oo0 s LEU 153 Ca 0.04 0.93 -0.21 0.00 0.69 0.00 0.00 54.13 55.59 2oo0 s LEU 153 Cb -0.13 -3.15 -0.03 0.00 -0.43 0.00 0.00 46.19 42.44 2oo0 s LEU 153 CO -0.12 -0.53 0.60 -0.60 -0.29 0.00 0.00 176.35 175.41 2oo0 s ARG 154 N 2.86 4.33 0.20 1.98 3.52 0.14 -1.20 118.95 130.77 2oo0 s ARG 154 Ca 0.34 0.65 0.07 0.00 -0.13 0.00 0.00 55.73 56.66 2oo0 s ARG 154 Cb -0.15 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 2oo0 s ARG 154 CO 0.09 0.00 0.05 0.96 -0.81 0.00 0.00 175.30 175.59 2oo0 s ILE 155 N 1.08 3.90 0.50 4.11 -4.36 -0.15 -0.79 121.20 125.48 2oo0 s ILE 155 Ca 0.31 -1.44 -0.23 0.00 -0.26 0.00 0.00 60.65 59.03 2oo0 s ILE 155 Cb -0.16 -3.00 -0.06 0.00 1.25 0.00 0.00 42.46 40.48 2oo0 s ILE 155 CO 0.13 -0.18 1.30 0.00 0.24 0.00 0.00 174.94 176.43 2oo0 s ALA 156 N -1.88 2.94 0.31 2.27 0.00 0.30 -4.51 121.76 121.20 2oo0 s ALA 156 Ca 0.29 1.22 0.05 0.00 0.00 0.00 0.00 51.96 53.52 2oo0 s ALA 156 Cb -0.09 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 2oo0 s ALA 156 CO 0.20 -1.09 0.00 0.95 0.00 0.00 0.00 175.76 175.82 2oo0 s THR 157 N -1.36 1.47 -0.92 0.00 -4.23 -1.26 -4.95 115.64 104.39 2oo0 s THR 157 Ca 0.67 -2.05 -0.18 0.00 -1.18 0.00 0.00 61.69 58.95 2oo0 s THR 157 Cb -0.37 -2.66 0.14 0.00 1.34 0.00 0.00 72.50 70.95 2oo0 s THR 157 CO 0.45 -0.14 1.09 -0.62 -0.54 0.00 0.00 174.62 174.86 2oo0 s ASP 158 N -3.49 6.65 -0.21 3.99 2.15 -1.26 -4.84 116.67 119.66 2oo0 s ASP 158 Ca 0.33 -2.13 0.15 0.00 0.43 0.00 0.00 52.55 51.33 2oo0 s ASP 158 Cb 0.07 -2.38 0.80 0.00 -0.30 0.00 0.00 42.92 41.11 2oo0 s ASP 158 CO 0.14 -1.00 1.72 -0.90 -0.17 0.00 0.00 175.17 174.96 2oo0 n ASP 159 N 6.22 5.52 0.10 -0.34 5.68 -1.26 -4.65 116.55 127.83 2oo0 n ASP 159 Ca 0.23 -2.82 0.18 0.00 -0.50 0.00 0.00 54.79 51.88 2oo0 n ASP 159 Cb 0.49 -0.67 0.74 0.00 -1.14 0.00 0.00 41.12 40.55 2oo0 n ASP 159 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2oo0 h SER 160 N 4.01 0.00 -0.21 -1.12 4.64 -1.88 0.10 113.55 119.09 2oo0 h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oo0 h SER 160 Cb 1.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 2oo0 h SER 160 CO 0.44 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.69 2oo0 n LYS 161 N -4.07 1.87 -2.66 4.77 5.02 -1.26 -4.98 118.16 116.85 2oo0 n LYS 161 Ca 0.06 -1.80 -0.34 0.00 -2.02 0.00 0.00 58.31 54.21 2oo0 n LYS 161 Cb 0.48 -1.34 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 2oo0 n LYS 161 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oo0 s ALA 162 N -1.21 2.97 0.14 7.82 0.00 0.02 -4.16 121.76 127.33 2oo0 s ALA 162 Ca 0.25 0.53 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 2oo0 s ALA 162 Cb 0.15 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 2oo0 s ALA 162 CO 0.21 -0.11 1.75 0.28 0.00 0.00 0.00 175.76 177.89 2oo0 h VAL 163 N 1.80 1.13 -3.80 0.00 2.07 -1.10 -3.39 116.25 112.96 2oo0 h VAL 163 Ca -0.49 -0.32 -0.68 0.00 0.82 0.00 0.00 66.70 66.03 2oo0 h VAL 163 Cb 1.20 0.71 -0.35 0.00 -1.52 0.00 0.00 31.29 31.34 2oo0 h VAL 163 CO 0.60 0.13 -0.74 0.00 0.02 0.00 0.00 177.57 177.59 2oo0 s ARG 165 N 1.18 4.59 -0.00 0.00 0.52 -1.26 -2.11 118.95 121.88 2oo0 s ARG 165 Ca -0.06 1.28 0.00 0.00 -0.52 0.00 0.00 55.73 56.44 2oo0 s ARG 165 Cb -0.20 -3.39 -0.01 0.00 0.52 0.00 0.00 34.95 31.88 2oo0 s ARG 165 CO -0.03 0.19 0.01 1.28 0.02 0.00 0.00 175.30 176.78 2oo0 n LEU 166 N 3.01 0.00 0.26 2.53 4.77 -1.26 -4.78 117.00 121.52 2oo0 n LEU 166 Ca 0.01 -0.05 0.15 0.00 -0.03 0.00 0.00 56.01 56.09 2oo0 n LEU 166 Cb 0.50 0.00 0.63 0.00 -2.33 0.00 0.00 43.42 42.22 2oo0 n LEU 166 CO 0.50 0.00 0.93 0.28 -1.33 0.00 0.00 177.39 177.77 2oo0 h SER 167 N 0.00 0.00 -0.14 -1.43 0.02 -1.90 -0.64 113.55 109.46 2oo0 h SER 167 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2oo0 h SER 167 Cb 0.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2oo0 h SER 167 CO 0.00 0.08 0.06 1.62 -1.14 0.00 0.00 176.83 177.45 2oo0 h VAL 168 N 0.00 1.09 0.02 2.27 3.04 -1.96 -3.30 116.25 117.41 2oo0 h VAL 168 Ca -0.00 -0.29 -0.38 0.00 -1.01 0.00 0.00 66.70 65.02 2oo0 h VAL 168 Cb 0.56 0.88 -0.06 0.00 -2.01 0.00 0.00 31.29 30.67 2oo0 h VAL 168 CO 0.01 0.10 -2.36 1.17 -1.01 0.00 0.00 177.57 175.49 2oo0 n LYS 169 N -4.44 0.67 -4.11 4.17 4.81 -0.58 -5.02 118.16 113.66 2oo0 n LYS 169 Ca -0.00 0.15 -0.13 0.00 -0.87 0.00 0.00 58.31 57.47 2oo0 n LYS 169 Cb 0.13 -1.56 -0.11 0.00 0.02 0.00 0.00 35.03 33.51 2oo0 n LYS 169 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2oo0 s PHE 170 N -2.53 0.81 0.00 5.64 0.08 -0.35 -5.09 117.98 116.54 2oo0 s PHE 170 Ca -0.29 -0.64 0.00 0.00 0.12 0.00 0.00 56.93 56.12 2oo0 s PHE 170 Cb 0.08 -0.47 0.00 0.00 -0.57 0.00 0.00 43.02 42.06 2oo0 s PHE 170 CO 0.67 -0.09 0.00 0.41 -0.10 0.00 0.00 175.22 176.11 2oo0 n GLY 171 N 0.89 1.71 3.76 4.36 0.00 -1.26 -4.13 105.19 110.51 2oo0 n GLY 171 Ca -0.19 -0.99 -0.40 0.00 0.00 0.00 0.00 46.02 44.44 2oo0 n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oo0 s ALA 172 N 0.00 3.35 0.91 4.61 0.00 0.03 -3.77 121.76 126.89 2oo0 s ALA 172 Ca 0.00 0.90 -0.11 0.00 0.00 0.00 0.00 51.96 52.75 2oo0 s ALA 172 Cb 0.00 -3.33 0.14 0.00 0.00 0.00 0.00 23.12 19.93 2oo0 s ALA 172 CO 0.00 -0.22 1.11 0.95 0.00 0.00 0.00 175.76 177.60 2oo0 s THR 173 N -1.24 2.46 0.38 0.00 -4.23 -1.26 -0.54 115.64 111.21 2oo0 s THR 173 Ca 0.47 0.15 0.05 0.00 -1.18 0.00 0.00 61.69 61.18 2oo0 s THR 173 Cb -0.31 -2.36 0.26 0.00 1.34 0.00 0.00 72.50 71.43 2oo0 s THR 173 CO 0.40 -0.20 2.03 -0.07 -0.54 0.00 0.00 174.62 176.25 2oo0 h LEU 174 N -1.74 0.60 -0.31 4.79 3.38 -1.96 0.93 115.31 121.00 2oo0 h LEU 174 Ca -0.47 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 2oo0 h LEU 174 Cb 1.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2oo0 h LEU 174 CO 0.47 0.44 0.07 -0.09 0.09 0.00 0.00 178.44 179.41 2oo0 h ARG 175 N 0.71 0.50 -0.48 1.13 2.43 -2.01 -2.46 114.38 114.20 2oo0 h ARG 175 Ca 0.19 -0.13 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 2oo0 h ARG 175 Cb -0.08 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 2oo0 h ARG 175 CO -0.04 0.58 -0.02 1.15 -1.51 0.00 0.00 179.97 180.13 2oo0 h THR 176 N 0.34 1.25 -0.61 0.20 2.02 -1.82 -3.05 112.91 111.23 2oo0 h THR 176 Ca 0.10 -1.05 0.07 0.00 0.77 0.00 0.00 66.41 66.29 2oo0 h THR 176 Cb 0.31 0.90 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 2oo0 h THR 176 CO 0.00 0.37 0.30 0.28 0.37 0.00 0.00 175.52 176.85 2oo0 h SER 177 N 0.76 0.42 -0.42 4.18 0.02 -0.51 -0.08 113.55 117.92 2oo0 h SER 177 Ca 0.14 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 2oo0 h SER 177 Cb 0.49 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.96 2oo0 h SER 177 CO 0.02 0.27 0.18 -0.09 -1.14 0.00 0.00 176.83 176.07 2oo0 h ARG 178 N 0.56 0.36 -0.62 3.45 1.12 -1.34 -0.52 114.38 117.39 2oo0 h ARG 178 Ca 0.28 -0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 59.04 2oo0 h ARG 178 Cb 0.23 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 30.09 2oo0 h ARG 178 CO -0.21 0.24 0.02 -0.07 -3.11 0.00 0.00 179.97 176.83 2oo0 h LEU 179 N 0.37 1.05 -0.89 3.80 3.38 -1.39 -2.34 115.31 119.30 2oo0 h LEU 179 Ca 0.19 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2oo0 h LEU 179 Cb 0.13 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 2oo0 h LEU 179 CO -0.16 1.09 0.50 -0.07 0.09 0.00 0.00 178.44 179.89 2oo0 h LEU 180 N 0.99 1.09 -0.27 1.67 3.38 -0.55 0.20 115.31 121.81 2oo0 h LEU 180 Ca 0.18 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2oo0 h LEU 180 Cb 0.54 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2oo0 h LEU 180 CO 0.03 0.87 0.13 -0.07 0.09 0.00 0.00 178.44 179.49 2oo0 h LEU 181 N 1.23 0.36 -0.45 1.67 3.38 -0.87 0.13 115.31 120.75 2oo0 h LEU 181 Ca 0.31 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2oo0 h LEU 181 Cb 0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2oo0 h LEU 181 CO -0.05 0.38 0.13 -0.33 0.09 0.00 0.00 178.44 178.65 2oo0 h GLU 182 N 0.31 0.71 -0.57 1.13 5.08 -1.10 -1.91 114.58 118.23 2oo0 h GLU 182 Ca 0.09 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2oo0 h GLU 182 Cb 0.11 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2oo0 h GLU 182 CO -0.01 0.70 0.36 -0.09 -1.00 0.00 0.00 179.01 178.97 2oo0 h ARG 183 N 0.60 0.76 -0.78 2.33 9.65 -0.45 -1.84 114.38 124.64 2oo0 h ARG 183 Ca 0.14 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.99 2oo0 h ARG 183 Cb 0.30 -0.17 -0.04 0.00 -1.39 0.00 0.00 29.97 28.66 2oo0 h ARG 183 CO -0.00 0.52 0.50 0.00 2.80 0.00 0.00 179.97 183.79 2oo0 h ALA 184 N 1.19 1.02 -0.40 2.80 0.00 -0.64 -2.07 119.26 121.16 2oo0 h ALA 184 Ca 0.21 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2oo0 h ALA 184 Cb -0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2oo0 h ALA 184 CO -0.04 0.34 0.23 -0.22 0.00 0.00 0.00 179.25 179.56 2oo0 h LYS 185 N 1.00 0.55 -0.89 0.00 1.63 -1.04 -0.02 116.57 117.79 2oo0 h LYS 185 Ca 0.30 -0.06 0.10 0.00 -0.85 0.00 0.00 60.65 60.15 2oo0 h LYS 185 Cb -0.03 -0.11 -0.08 0.00 -0.60 0.00 0.00 32.23 31.41 2oo0 h LYS 185 CO -0.10 0.43 0.53 0.93 -3.45 0.00 0.00 179.45 177.79 2oo0 h GLU 186 N 0.52 0.85 -0.01 1.90 5.08 -1.11 -2.25 114.58 119.57 2oo0 h GLU 186 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2oo0 h GLU 186 Cb 0.03 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.08 2oo0 h GLU 186 CO -0.03 0.56 -0.04 1.28 -1.00 0.00 0.00 179.01 179.78 2oo0 n LEU 187 N -4.69 0.58 -2.28 1.33 4.77 -0.80 -4.92 117.00 111.00 2oo0 n LEU 187 Ca 0.16 -0.13 -0.17 0.00 -0.03 0.00 0.00 56.01 55.84 2oo0 n LEU 187 Cb 0.30 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2oo0 n LEU 187 CO 0.27 0.10 -0.00 -3.20 -1.33 0.00 0.00 177.39 173.23 2oo0 n ASN 188 N -0.68 -4.95 -4.82 -1.43 2.85 -0.52 -4.99 115.26 100.72 2oo0 n ASN 188 Ca 0.19 -0.21 -0.36 0.00 -0.11 0.00 0.00 54.58 54.09 2oo0 n ASN 188 Cb 0.24 -3.81 -0.07 0.00 1.24 0.00 0.00 39.78 37.39 2oo0 n ASN 188 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2oo0 s ILE 189 N -3.01 5.12 -0.30 -1.44 1.01 -0.14 -4.99 121.20 117.46 2oo0 s ILE 189 Ca 0.22 0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.69 2oo0 s ILE 189 Cb -0.10 -3.24 -0.01 0.00 0.01 0.00 0.00 42.46 39.12 2oo0 s ILE 189 CO 0.27 0.57 0.57 -0.62 0.00 0.00 0.00 174.94 175.73 2oo0 s ASP 190 N -1.12 6.44 -0.24 3.58 2.15 -1.26 -4.37 116.67 121.84 2oo0 s ASP 190 Ca 0.16 0.36 -0.11 0.00 0.43 0.00 0.00 52.55 53.39 2oo0 s ASP 190 Cb -0.12 -2.30 -0.05 0.00 -0.30 0.00 0.00 42.92 40.15 2oo0 s ASP 190 CO 0.06 -0.42 0.20 -0.69 -0.17 0.00 0.00 175.17 174.15 2oo0 s VAL 191 N 2.47 5.33 -0.60 1.11 1.01 -1.26 -0.68 120.40 127.77 2oo0 s VAL 191 Ca 0.22 0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.55 2oo0 s VAL 191 Cb -0.15 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2oo0 s VAL 191 CO 0.11 0.32 0.50 1.33 0.00 0.00 0.00 175.10 177.36 2oo0 n VAL 192 N 4.35 0.00 -3.07 2.92 0.24 0.57 -4.59 118.33 118.74 2oo0 n VAL 192 Ca -0.14 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 2oo0 n VAL 192 Cb 0.52 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.96 2oo0 n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oo0 n GLY 193 N 0.79 -0.99 2.95 7.63 0.00 -1.22 -0.72 105.19 113.63 2oo0 n GLY 193 Ca 0.03 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 2oo0 n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oo0 s VAL 194 N -3.00 0.35 0.23 1.61 1.01 -0.31 -1.28 120.40 119.01 2oo0 s VAL 194 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.87 2oo0 s VAL 194 Cb 0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 2oo0 s VAL 194 CO 0.00 0.10 -0.13 -0.94 0.00 0.00 0.00 175.10 174.13 2oo0 s SER 195 N -0.11 2.75 0.15 3.32 1.04 -0.34 -1.00 113.70 119.50 2oo0 s SER 195 Ca 0.02 -1.07 -0.16 0.00 0.48 0.00 0.00 55.95 55.22 2oo0 s SER 195 Cb -0.02 -0.16 0.03 0.00 0.10 0.00 0.00 66.02 65.97 2oo0 s SER 195 CO -0.00 -0.20 0.42 0.72 0.98 0.00 0.00 173.24 175.17 2oo0 s PHE 196 N -2.93 -0.12 -0.06 5.02 -0.12 -0.68 -0.98 117.98 118.11 2oo0 s PHE 196 Ca 0.25 -0.21 -0.01 0.00 -0.05 0.00 0.00 56.93 56.91 2oo0 s PHE 196 Cb 0.00 0.27 0.03 0.00 -0.63 0.00 0.00 43.02 42.68 2oo0 s PHE 196 CO 0.09 -0.76 -0.01 -1.58 -0.05 0.00 0.00 175.22 172.91 2oo0 s HIS 197 N -3.84 0.64 -1.86 3.49 2.46 -1.26 -2.43 115.29 112.49 2oo0 s HIS 197 Ca 0.06 -0.15 0.28 0.00 0.47 0.00 0.00 55.06 55.71 2oo0 s HIS 197 Cb 0.01 -0.73 1.59 0.00 -0.13 0.00 0.00 32.58 33.32 2oo0 s HIS 197 CO -0.08 -0.28 1.99 1.33 -2.47 0.00 0.00 174.74 175.22 2oo0 n VAL 198 N 4.85 0.03 0.00 0.89 0.24 -1.26 -4.63 118.33 118.45 2oo0 n VAL 198 Ca -0.12 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2oo0 n VAL 198 Cb 0.50 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.30 2oo0 n VAL 198 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oo0 n GLY 199 N 0.80 2.59 3.77 7.63 0.00 -1.26 -4.21 105.19 114.52 2oo0 n GLY 199 Ca 0.19 -1.58 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2oo0 n GLY 199 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oo0 s SER 200 N 0.00 6.57 -0.93 1.61 0.15 -0.90 -3.39 113.70 116.81 2oo0 s SER 200 Ca 0.00 2.45 -0.02 0.00 0.70 0.00 0.00 55.95 59.08 2oo0 s SER 200 Cb 0.00 -2.62 -0.02 0.00 -1.71 0.00 0.00 66.02 61.66 2oo0 s SER 200 CO 0.00 -0.65 0.79 0.61 1.20 0.00 0.00 173.24 175.18 2oo0 n GLY 201 N 0.71 -0.42 3.71 9.45 0.00 -1.23 -1.41 105.19 115.99 2oo0 n GLY 201 Ca 0.03 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2oo0 n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oo0 n THR 203 N 1.23 0.00 -3.95 0.00 -2.24 -1.26 -4.92 114.28 103.15 2oo0 n THR 203 Ca 0.07 -0.34 -0.31 0.00 -2.27 0.00 0.00 64.05 61.20 2oo0 n THR 203 Cb 0.35 0.85 -0.15 0.00 -2.10 0.00 0.00 70.33 69.28 2oo0 n THR 203 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2oo0 s ASP 204 N -1.24 4.55 0.59 3.42 2.15 -1.26 -4.97 116.67 119.91 2oo0 s ASP 204 Ca 0.00 -2.14 0.35 0.00 0.43 0.00 0.00 52.55 51.19 2oo0 s ASP 204 Cb 0.00 -1.46 1.88 0.00 -0.30 0.00 0.00 42.92 43.04 2oo0 s ASP 204 CO 0.00 -0.37 2.21 1.55 -0.17 0.00 0.00 175.17 178.38 2oo0 h PRO 205 N 7.58 0.00 -0.04 4.34 0.13 -1.94 -2.24 132.00 139.83 2oo0 h PRO 205 Ca -0.06 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2oo0 h PRO 205 Cb 1.01 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2oo0 h PRO 205 CO 0.52 0.04 0.05 0.93 -0.23 0.00 0.00 178.00 179.31 2oo0 h GLU 206 N 0.00 0.00 0.00 0.86 4.39 -1.97 -1.72 114.58 116.14 2oo0 h GLU 206 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2oo0 h GLU 206 Cb 0.18 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2oo0 h GLU 206 CO 0.00 0.00 -0.11 1.79 -1.16 0.00 0.00 179.01 179.53 2oo0 h THR 207 N 0.00 0.74 -0.59 1.13 1.35 -1.73 -0.54 112.91 113.27 2oo0 h THR 207 Ca 0.02 -0.45 -0.03 0.00 -0.55 0.00 0.00 66.41 65.40 2oo0 h THR 207 Cb 0.12 1.27 -0.03 0.00 -1.73 0.00 0.00 68.15 67.78 2oo0 h THR 207 CO -0.00 0.11 0.24 -0.26 -0.25 0.00 0.00 175.52 175.36 2oo0 h PHE 208 N 0.00 0.89 -0.33 4.73 -1.00 -1.52 -0.98 116.94 118.72 2oo0 h PHE 208 Ca -0.00 -0.06 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 2oo0 h PHE 208 Cb 0.26 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 2oo0 h PHE 208 CO 0.00 0.71 0.13 0.28 -1.61 0.00 0.00 178.31 177.81 2oo0 h VAL 209 N 0.81 1.19 -0.75 -0.55 2.07 -1.23 -0.35 116.25 117.43 2oo0 h VAL 209 Ca 0.20 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2oo0 h VAL 209 Cb 0.19 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2oo0 h VAL 209 CO -0.02 0.20 0.47 -0.61 0.02 0.00 0.00 177.57 177.64 2oo0 h GLN 210 N 0.38 1.01 -0.55 1.57 5.75 -1.25 -0.83 115.11 121.18 2oo0 h GLN 210 Ca 0.11 -0.08 -0.08 0.00 -0.15 0.00 0.00 58.65 58.46 2oo0 h GLN 210 Cb 0.19 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 2oo0 h GLN 210 CO -0.01 0.69 0.05 0.00 -2.65 0.00 0.00 178.83 176.91 2oo0 h ALA 211 N 1.26 0.74 -0.40 3.38 0.00 -0.92 -0.05 119.26 123.26 2oo0 h ALA 211 Ca 0.27 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2oo0 h ALA 211 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2oo0 h ALA 211 CO -0.05 0.53 0.05 0.82 0.00 0.00 0.00 179.25 180.59 2oo0 h ILE 212 N 0.83 1.25 0.01 0.00 2.04 -0.92 0.86 117.51 121.58 2oo0 h ILE 212 Ca 0.16 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 65.12 2oo0 h ILE 212 Cb 0.47 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 2oo0 h ILE 212 CO 0.02 0.31 -0.08 -1.28 0.00 0.00 0.00 178.15 177.12 2oo0 h SER 213 N 0.53 -0.22 -0.88 1.72 0.87 -1.04 -1.48 113.55 113.05 2oo0 h SER 213 Ca 0.12 0.03 0.07 0.00 -1.23 0.00 0.00 61.79 60.79 2oo0 h SER 213 Cb 0.40 0.10 -0.07 0.00 -0.44 0.00 0.00 62.40 62.39 2oo0 h SER 213 CO 0.01 -0.12 0.54 0.44 -0.53 0.00 0.00 176.83 177.18 2oo0 h ASP 214 N -0.14 0.84 -0.69 6.23 3.32 -0.87 -2.37 116.42 122.73 2oo0 h ASP 214 Ca 0.03 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2oo0 h ASP 214 Cb 0.18 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 2oo0 h ASP 214 CO -0.08 0.52 0.35 0.00 -1.72 0.00 0.00 179.24 178.31 2oo0 h ALA 215 N 1.43 1.28 -0.59 3.45 0.00 -0.51 -2.18 119.26 122.13 2oo0 h ALA 215 Ca 0.39 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2oo0 h ALA 215 Cb 0.23 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2oo0 h ALA 215 CO -0.19 0.56 0.39 -0.09 0.00 0.00 0.00 179.25 179.92 2oo0 h ARG 216 N 1.00 0.78 -0.71 0.00 9.65 -0.79 -0.62 114.38 123.68 2oo0 h ARG 216 Ca 0.25 -0.05 0.10 0.00 -1.10 0.00 0.00 59.98 59.18 2oo0 h ARG 216 Cb 0.09 -0.17 -0.08 0.00 -1.39 0.00 0.00 29.97 28.42 2oo0 h ARG 216 CO -0.03 0.51 0.34 0.00 2.80 0.00 0.00 179.97 183.59 2oo0 h VAL 218 N 0.56 1.31 -0.53 0.00 2.07 -1.06 -0.80 116.25 117.80 2oo0 h VAL 218 Ca 0.36 -1.73 0.11 0.00 0.82 0.00 0.00 66.70 66.26 2oo0 h VAL 218 Cb 0.42 1.89 -0.10 0.00 -1.52 0.00 0.00 31.29 31.98 2oo0 h VAL 218 CO -0.30 0.54 -0.15 -0.26 0.02 0.00 0.00 177.57 177.42 2oo0 h PHE 219 N 0.38 -0.33 -0.63 1.57 -1.00 -0.82 0.26 116.94 116.37 2oo0 h PHE 219 Ca -0.01 0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.82 2oo0 h PHE 219 Cb 1.12 0.23 -0.03 0.00 3.61 0.00 0.00 35.95 40.88 2oo0 h PHE 219 CO 0.09 -0.25 0.39 -0.44 -1.61 0.00 0.00 178.31 176.50 2oo0 h ASP 220 N -0.02 0.75 -0.30 2.17 3.32 -0.75 -1.18 116.42 120.41 2oo0 h ASP 220 Ca 0.25 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2oo0 h ASP 220 Cb 0.41 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2oo0 h ASP 220 CO -0.56 0.58 -0.05 0.24 -1.72 0.00 0.00 179.24 177.73 2oo0 h MET 221 N 0.86 0.68 -0.72 3.56 2.86 -0.71 -2.46 114.93 119.00 2oo0 h MET 221 Ca 0.23 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 2oo0 h MET 221 Cb -0.04 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 2oo0 h MET 221 CO -0.04 0.73 0.32 0.78 1.06 0.00 0.00 176.91 179.75 2oo0 h GLY 222 N 0.95 1.13 0.95 8.32 0.00 -0.07 -2.56 103.07 111.79 2oo0 h GLY 222 Ca 0.12 -0.59 0.02 0.00 0.00 0.00 0.00 47.33 46.88 2oo0 h GLY 222 CO 0.02 0.56 0.43 0.00 0.00 0.00 0.00 176.54 177.55 2oo0 h ALA 223 N 1.15 0.86 -0.54 3.60 0.00 -0.95 0.14 119.26 123.51 2oo0 h ALA 223 Ca 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2oo0 h ALA 223 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2oo0 h ALA 223 CO -0.03 0.23 0.25 0.93 0.00 0.00 0.00 179.25 180.64 2oo0 h GLU 224 N 0.86 0.76 0.00 0.00 5.08 -1.22 -2.83 114.58 117.23 2oo0 h GLU 224 Ca 0.26 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2oo0 h GLU 224 Cb -0.05 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.06 2oo0 h GLU 224 CO -0.08 0.60 -0.42 -0.39 -1.00 0.00 0.00 179.01 177.73 2oo0 h VAL 225 N 0.76 0.00 0.00 3.13 -1.51 -1.24 -3.48 116.25 113.91 2oo0 h VAL 225 Ca 0.19 -0.82 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 2oo0 h VAL 225 Cb 0.10 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 30.85 2oo0 h VAL 225 CO -0.02 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.93 2oo0 n GLY 226 N 1.20 1.04 3.86 5.19 0.00 -0.68 -5.04 105.19 110.77 2oo0 n GLY 226 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2oo0 n GLY 226 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oo0 s PHE 227 N -1.74 3.40 -0.87 1.61 0.08 0.39 -4.98 117.98 115.87 2oo0 s PHE 227 Ca 0.00 1.03 -0.07 0.00 0.12 0.00 0.00 56.93 58.01 2oo0 s PHE 227 Cb 0.00 -2.38 0.22 0.00 -0.57 0.00 0.00 43.02 40.29 2oo0 s PHE 227 CO 0.00 0.19 0.78 -1.54 -0.10 0.00 0.00 175.22 174.55 2oo0 s SER 228 N -2.32 6.34 0.05 1.36 1.04 -1.26 -3.78 113.70 115.13 2oo0 s SER 228 Ca 0.50 -3.25 -0.30 0.00 0.48 0.00 0.00 55.95 53.38 2oo0 s SER 228 Cb -0.11 -2.04 -0.05 0.00 0.10 0.00 0.00 66.02 63.92 2oo0 s SER 228 CO 0.19 -0.34 1.13 -0.04 0.98 0.00 0.00 173.24 175.16 2oo0 s MET 229 N -0.68 4.48 0.00 4.02 1.00 -1.26 -4.88 119.30 121.97 2oo0 s MET 229 Ca 0.24 1.66 0.00 0.00 0.00 0.00 0.00 55.69 57.59 2oo0 s MET 229 Cb -0.11 -3.38 0.00 0.00 0.00 0.00 0.00 34.83 31.34 2oo0 s MET 229 CO -0.09 -0.17 0.00 2.48 0.00 0.00 0.00 175.02 177.24 2oo0 n TYR 230 N 3.82 0.00 -3.93 -0.03 0.18 0.10 -4.88 117.16 112.42 2oo0 n TYR 230 Ca 0.08 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.51 2oo0 n TYR 230 Cb 0.48 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.30 2oo0 n TYR 230 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 2oo0 s LEU 231 N 0.00 2.90 -0.18 -3.48 0.20 -0.54 0.63 118.68 118.21 2oo0 s LEU 231 Ca 0.00 -0.50 -0.02 0.00 0.69 0.00 0.00 54.13 54.29 2oo0 s LEU 231 Cb 0.00 -1.71 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 2oo0 s LEU 231 CO 0.00 -0.04 -0.08 -0.22 -0.29 0.00 0.00 176.35 175.72 2oo0 s LEU 232 N 1.44 2.86 -0.25 -0.68 2.96 -0.36 -1.17 118.68 123.47 2oo0 s LEU 232 Ca 0.05 -0.34 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2oo0 s LEU 232 Cb -0.15 -1.69 0.06 0.00 0.50 0.00 0.00 46.19 44.92 2oo0 s LEU 232 CO -0.04 0.08 -0.07 -0.62 -1.32 0.00 0.00 176.35 174.37 2oo0 s ASP 233 N 0.90 4.17 0.00 3.68 -1.08 -0.17 0.20 116.67 124.37 2oo0 s ASP 233 Ca -0.02 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 50.82 2oo0 s ASP 233 Cb -0.15 -1.36 0.41 0.00 -1.46 0.00 0.00 42.92 40.35 2oo0 s ASP 233 CO 0.00 -0.22 1.33 2.30 0.52 0.00 0.00 175.17 179.11 2oo0 n ILE 234 N 4.54 0.57 -4.61 4.11 -5.35 -0.23 -1.69 119.36 116.71 2oo0 n ILE 234 Ca -0.12 -0.58 0.00 0.00 -0.27 0.00 0.00 62.75 61.78 2oo0 n ILE 234 Cb 0.43 0.31 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 2oo0 n ILE 234 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2oo0 n GLY 235 N 1.20 0.71 0.00 3.28 0.00 -1.02 -4.71 105.19 104.65 2oo0 n GLY 235 Ca 0.15 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2oo0 n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oo0 n GLY 236 N 0.00 5.24 0.00 -0.02 0.00 -1.25 -0.42 105.19 108.73 2oo0 n GLY 236 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2oo0 n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oo0 n GLY 237 N 4.23 0.37 3.77 -0.02 0.00 -1.26 -4.51 105.19 107.78 2oo0 n GLY 237 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2oo0 n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oo0 s PHE 238 N -2.00 2.98 0.62 1.61 0.08 -1.26 -1.84 117.98 118.16 2oo0 s PHE 238 Ca 0.00 1.56 -0.16 0.00 0.12 0.00 0.00 56.93 58.45 2oo0 s PHE 238 Cb 0.00 -3.31 -0.02 0.00 -0.57 0.00 0.00 43.02 39.12 2oo0 s PHE 238 CO 0.00 -1.27 1.09 -1.25 -0.10 0.00 0.00 175.22 173.69 2oo0 s PRO 239 N -2.66 3.08 0.00 0.24 0.04 -1.26 -3.78 135.00 130.66 2oo0 s PRO 239 Ca 0.62 1.36 0.13 0.00 0.04 0.00 0.00 61.00 63.15 2oo0 s PRO 239 Cb -0.27 -1.99 0.20 0.00 0.04 0.00 0.00 34.50 32.48 2oo0 s PRO 239 CO 0.33 -1.02 1.06 0.41 0.04 0.00 0.00 177.00 177.81 2oo0 n GLY 240 N -0.57 1.00 3.56 0.56 0.00 -1.26 -4.16 105.19 104.33 2oo0 n GLY 240 Ca 0.10 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 2oo0 n GLY 240 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oo0 s SER 241 N -1.04 0.67 0.00 1.61 1.04 -1.26 -2.43 113.70 112.30 2oo0 s SER 241 Ca 0.20 -1.38 0.25 0.00 0.48 0.00 0.00 55.95 55.50 2oo0 s SER 241 Cb 0.12 0.69 0.55 0.00 0.10 0.00 0.00 66.02 67.48 2oo0 s SER 241 CO 0.17 -1.36 1.44 -0.62 0.98 0.00 0.00 173.24 173.84 2oo0 n GLU 242 N -0.55 0.22 -0.93 4.02 -0.58 -1.26 -4.45 120.64 117.11 2oo0 n GLU 242 Ca -0.01 -0.13 -0.12 0.00 -0.42 0.00 0.00 57.16 56.48 2oo0 n GLU 242 Cb 0.61 -1.50 -0.15 0.00 -0.57 0.00 0.00 31.44 29.84 2oo0 n GLU 242 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2oo0 n ASP 243 N -1.28 4.97 -3.99 1.62 2.03 -1.26 -4.83 116.55 113.81 2oo0 n ASP 243 Ca 0.07 -2.40 -0.08 0.00 0.52 0.00 0.00 54.79 52.90 2oo0 n ASP 243 Cb 0.34 -1.31 -0.09 0.00 -0.72 0.00 0.00 41.12 39.34 2oo0 n ASP 243 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2oo0 s VAL 244 N 1.25 0.17 0.08 5.18 -7.23 -1.26 -5.07 120.40 113.52 2oo0 s VAL 244 Ca 0.61 -1.44 -0.15 0.00 -1.81 0.00 0.00 61.98 59.20 2oo0 s VAL 244 Cb 0.28 -1.25 -0.15 0.00 0.56 0.00 0.00 36.38 35.83 2oo0 s VAL 244 CO -0.00 -0.79 1.31 0.50 -0.31 0.00 0.00 175.10 175.80 2oo0 h LYS 245 N 3.27 0.69 -4.40 4.82 3.64 -1.97 -3.41 116.57 119.21 2oo0 h LYS 245 Ca -0.34 -0.51 -0.72 0.00 -1.27 0.00 0.00 60.65 57.82 2oo0 h LYS 245 Cb 1.17 0.09 -0.29 0.00 -0.41 0.00 0.00 32.23 32.79 2oo0 h LYS 245 CO 0.58 1.13 -0.45 -1.17 -2.27 0.00 0.00 179.45 177.28 2oo0 s LEU 246 N -8.61 5.36 0.57 5.20 2.96 -1.26 -5.08 118.68 117.82 2oo0 s LEU 246 Ca -0.12 -1.71 -0.10 0.00 -0.22 0.00 0.00 54.13 51.99 2oo0 s LEU 246 Cb 0.08 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2oo0 s LEU 246 CO 0.86 -0.60 0.95 -0.54 -1.32 0.00 0.00 176.35 175.71 2oo0 s LYS 247 N 1.37 3.60 0.18 1.98 1.02 -1.26 -4.72 119.74 121.91 2oo0 s LYS 247 Ca 0.04 0.60 -0.17 0.00 0.02 0.00 0.00 55.97 56.46 2oo0 s LYS 247 Cb -0.24 -2.17 0.13 0.00 -0.52 0.00 0.00 37.83 35.02 2oo0 s LYS 247 CO 0.00 -0.44 1.64 0.35 -0.92 0.00 0.00 175.35 175.98 2oo0 h PHE 248 N -0.08 -0.40 0.00 3.18 3.57 -1.88 -2.11 116.94 119.21 2oo0 h PHE 248 Ca -0.45 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.06 2oo0 h PHE 248 Cb 1.19 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 40.18 2oo0 h PHE 248 CO 0.64 -0.25 -0.16 0.93 -2.23 0.00 0.00 178.31 177.23 2oo0 h GLU 249 N -0.07 0.00 0.00 1.11 3.07 -1.99 -0.47 114.58 116.23 2oo0 h GLU 249 Ca 0.22 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.99 2oo0 h GLU 249 Cb 0.41 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 2oo0 h GLU 249 CO -0.50 0.16 -0.41 1.49 -1.40 0.00 0.00 179.01 178.35 2oo0 h GLU 250 N 0.00 0.00 0.01 2.33 4.81 -1.77 -1.77 114.58 118.19 2oo0 h GLU 250 Ca -0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2oo0 h GLU 250 Cb 0.32 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.70 2oo0 h GLU 250 CO 0.02 0.41 -0.24 0.82 -0.73 0.00 0.00 179.01 179.28 2oo0 h ILE 251 N 0.00 1.59 -0.04 2.32 2.04 -0.91 -3.29 117.51 119.22 2oo0 h ILE 251 Ca -0.00 -2.05 -0.06 0.00 1.00 0.00 0.00 64.86 63.74 2oo0 h ILE 251 Cb 0.94 2.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.92 2oo0 h ILE 251 CO 0.05 0.56 -0.27 0.71 0.00 0.00 0.00 178.15 179.20 2oo0 h THR 252 N -0.59 1.21 -0.09 -0.27 1.35 -1.21 -1.10 112.91 112.21 2oo0 h THR 252 Ca -0.03 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2oo0 h THR 252 Cb 1.04 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.94 2oo0 h THR 252 CO 0.05 0.29 0.06 1.23 -0.25 0.00 0.00 175.52 176.90 2oo0 h GLY 253 N 0.87 0.12 0.64 5.82 0.00 -1.44 -1.02 103.07 108.07 2oo0 h GLY 253 Ca 0.01 -0.05 -0.24 0.00 0.00 0.00 0.00 47.33 47.05 2oo0 h GLY 253 CO 0.04 0.04 -1.81 3.33 0.00 0.00 0.00 176.54 178.15 2oo0 n VAL 254 N -4.52 1.26 0.04 4.60 0.24 -0.74 -4.40 118.33 114.80 2oo0 n VAL 254 Ca -0.02 -0.75 -0.13 0.00 -2.04 0.00 0.00 64.34 61.41 2oo0 n VAL 254 Cb 0.09 -0.69 -0.08 0.00 -1.47 0.00 0.00 33.84 31.69 2oo0 n VAL 254 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2oo0 h ILE 255 N 0.00 1.11 -0.29 1.34 2.04 -0.91 -3.25 117.51 117.54 2oo0 h ILE 255 Ca -0.29 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.12 2oo0 h ILE 255 Cb 1.83 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 39.31 2oo0 h ILE 255 CO 0.05 0.13 -0.08 0.78 0.00 0.00 0.00 178.15 179.02 2oo0 h ASN 256 N -0.29 -0.30 -0.71 1.72 2.35 -1.40 -0.77 115.58 116.18 2oo0 h ASN 256 Ca -0.01 0.09 0.05 0.00 -0.55 0.00 0.00 56.30 55.89 2oo0 h ASN 256 Cb 0.26 0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 2oo0 h ASN 256 CO 0.01 -0.11 0.47 -0.65 -1.65 0.00 0.00 177.43 175.50 2oo0 h PRO 257 N -0.02 0.76 -0.51 0.81 0.11 -1.77 -1.20 132.00 130.18 2oo0 h PRO 257 Ca 0.14 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.09 2oo0 h PRO 257 Cb 0.23 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 2oo0 h PRO 257 CO -0.31 0.51 -0.13 0.00 -0.21 0.00 0.00 178.00 177.86 2oo0 h ALA 258 N 1.60 0.81 -0.20 -0.75 0.00 -1.29 -2.06 119.26 117.38 2oo0 h ALA 258 Ca 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2oo0 h ALA 258 Cb 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2oo0 h ALA 258 CO -0.09 0.66 0.09 -0.07 0.00 0.00 0.00 179.25 179.83 2oo0 h LEU 259 N 0.86 0.27 -1.86 0.00 3.38 -0.77 -1.67 115.31 115.51 2oo0 h LEU 259 Ca 0.13 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2oo0 h LEU 259 Cb 0.68 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2oo0 h LEU 259 CO 0.05 0.34 0.09 0.44 0.09 0.00 0.00 178.44 179.45 2oo0 h ASP 260 N 0.18 0.16 0.06 -0.43 3.32 -1.16 0.45 116.42 119.00 2oo0 h ASP 260 Ca 0.07 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 2oo0 h ASP 260 Cb 0.15 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.67 2oo0 h ASP 260 CO -0.01 0.11 -0.37 0.50 -1.72 0.00 0.00 179.24 177.75 2oo0 h LYS 261 N 0.18 0.13 0.00 3.56 3.64 -1.20 -3.29 116.57 119.59 2oo0 h LYS 261 Ca 0.05 -0.22 -0.17 0.00 -1.27 0.00 0.00 60.65 59.04 2oo0 h LYS 261 Cb -0.02 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2oo0 h LYS 261 CO -0.01 1.10 -1.85 0.66 -2.27 0.00 0.00 179.45 177.08 2oo0 n TYR 262 N -4.40 0.41 -3.14 1.91 4.01 -0.64 -4.57 117.16 110.74 2oo0 n TYR 262 Ca -0.12 0.13 -0.21 0.00 -0.16 0.00 0.00 57.90 57.54 2oo0 n TYR 262 Cb 0.63 -0.89 -0.04 0.00 -0.31 0.00 0.00 39.34 38.73 2oo0 n TYR 262 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2oo0 n PHE 263 N -2.66 1.21 -1.53 -0.72 3.72 0.16 -4.94 117.46 112.70 2oo0 n PHE 263 Ca -0.15 -3.85 -0.36 0.00 -0.05 0.00 0.00 57.45 53.05 2oo0 n PHE 263 Cb 0.85 -0.44 0.09 0.00 -0.94 0.00 0.00 39.48 39.04 2oo0 n PHE 263 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2oo0 s PRO 264 N -2.56 2.25 0.49 -1.08 0.04 -1.20 -4.51 135.00 128.42 2oo0 s PRO 264 Ca 0.42 1.94 0.15 0.00 0.04 0.00 0.00 61.00 63.55 2oo0 s PRO 264 Cb 0.31 -1.82 1.19 0.00 0.04 0.00 0.00 34.50 34.21 2oo0 s PRO 264 CO -0.09 -1.80 2.11 0.66 0.04 0.00 0.00 177.00 177.91 2oo0 h SER 265 N 0.05 0.12 0.00 6.66 4.64 -1.90 0.25 113.55 123.36 2oo0 h SER 265 Ca -0.49 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2oo0 h SER 265 Cb 1.32 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2oo0 h SER 265 CO 0.51 0.08 0.00 -0.90 -0.87 0.00 0.00 176.83 175.65 2oo0 n ASP 266 N -4.51 0.00 0.06 4.97 3.85 -1.26 -1.99 116.55 117.68 2oo0 n ASP 266 Ca 0.00 -0.75 0.13 0.00 -0.71 0.00 0.00 54.79 53.46 2oo0 n ASP 266 Cb 0.15 0.00 0.46 0.00 -1.35 0.00 0.00 41.12 40.38 2oo0 n ASP 266 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2oo0 n SER 267 N -0.89 0.52 0.00 -1.12 3.41 0.07 -4.94 113.62 110.67 2oo0 n SER 267 Ca 0.11 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 2oo0 n SER 267 Cb 0.05 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 2oo0 n SER 267 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oo0 n GLY 268 N 1.38 0.78 3.77 5.00 0.00 -0.84 -5.02 105.19 110.26 2oo0 n GLY 268 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2oo0 n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oo0 s VAL 269 N -3.18 2.55 -0.28 1.61 0.11 -1.26 -4.91 120.40 115.04 2oo0 s VAL 269 Ca 0.00 0.54 -0.10 0.00 -2.93 0.00 0.00 61.98 59.49 2oo0 s VAL 269 Cb 0.00 -3.34 -0.03 0.00 -1.53 0.00 0.00 36.38 31.47 2oo0 s VAL 269 CO 0.00 0.12 0.14 -0.60 -3.33 0.00 0.00 175.10 171.43 2oo0 s ARG 270 N -1.65 3.74 -0.23 1.54 3.52 0.20 -4.98 118.95 121.09 2oo0 s ARG 270 Ca 0.51 -0.45 -0.10 0.00 -0.13 0.00 0.00 55.73 55.57 2oo0 s ARG 270 Cb -0.42 -3.53 -0.05 0.00 -1.56 0.00 0.00 34.95 29.40 2oo0 s ARG 270 CO 0.54 -0.23 0.14 0.42 -0.81 0.00 0.00 175.30 175.36 2oo0 s ILE 271 N 1.68 5.26 0.37 4.11 1.01 -1.26 -1.23 121.20 131.15 2oo0 s ILE 271 Ca 0.06 0.14 0.05 0.00 0.00 0.00 0.00 60.65 60.91 2oo0 s ILE 271 Cb -0.16 -3.44 -0.07 0.00 0.01 0.00 0.00 42.46 38.81 2oo0 s ILE 271 CO 0.08 0.37 0.04 0.27 0.00 0.00 0.00 174.94 175.70 2oo0 s ILE 272 N 0.91 1.48 0.20 2.92 -4.36 0.13 -1.31 121.20 121.17 2oo0 s ILE 272 Ca 0.07 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.41 2oo0 s ILE 272 Cb -0.13 -2.82 -0.03 0.00 1.25 0.00 0.00 42.46 40.73 2oo0 s ILE 272 CO 0.03 0.00 0.24 0.00 0.24 0.00 0.00 174.94 175.45 2oo0 s ALA 273 N -3.04 0.61 -0.50 2.27 0.00 -0.63 -1.07 121.76 119.41 2oo0 s ALA 273 Ca 0.34 -1.35 0.07 0.00 0.00 0.00 0.00 51.96 51.02 2oo0 s ALA 273 Cb 0.09 1.18 0.37 0.00 0.00 0.00 0.00 23.12 24.75 2oo0 s ALA 273 CO 0.16 -0.66 0.94 0.39 0.00 0.00 0.00 175.76 176.59 2oo0 n GLU 274 N -0.27 2.73 -2.27 0.00 1.02 0.44 -0.60 120.64 121.69 2oo0 n GLU 274 Ca -0.01 -4.42 -0.41 0.00 -0.02 0.00 0.00 57.16 52.31 2oo0 n GLU 274 Cb 0.64 -2.08 -0.03 0.00 -0.02 0.00 0.00 31.44 29.95 2oo0 n GLU 274 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2oo0 s PRO 275 N -3.28 4.47 0.00 3.49 0.04 -1.23 -3.93 135.00 134.57 2oo0 s PRO 275 Ca 0.46 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2oo0 s PRO 275 Cb 0.33 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.74 2oo0 s PRO 275 CO -0.13 -0.03 0.00 0.41 0.04 0.00 0.00 177.00 177.29 2oo0 n GLY 276 N 1.09 0.12 0.30 0.56 0.00 -1.26 -1.31 105.19 104.68 2oo0 n GLY 276 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2oo0 n GLY 276 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2oo0 h ARG 277 N 0.00 0.41 -0.78 1.61 2.43 -1.91 -1.87 114.38 114.26 2oo0 h ARG 277 Ca 0.00 -0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.32 2oo0 h ARG 277 Cb 0.00 -0.09 -0.11 0.00 -0.42 0.00 0.00 29.97 29.35 2oo0 h ARG 277 CO 0.00 0.27 0.25 -0.92 -1.51 0.00 0.00 179.97 178.06 2oo0 h TYR 278 N 0.42 0.41 -0.01 2.20 3.20 -1.72 -2.21 116.97 119.27 2oo0 h TYR 278 Ca 0.50 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 62.26 2oo0 h TYR 278 Cb 0.89 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 2oo0 h TYR 278 CO -0.15 -0.05 -0.71 1.88 -1.64 0.00 0.00 178.16 177.48 2oo0 h TYR 279 N 0.33 0.06 0.00 -3.82 0.05 -1.64 -3.41 116.97 108.54 2oo0 h TYR 279 Ca 0.45 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.20 2oo0 h TYR 279 Cb 0.78 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.51 2oo0 h TYR 279 CO -0.22 0.74 -0.92 1.33 -1.05 0.00 0.00 178.16 178.05 2oo0 n VAL 280 N -3.71 0.00 0.07 -2.88 0.24 -1.03 -4.50 118.33 106.51 2oo0 n VAL 280 Ca -0.01 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.17 2oo0 n VAL 280 Cb 0.69 0.25 -0.05 0.00 -1.47 0.00 0.00 33.84 33.27 2oo0 n VAL 280 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oo0 h ALA 281 N 0.00 -0.43 0.00 2.33 0.00 -1.58 -2.62 119.26 116.95 2oo0 h ALA 281 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oo0 h ALA 281 Cb 0.14 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2oo0 h ALA 281 CO 0.00 -0.81 0.00 0.66 0.00 0.00 0.00 179.25 179.10 2oo0 h SER 282 N -0.46 0.00 0.43 0.00 4.64 -1.77 -1.58 113.55 114.82 2oo0 h SER 282 Ca 0.06 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 2oo0 h SER 282 Cb 0.53 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 2oo0 h SER 282 CO -0.24 0.00 -0.31 0.00 -0.87 0.00 0.00 176.83 175.41 2oo0 h ALA 283 N 2.27 1.33 -3.14 5.18 0.00 -1.77 -3.42 119.26 119.70 2oo0 h ALA 283 Ca 0.00 -0.28 -0.62 0.00 0.00 0.00 0.00 54.91 54.00 2oo0 h ALA 283 Cb 0.64 -0.05 -0.17 0.00 0.00 0.00 0.00 17.79 18.21 2oo0 h ALA 283 CO 0.00 0.39 -0.55 -0.06 0.00 0.00 0.00 179.25 179.02 2oo0 s PHE 284 N -4.13 3.24 -0.11 0.00 0.40 -1.21 -0.90 117.98 115.26 2oo0 s PHE 284 Ca -0.02 0.03 0.02 0.00 -0.60 0.00 0.00 56.93 56.36 2oo0 s PHE 284 Cb 0.14 -2.18 -0.01 0.00 0.51 0.00 0.00 43.02 41.48 2oo0 s PHE 284 CO 0.69 0.02 -0.19 0.99 0.70 0.00 0.00 175.22 177.43 2oo0 s THR 285 N 0.88 2.57 -0.19 0.64 2.01 -0.63 -1.55 115.64 119.36 2oo0 s THR 285 Ca 0.05 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.12 2oo0 s THR 285 Cb -0.13 -2.03 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 2oo0 s THR 285 CO 0.03 0.55 0.10 -0.22 -0.69 0.00 0.00 174.62 174.38 2oo0 s LEU 286 N 0.24 4.05 -0.20 4.42 2.96 0.07 -1.62 118.68 128.60 2oo0 s LEU 286 Ca -0.12 0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 53.92 2oo0 s LEU 286 Cb -0.16 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.47 2oo0 s LEU 286 CO 0.07 0.19 -0.01 0.00 -1.32 0.00 0.00 176.35 175.28 2oo0 s ALA 287 N 0.27 3.00 0.15 5.97 0.00 0.01 -0.47 121.76 130.69 2oo0 s ALA 287 Ca 0.06 -1.01 0.10 0.00 0.00 0.00 0.00 51.96 51.12 2oo0 s ALA 287 Cb -0.12 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 2oo0 s ALA 287 CO -0.01 -0.18 -0.22 0.14 0.00 0.00 0.00 175.76 175.49 2oo0 s VAL 288 N 1.05 2.52 -0.08 0.00 -7.23 -0.19 -1.87 120.40 114.59 2oo0 s VAL 288 Ca 0.02 -1.78 -0.04 0.00 -1.81 0.00 0.00 61.98 58.36 2oo0 s VAL 288 Cb -0.14 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 2oo0 s VAL 288 CO 0.01 0.00 0.12 0.21 -0.31 0.00 0.00 175.10 175.14 2oo0 s ASN 289 N -2.36 6.12 -0.40 4.85 3.84 -1.26 -0.78 114.94 124.94 2oo0 s ASN 289 Ca 0.18 0.35 -0.29 0.00 0.21 0.00 0.00 52.86 53.32 2oo0 s ASN 289 Cb -0.09 -1.91 0.01 0.00 -0.55 0.00 0.00 41.25 38.71 2oo0 s ASN 289 CO 0.09 0.36 1.31 -0.63 -2.79 0.00 0.00 177.10 175.44 2oo0 s ILE 290 N -1.09 4.04 -0.04 -5.21 1.01 0.58 -2.73 121.20 117.75 2oo0 s ILE 290 Ca 0.18 1.09 0.22 0.00 0.00 0.00 0.00 60.65 62.15 2oo0 s ILE 290 Cb -0.12 -4.29 -0.33 0.00 0.01 0.00 0.00 42.46 37.73 2oo0 s ILE 290 CO 0.08 -0.75 0.49 2.30 0.00 0.00 0.00 174.94 177.06 2oo0 n ILE 291 N 6.80 0.05 -3.73 2.92 -5.35 0.83 -0.54 119.36 120.35 2oo0 n ILE 291 Ca 0.15 -0.51 -0.10 0.00 -0.27 0.00 0.00 62.75 62.02 2oo0 n ILE 291 Cb 0.48 -0.02 -0.05 0.00 -1.74 0.00 0.00 39.64 38.31 2oo0 n ILE 291 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2oo0 s ALA 292 N -3.49 -0.72 -0.19 -1.28 0.00 -1.15 -4.92 121.76 110.00 2oo0 s ALA 292 Ca -0.08 -0.28 -0.17 0.00 0.00 0.00 0.00 51.96 51.43 2oo0 s ALA 292 Cb 0.14 0.74 0.05 0.00 0.00 0.00 0.00 23.12 24.05 2oo0 s ALA 292 CO 0.90 -0.68 0.51 0.21 0.00 0.00 0.00 175.76 176.71 2oo0 s LYS 293 N -3.85 0.58 0.04 0.00 2.20 -1.26 -1.51 119.74 115.94 2oo0 s LYS 293 Ca 0.07 0.75 0.03 0.00 -0.36 0.00 0.00 55.97 56.46 2oo0 s LYS 293 Cb 0.02 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.57 2oo0 s LYS 293 CO -0.08 -0.08 -0.11 0.15 -0.36 0.00 0.00 175.35 174.88 2oo0 s LYS 294 N 0.45 0.68 -0.17 4.03 1.02 -0.23 -5.00 119.74 120.52 2oo0 s LYS 294 Ca -0.01 -0.74 -0.02 0.00 0.02 0.00 0.00 55.97 55.21 2oo0 s LYS 294 Cb -0.04 -0.59 -0.01 0.00 -0.52 0.00 0.00 37.83 36.66 2oo0 s LYS 294 CO -0.02 0.13 -0.08 -1.50 -0.92 0.00 0.00 175.35 172.97 2oo0 s ILE 295 N -1.09 3.36 -0.22 2.17 2.07 -1.26 -1.17 121.20 125.05 2oo0 s ILE 295 Ca -0.04 -0.53 0.01 0.00 -1.41 0.00 0.00 60.65 58.68 2oo0 s ILE 295 Cb -0.09 -2.47 0.04 0.00 0.13 0.00 0.00 42.46 40.07 2oo0 s ILE 295 CO 0.01 0.48 -0.14 -0.69 -1.91 0.00 0.00 174.94 172.69 2oo0 s VAL 296 N 0.80 2.26 -0.27 4.00 1.01 0.43 -4.99 120.40 123.64 2oo0 s VAL 296 Ca -0.03 -1.23 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 2oo0 s VAL 296 Cb -0.15 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2oo0 s VAL 296 CO 0.01 0.25 1.58 -0.76 0.00 0.00 0.00 175.10 176.18 2oo0 s LEU 297 N 1.22 3.80 0.00 3.92 2.01 -1.26 -1.08 118.68 127.30 2oo0 s LEU 297 Ca -0.01 1.43 0.00 0.00 0.01 0.00 0.00 54.13 55.56 2oo0 s LEU 297 Cb -0.16 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.50 2oo0 s LEU 297 CO -0.08 -1.32 0.28 -0.62 1.01 0.00 0.00 176.35 175.62 2oo0 n GLU 311 N 7.77 0.00 -3.35 1.70 1.02 -1.26 -4.91 120.64 121.61 2oo0 n GLU 311 Ca 0.19 0.12 -0.39 0.00 -0.02 0.00 0.00 57.16 57.06 2oo0 n GLU 311 Cb 0.46 -0.78 -0.08 0.00 -0.02 0.00 0.00 31.44 31.02 2oo0 n GLU 311 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2oo0 s GLN 312 N -0.57 4.13 0.17 3.49 0.74 -1.26 -5.09 119.66 121.27 2oo0 s GLN 312 Ca 0.00 0.21 0.07 0.00 0.05 0.00 0.00 55.36 55.69 2oo0 s GLN 312 Cb 0.00 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 2oo0 s GLN 312 CO 0.00 -0.15 -0.14 0.95 -0.55 0.00 0.00 175.29 175.40 2oo0 s THR 313 N 1.66 1.54 0.04 -0.34 -4.23 -0.24 -4.36 115.64 109.71 2oo0 s THR 313 Ca 0.19 -2.05 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 2oo0 s THR 313 Cb -0.15 -1.88 -0.02 0.00 1.34 0.00 0.00 72.50 71.79 2oo0 s THR 313 CO 0.09 -0.56 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.10 2oo0 s PHE 314 N -2.78 1.27 -0.17 3.99 0.08 -0.80 -0.43 117.98 119.14 2oo0 s PHE 314 Ca 0.18 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 56.87 2oo0 s PHE 314 Cb -0.01 -0.75 0.01 0.00 -0.57 0.00 0.00 43.02 41.69 2oo0 s PHE 314 CO 0.05 0.04 -0.17 -1.64 -0.10 0.00 0.00 175.22 173.40 2oo0 s MET 315 N -1.19 3.09 -0.10 0.44 -1.94 -0.32 -1.29 119.30 117.99 2oo0 s MET 315 Ca 0.02 -0.79 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 2oo0 s MET 315 Cb -0.08 -2.62 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 2oo0 s MET 315 CO 0.01 -0.12 -0.11 0.71 -0.01 0.00 0.00 175.02 175.50 2oo0 s TYR 316 N 1.13 2.84 -0.13 -0.03 2.02 -0.32 -1.06 117.35 121.79 2oo0 s TYR 316 Ca 0.01 -0.35 -0.03 0.00 -0.37 0.00 0.00 57.07 56.32 2oo0 s TYR 316 Cb -0.14 -1.79 -0.03 0.00 -0.40 0.00 0.00 41.96 39.60 2oo0 s TYR 316 CO -0.07 0.01 -0.02 0.71 -1.57 0.00 0.00 175.55 174.61 2oo0 s TYR 317 N -0.12 3.07 0.36 2.71 1.51 -0.57 -0.23 117.35 124.08 2oo0 s TYR 317 Ca -0.00 -0.11 0.08 0.00 -1.01 0.00 0.00 57.07 56.02 2oo0 s TYR 317 Cb -0.13 -1.91 -0.07 0.00 -0.11 0.00 0.00 41.96 39.74 2oo0 s TYR 317 CO 0.03 0.14 -0.03 0.14 -1.11 0.00 0.00 175.55 174.72 2oo0 s VAL 318 N -0.04 1.96 -0.37 0.71 -7.23 0.37 -0.12 120.40 115.69 2oo0 s VAL 318 Ca 0.02 -2.09 0.06 0.00 -1.81 0.00 0.00 61.98 58.15 2oo0 s VAL 318 Cb -0.13 -2.77 0.59 0.00 0.56 0.00 0.00 36.38 34.63 2oo0 s VAL 318 CO 0.02 -0.12 1.70 -0.46 -0.31 0.00 0.00 175.10 175.94 2oo0 n ASN 319 N -0.82 3.99 -3.84 4.85 0.23 -1.11 -2.28 115.26 116.29 2oo0 n ASN 319 Ca -0.05 -3.18 -0.12 0.00 -0.53 0.00 0.00 54.58 50.70 2oo0 n ASN 319 Cb 0.65 -0.75 -0.10 0.00 -2.08 0.00 0.00 39.78 37.50 2oo0 n ASN 319 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2oo0 s ASP 320 N -0.84 -0.05 0.00 0.53 -1.08 -1.26 -4.61 116.67 109.36 2oo0 s ASP 320 Ca 0.47 -0.05 0.00 0.00 -0.52 0.00 0.00 52.55 52.45 2oo0 s ASP 320 Cb 0.38 0.26 0.00 0.00 -1.46 0.00 0.00 42.92 42.10 2oo0 s ASP 320 CO 0.10 -0.33 0.00 0.61 0.52 0.00 0.00 175.17 176.07 2oo0 n GLY 321 N 1.70 3.56 0.29 2.66 0.00 -1.26 -4.38 105.19 107.75 2oo0 n GLY 321 Ca -0.21 -1.13 0.17 0.00 0.00 0.00 0.00 46.02 44.86 2oo0 n GLY 321 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2oo0 h VAL 322 N 0.36 0.21 0.00 1.61 2.07 -1.89 0.26 116.25 118.87 2oo0 h VAL 322 Ca 0.00 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2oo0 h VAL 322 Cb 0.00 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2oo0 h VAL 322 CO 0.00 0.04 -0.45 1.88 0.02 0.00 0.00 177.57 179.07 2oo0 h TYR 323 N 0.00 0.00 0.00 1.57 -1.99 -1.93 -2.50 116.97 112.12 2oo0 h TYR 323 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2oo0 h TYR 323 Cb 0.28 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.01 2oo0 h TYR 323 CO 0.00 0.02 0.00 0.41 -0.00 0.00 0.00 178.16 178.59 2oo0 n GLY 324 N 1.14 0.60 0.26 3.88 0.00 -0.04 -0.41 105.19 110.61 2oo0 n GLY 324 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2oo0 n GLY 324 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2oo0 h SER 325 N 0.00 0.00 -0.31 1.61 0.02 -1.81 -2.32 113.55 110.75 2oo0 h SER 325 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2oo0 h SER 325 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2oo0 h SER 325 CO 0.00 0.07 0.00 0.49 -1.14 0.00 0.00 176.83 176.25 2oo0 n PHE 326 N -4.22 0.43 -0.00 3.45 3.72 -0.47 -3.53 117.46 116.84 2oo0 n PHE 326 Ca -0.03 -0.21 0.23 0.00 -0.05 0.00 0.00 57.45 57.39 2oo0 n PHE 326 Cb 0.16 -0.01 0.72 0.00 -0.94 0.00 0.00 39.48 39.41 2oo0 n PHE 326 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 176.76 173.76 2oo0 h ASN 327 N 1.80 0.00 -0.41 4.37 7.08 -0.93 -0.08 115.58 127.41 2oo0 h ASN 327 Ca 0.00 0.00 0.12 0.00 -3.08 0.00 0.00 56.30 53.34 2oo0 h ASN 327 Cb 0.44 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.66 2oo0 h ASN 327 CO 0.01 0.00 0.41 0.00 -2.08 0.00 0.00 177.43 175.77 2oo0 h ILE 329 N 0.00 1.24 0.00 0.00 2.04 -1.25 -0.14 117.51 119.41 2oo0 h ILE 329 Ca 0.19 -0.97 -0.17 0.00 1.00 0.00 0.00 64.86 64.91 2oo0 h ILE 329 Cb 1.02 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2oo0 h ILE 329 CO -0.00 0.35 -0.96 -0.07 0.00 0.00 0.00 178.15 177.47 2oo0 h LEU 330 N 0.83 0.00 0.00 1.44 4.07 -1.41 -3.29 115.31 116.95 2oo0 h LEU 330 Ca 0.17 -0.57 -0.20 0.00 0.08 0.00 0.00 57.88 57.36 2oo0 h LEU 330 Cb 0.41 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 2oo0 h LEU 330 CO 0.01 1.34 -1.11 1.88 -1.08 0.00 0.00 178.44 179.48 2oo0 h TYR 331 N -1.00 0.00 -0.13 1.13 0.05 -1.18 -3.36 116.97 112.48 2oo0 h TYR 331 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.52 2oo0 h TYR 331 Cb 1.18 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.92 2oo0 h TYR 331 CO 0.11 0.84 0.00 -3.47 -1.05 0.00 0.00 178.16 174.59 2oo0 n ASP 332 N -3.19 2.18 -3.31 3.88 4.64 -0.18 -4.98 116.55 115.58 2oo0 n ASP 332 Ca -0.05 -1.71 -0.24 0.00 -1.38 0.00 0.00 54.79 51.42 2oo0 n ASP 332 Cb 0.91 -0.09 0.01 0.00 -1.04 0.00 0.00 41.12 40.91 2oo0 n ASP 332 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 2oo0 n HIS 333 N 0.25 -1.88 -2.49 -0.67 8.25 -0.75 -4.91 115.22 113.03 2oo0 n HIS 333 Ca 0.06 0.52 -0.37 0.00 -0.26 0.00 0.00 57.72 57.67 2oo0 n HIS 333 Cb 0.29 -3.45 -0.04 0.00 1.12 0.00 0.00 29.99 27.91 2oo0 n HIS 333 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2oo0 s ALA 334 N -3.03 3.11 -0.39 -1.41 0.00 -0.50 -4.98 121.76 114.57 2oo0 s ALA 334 Ca 0.39 0.76 -0.02 0.00 0.00 0.00 0.00 51.96 53.10 2oo0 s ALA 334 Cb -0.20 -3.30 0.10 0.00 0.00 0.00 0.00 23.12 19.73 2oo0 s ALA 334 CO 0.49 -0.28 0.16 -1.01 0.00 0.00 0.00 175.76 175.12 2oo0 s HIS 335 N -1.58 3.59 0.24 0.00 3.76 -1.26 -4.57 115.29 115.46 2oo0 s HIS 335 Ca 0.57 -2.46 -0.13 0.00 -0.15 0.00 0.00 55.06 52.89 2oo0 s HIS 335 Cb -0.24 -3.06 -0.08 0.00 1.11 0.00 0.00 32.58 30.31 2oo0 s HIS 335 CO 0.30 -0.95 0.63 0.14 -0.85 0.00 0.00 174.74 174.01 2oo0 s VAL 336 N 1.11 4.79 -0.26 -0.90 -7.23 -1.26 -5.07 120.40 111.58 2oo0 s VAL 336 Ca 0.07 0.79 0.01 0.00 -1.81 0.00 0.00 61.98 61.04 2oo0 s VAL 336 Cb -0.22 -3.67 0.07 0.00 0.56 0.00 0.00 36.38 33.13 2oo0 s VAL 336 CO -0.05 -0.01 -0.00 -0.54 -0.31 0.00 0.00 175.10 174.19 2oo0 s LYS 337 N -2.59 1.38 0.21 4.82 1.02 -1.26 -5.04 119.74 118.28 2oo0 s LYS 337 Ca 0.47 -1.13 -0.30 0.00 0.02 0.00 0.00 55.97 55.03 2oo0 s LYS 337 Cb -0.12 -2.56 -0.09 0.00 -0.52 0.00 0.00 37.83 34.54 2oo0 s LYS 337 CO 0.20 -0.73 1.26 -1.25 -0.92 0.00 0.00 175.35 173.90 2oo0 s PRO 338 N 1.38 4.43 -0.04 -1.68 0.04 -1.26 -4.60 135.00 133.27 2oo0 s PRO 338 Ca 0.00 2.00 0.05 0.00 0.04 0.00 0.00 61.00 63.09 2oo0 s PRO 338 Cb -0.18 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 2oo0 s PRO 338 CO -0.10 -0.17 -0.21 -0.51 0.04 0.00 0.00 177.00 176.05 2oo0 s LEU 339 N -0.36 1.99 0.01 -3.56 1.02 0.26 -4.95 118.68 113.09 2oo0 s LEU 339 Ca 0.54 -0.42 -0.30 0.00 0.02 0.00 0.00 54.13 53.97 2oo0 s LEU 339 Cb -0.35 -1.15 -0.05 0.00 0.02 0.00 0.00 46.19 44.66 2oo0 s LEU 339 CO 0.39 0.21 1.21 -0.76 0.02 0.00 0.00 176.35 177.42 2oo0 s LEU 340 N -0.13 4.33 -0.00 1.79 1.02 -1.26 0.46 118.68 124.89 2oo0 s LEU 340 Ca -0.02 1.94 -0.20 0.00 0.02 0.00 0.00 54.13 55.87 2oo0 s LEU 340 Cb -0.12 -3.57 -0.23 0.00 0.02 0.00 0.00 46.19 42.29 2oo0 s LEU 340 CO 0.02 -0.53 1.10 -0.61 0.02 0.00 0.00 176.35 176.36 2oo0 h GLN 341 N 7.13 0.38 -5.83 1.70 -0.00 -1.91 -3.42 115.11 113.16 2oo0 h GLN 341 Ca -0.39 -0.39 -0.59 0.00 -0.00 0.00 0.00 58.65 57.29 2oo0 h GLN 341 Cb 1.19 0.11 -0.08 0.00 0.00 0.00 0.00 27.48 28.70 2oo0 h GLN 341 CO 0.84 1.06 0.33 0.21 0.00 0.00 0.00 178.83 181.27 2oo0 s LYS 342 N -3.25 4.25 0.24 1.69 2.20 -1.26 -5.03 119.74 118.57 2oo0 s LYS 342 Ca -0.14 0.88 -0.31 0.00 -0.36 0.00 0.00 55.97 56.04 2oo0 s LYS 342 Cb 0.03 -3.59 -0.13 0.00 -1.51 0.00 0.00 37.83 32.63 2oo0 s LYS 342 CO 0.81 -0.34 1.53 0.54 -0.36 0.00 0.00 175.35 177.53 2oo0 n ARG 343 N 5.34 2.34 -2.48 4.03 1.74 -1.26 -4.96 116.66 121.42 2oo0 n ARG 343 Ca 0.03 0.84 -0.34 0.00 -0.77 0.00 0.00 57.85 57.61 2oo0 n ARG 343 Cb 0.49 -2.57 -0.03 0.00 -1.02 0.00 0.00 32.46 29.33 2oo0 n ARG 343 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2oo0 s PRO 344 N -0.01 3.73 0.29 5.56 0.04 -1.26 -5.01 135.00 138.34 2oo0 s PRO 344 Ca 0.70 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 2oo0 s PRO 344 Cb -0.59 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 31.75 2oo0 s PRO 344 CO 0.45 -0.49 1.62 0.15 0.04 0.00 0.00 177.00 178.76 2oo0 s LYS 345 N -3.33 4.11 0.65 4.56 3.01 -1.26 -4.87 119.74 122.61 2oo0 s LYS 345 Ca 0.67 2.59 0.33 0.00 -1.01 0.00 0.00 55.97 58.56 2oo0 s LYS 345 Cb -0.17 -3.02 1.81 0.00 -1.01 0.00 0.00 37.83 35.44 2oo0 s LYS 345 CO 0.22 -0.66 2.06 -1.35 0.51 0.00 0.00 175.35 176.13 2oo0 h PRO 346 N 5.06 0.00 0.00 -1.68 0.11 -2.05 -2.90 132.00 130.54 2oo0 h PRO 346 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2oo0 h PRO 346 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2oo0 h PRO 346 CO 0.81 0.00 -0.47 -0.40 -0.21 0.00 0.00 178.00 177.73 2oo0 n ASP 347 N -3.17 0.82 -4.88 -2.05 5.68 -1.26 -5.06 116.55 106.63 2oo0 n ASP 347 Ca -0.01 -0.55 -0.30 0.00 -0.50 0.00 0.00 54.79 53.44 2oo0 n ASP 347 Cb 0.32 1.05 -0.02 0.00 -1.14 0.00 0.00 41.12 41.33 2oo0 n ASP 347 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 2oo0 s GLU 348 N -1.76 3.73 0.31 0.11 -1.05 -1.10 -5.00 118.70 113.95 2oo0 s GLU 348 Ca 0.02 0.43 -0.28 0.00 -0.15 0.00 0.00 54.97 54.99 2oo0 s GLU 348 Cb 0.05 -2.37 -0.10 0.00 -0.44 0.00 0.00 34.13 31.27 2oo0 s GLU 348 CO 0.27 -0.09 1.16 0.21 0.95 0.00 0.00 175.26 177.76 2oo0 s LYS 349 N -4.07 4.47 0.02 -4.83 2.20 -1.26 -4.99 119.74 111.29 2oo0 s LYS 349 Ca 0.51 1.91 -0.01 0.00 -0.36 0.00 0.00 55.97 58.02 2oo0 s LYS 349 Cb -0.10 -3.06 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 2oo0 s LYS 349 CO 0.35 0.02 0.16 0.71 -0.36 0.00 0.00 175.35 176.23 2oo0 s TYR 350 N -1.21 3.44 0.11 4.03 1.51 -1.26 -4.11 117.35 119.86 2oo0 s TYR 350 Ca 0.48 0.26 0.08 0.00 -1.01 0.00 0.00 57.07 56.88 2oo0 s TYR 350 Cb -0.33 -1.76 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 2oo0 s TYR 350 CO 0.43 0.60 -0.20 0.71 -1.11 0.00 0.00 175.55 175.97 2oo0 s TYR 351 N -1.36 1.79 0.13 2.71 2.02 0.14 -4.86 117.35 117.91 2oo0 s TYR 351 Ca 0.29 -0.43 -0.31 0.00 -0.37 0.00 0.00 57.07 56.25 2oo0 s TYR 351 Cb -0.13 -0.97 -0.10 0.00 -0.40 0.00 0.00 41.96 40.37 2oo0 s TYR 351 CO 0.21 0.22 1.64 0.45 -1.57 0.00 0.00 175.55 176.50 2oo0 s SER 352 N -2.03 6.55 0.02 2.29 0.15 -1.26 -1.61 113.70 117.81 2oo0 s SER 352 Ca 0.08 2.61 -0.02 0.00 0.70 0.00 0.00 55.95 59.32 2oo0 s SER 352 Cb -0.09 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.62 2oo0 s SER 352 CO 0.05 -0.88 0.03 -0.44 1.20 0.00 0.00 173.24 173.19 2oo0 s SER 353 N 1.74 0.17 0.13 5.45 0.01 0.12 -1.91 113.70 119.41 2oo0 s SER 353 Ca 0.73 -0.41 0.09 0.00 1.31 0.00 0.00 55.95 57.67 2oo0 s SER 353 Cb -0.43 0.14 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 2oo0 s SER 353 CO 0.32 -0.33 -0.22 -0.94 0.41 0.00 0.00 173.24 172.49 2oo0 s SER 354 N -1.46 2.78 -0.09 2.44 1.04 -0.41 -0.44 113.70 117.55 2oo0 s SER 354 Ca -0.15 -0.75 0.03 0.00 0.48 0.00 0.00 55.95 55.56 2oo0 s SER 354 Cb -0.09 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 65.87 2oo0 s SER 354 CO -0.00 0.07 -0.19 -0.63 0.98 0.00 0.00 173.24 173.46 2oo0 s ILE 355 N -1.36 1.71 0.09 -1.02 1.01 -0.06 -1.17 121.20 120.40 2oo0 s ILE 355 Ca 0.11 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 60.04 2oo0 s ILE 355 Cb -0.09 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 2oo0 s ILE 355 CO 0.05 0.48 -0.23 0.26 0.00 0.00 0.00 174.94 175.50 2oo0 s TRP 356 N 0.55 2.02 0.97 3.97 0.52 0.68 -0.05 118.94 127.61 2oo0 s TRP 356 Ca -0.15 -0.40 -0.15 0.00 0.02 0.00 0.00 56.10 55.42 2oo0 s TRP 356 Cb -0.17 -1.14 0.18 0.00 -1.15 0.00 0.00 33.47 31.19 2oo0 s TRP 356 CO 0.05 0.20 1.19 0.20 0.02 0.00 0.00 176.95 178.62 2oo0 s GLY 357 N -1.66 1.64 0.00 0.98 0.00 -0.61 -0.48 107.32 107.19 2oo0 s GLY 357 Ca 0.10 -0.83 0.29 0.00 0.00 0.00 0.00 44.72 44.28 2oo0 s GLY 357 CO 0.04 -0.15 1.97 -1.55 0.00 0.00 0.00 173.10 173.40 2oo0 n PRO 358 N -3.92 0.24 -2.01 2.90 -0.04 -0.97 -4.58 135.00 126.63 2oo0 n PRO 358 Ca 0.11 -0.01 -0.28 0.00 -0.04 0.00 0.00 63.50 63.27 2oo0 n PRO 358 Cb 0.60 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.67 2oo0 n PRO 358 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2oo0 s THR 359 N -2.77 2.07 0.53 0.52 -4.23 -1.26 -4.97 115.64 105.53 2oo0 s THR 359 Ca 0.21 -0.09 0.41 0.00 -1.18 0.00 0.00 61.69 61.05 2oo0 s THR 359 Cb 0.20 -2.98 0.43 0.00 1.34 0.00 0.00 72.50 71.48 2oo0 s THR 359 CO 0.50 0.00 2.28 0.00 -0.54 0.00 0.00 174.62 176.86 2oo0 s ASP 361 N -5.36 6.95 0.62 0.00 -1.08 -1.26 -4.94 116.67 111.59 2oo0 s ASP 361 Ca -0.04 1.14 0.38 0.00 -0.52 0.00 0.00 52.55 53.52 2oo0 s ASP 361 Cb 0.12 -2.40 2.02 0.00 -1.46 0.00 0.00 42.92 41.20 2oo0 s ASP 361 CO 0.45 -0.11 2.24 1.23 0.52 0.00 0.00 175.17 179.51 2oo0 h GLY 362 N 6.78 0.00 2.00 2.66 0.00 -2.01 -0.88 103.07 111.61 2oo0 h GLY 362 Ca -0.41 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2oo0 h GLY 362 CO 0.75 0.00 -0.08 -2.00 0.00 0.00 0.00 176.54 175.21 2oo0 h LEU 363 N 0.00 0.00 -6.74 3.11 5.85 -1.98 -3.38 115.31 112.17 2oo0 h LEU 363 Ca -0.00 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 58.04 2oo0 h LEU 363 Cb 0.15 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2oo0 h LEU 363 CO 0.00 0.08 2.65 -0.67 -0.34 0.00 0.00 178.44 180.17 2oo0 n ASP 364 N -3.18 4.04 -4.05 1.25 2.03 -0.34 -4.86 116.55 111.43 2oo0 n ASP 364 Ca 0.01 -2.84 -0.26 0.00 0.52 0.00 0.00 54.79 52.22 2oo0 n ASP 364 Cb 0.40 -1.64 -0.17 0.00 -0.72 0.00 0.00 41.12 38.99 2oo0 n ASP 364 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2oo0 s ARG 365 N 3.87 1.86 -0.20 -0.67 3.52 -1.26 -1.57 118.95 124.50 2oo0 s ARG 365 Ca 0.51 -0.48 -0.04 0.00 -0.13 0.00 0.00 55.73 55.60 2oo0 s ARG 365 Cb 0.10 -1.52 -0.21 0.00 -1.56 0.00 0.00 34.95 31.77 2oo0 s ARG 365 CO -0.00 0.06 0.03 -0.89 -0.81 0.00 0.00 175.30 173.69 2oo0 n ILE 366 N 3.73 1.62 -3.75 4.11 5.41 0.93 -4.87 119.36 126.53 2oo0 n ILE 366 Ca -0.22 -0.57 -0.23 0.00 1.00 0.00 0.00 62.75 62.73 2oo0 n ILE 366 Cb 0.52 -1.61 -0.18 0.00 -0.71 0.00 0.00 39.64 37.67 2oo0 n ILE 366 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2oo0 s VAL 367 N -2.53 0.29 0.11 1.39 1.01 -0.74 -4.88 120.40 115.06 2oo0 s VAL 367 Ca -0.30 0.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 2oo0 s VAL 367 Cb 0.08 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.92 2oo0 s VAL 367 CO 0.66 0.22 1.48 -0.08 0.00 0.00 0.00 175.10 177.38 2oo0 h GLU 368 N 8.34 0.75 -2.18 2.72 4.81 -1.88 -0.13 114.58 127.02 2oo0 h GLU 368 Ca -0.18 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2oo0 h GLU 368 Cb 1.12 -0.01 -0.23 0.00 0.63 0.00 0.00 28.75 30.26 2oo0 h GLU 368 CO 0.25 0.96 -0.13 0.50 -0.73 0.00 0.00 179.01 179.85 2oo0 s ARG 369 N -4.57 0.57 0.24 1.92 3.52 -1.25 -4.44 118.95 114.93 2oo0 s ARG 369 Ca -0.12 1.20 -0.08 0.00 -0.13 0.00 0.00 55.73 56.59 2oo0 s ARG 369 Cb 0.10 0.36 -0.02 0.00 -1.56 0.00 0.00 34.95 33.82 2oo0 s ARG 369 CO 0.83 -0.18 0.36 0.00 -0.81 0.00 0.00 175.30 175.49 2oo0 s ASP 371 N -3.08 5.01 0.05 0.00 1.01 -1.26 0.15 116.67 118.55 2oo0 s ASP 371 Ca 0.29 -0.14 0.00 0.00 0.71 0.00 0.00 52.55 53.41 2oo0 s ASP 371 Cb 0.02 -1.86 -0.03 0.00 1.01 0.00 0.00 42.92 42.06 2oo0 s ASP 371 CO 0.11 0.09 -0.04 -0.76 0.21 0.00 0.00 175.17 174.77 2oo0 s LEU 372 N 0.87 2.39 0.96 1.23 1.43 -0.63 -4.88 118.68 120.05 2oo0 s LEU 372 Ca 0.01 -0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 52.20 2oo0 s LEU 372 Cb -0.14 0.07 0.17 0.00 0.03 0.00 0.00 46.19 46.32 2oo0 s LEU 372 CO 0.02 -0.44 1.09 -2.16 0.23 0.00 0.00 176.35 175.09 2oo0 s PRO 373 N -2.90 0.74 0.04 1.29 0.04 -1.26 0.23 135.00 133.18 2oo0 s PRO 373 Ca -0.01 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 61.73 2oo0 s PRO 373 Cb 0.00 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.73 2oo0 s PRO 373 CO -0.05 -2.65 1.67 -2.00 0.04 0.00 0.00 177.00 174.01 2oo0 s GLU 374 N -4.76 4.19 0.38 4.56 2.12 -1.26 -4.78 118.70 119.16 2oo0 s GLU 374 Ca 0.65 2.31 0.08 0.00 0.36 0.00 0.00 54.97 58.37 2oo0 s GLU 374 Cb -0.21 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 2oo0 s GLU 374 CO 0.59 -0.76 0.23 -1.64 -0.54 0.00 0.00 175.26 173.14 2oo0 s MET 375 N 3.01 2.40 0.08 4.30 -1.94 -1.26 -5.15 119.30 120.73 2oo0 s MET 375 Ca 0.74 -1.62 0.03 0.00 -1.71 0.00 0.00 55.69 53.14 2oo0 s MET 375 Cb -0.39 -2.20 -0.03 0.00 2.01 0.00 0.00 34.83 34.23 2oo0 s MET 375 CO 0.32 -0.05 -0.09 -1.01 -0.01 0.00 0.00 175.02 174.19 2oo0 s HIS 376 N -2.48 0.90 0.13 -0.03 0.09 -1.26 -5.08 115.29 107.55 2oo0 s HIS 376 Ca 0.42 -0.64 -0.35 0.00 -0.00 0.00 0.00 55.06 54.49 2oo0 s HIS 376 Cb -0.01 -0.51 -0.16 0.00 -0.00 0.00 0.00 32.58 31.91 2oo0 s HIS 376 CO 0.24 -0.06 1.39 0.28 -0.00 0.00 0.00 174.74 176.60 2oo0 n VAL 377 N 0.81 0.18 0.00 -0.90 0.31 -1.26 -1.30 118.33 116.16 2oo0 n VAL 377 Ca -0.18 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 2oo0 n VAL 377 Cb 0.57 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 2oo0 n VAL 377 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2oo0 n GLY 378 N 2.70 2.64 3.77 2.92 0.00 0.30 -5.01 105.19 112.51 2oo0 n GLY 378 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2oo0 n GLY 378 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oo0 s ASP 379 N -1.25 5.74 -0.04 1.61 1.01 -0.42 -4.75 116.67 118.56 2oo0 s ASP 379 Ca 0.00 2.29 -0.03 0.00 0.71 0.00 0.00 52.55 55.52 2oo0 s ASP 379 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2oo0 s ASP 379 CO 0.00 -1.21 0.15 0.26 0.21 0.00 0.00 175.17 174.57 2oo0 s TRP 380 N -1.64 3.50 0.04 4.23 0.52 -1.26 -0.31 118.94 124.02 2oo0 s TRP 380 Ca 0.71 0.37 0.08 0.00 0.02 0.00 0.00 56.10 57.28 2oo0 s TRP 380 Cb -0.28 -1.84 -0.03 0.00 -1.15 0.00 0.00 33.47 30.17 2oo0 s TRP 380 CO 0.32 0.65 -0.22 -1.64 0.02 0.00 0.00 176.95 176.08 2oo0 s MET 381 N -1.61 1.97 0.01 4.98 -1.94 0.04 -3.28 119.30 119.47 2oo0 s MET 381 Ca 0.23 -1.03 0.04 0.00 -1.71 0.00 0.00 55.69 53.22 2oo0 s MET 381 Cb -0.12 -2.10 -0.03 0.00 2.01 0.00 0.00 34.83 34.58 2oo0 s MET 381 CO 0.13 0.53 -0.09 -0.51 -0.01 0.00 0.00 175.02 175.08 2oo0 s LEU 382 N -1.32 3.08 -0.25 -0.03 1.43 0.17 -1.03 118.68 120.74 2oo0 s LEU 382 Ca 0.13 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.03 2oo0 s LEU 382 Cb -0.10 -1.78 0.07 0.00 0.03 0.00 0.00 46.19 44.41 2oo0 s LEU 382 CO 0.04 0.27 0.03 -0.36 0.23 0.00 0.00 176.35 176.56 2oo0 s PHE 383 N -1.00 1.76 0.70 0.29 0.40 0.38 -0.57 117.98 119.94 2oo0 s PHE 383 Ca 0.17 -1.48 -0.10 0.00 -0.60 0.00 0.00 56.93 54.93 2oo0 s PHE 383 Cb -0.11 -1.47 0.04 0.00 0.51 0.00 0.00 43.02 41.98 2oo0 s PHE 383 CO 0.07 -0.75 1.06 -1.21 0.70 0.00 0.00 175.22 175.09 2oo0 s GLU 384 N 1.61 2.56 -1.37 0.44 2.02 -1.26 -0.75 118.70 121.94 2oo0 s GLU 384 Ca 0.01 0.16 -0.08 0.00 0.02 0.00 0.00 54.97 55.08 2oo0 s GLU 384 Cb -0.18 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 31.99 2oo0 s GLU 384 CO -0.12 -1.13 1.11 0.09 0.02 0.00 0.00 175.26 175.23 2oo0 n ASN 385 N -2.97 -5.36 -1.50 -0.19 5.03 -1.14 -4.91 115.26 104.22 2oo0 n ASN 385 Ca 0.07 -0.60 -0.09 0.00 0.87 0.00 0.00 54.58 54.82 2oo0 n ASN 385 Cb 0.59 -4.82 0.20 0.00 -1.02 0.00 0.00 39.78 34.73 2oo0 n ASN 385 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 2oo0 n MET 386 N -4.82 2.14 0.07 3.52 2.81 -0.60 -4.63 117.12 115.62 2oo0 n MET 386 Ca -0.04 -3.11 0.06 0.00 -1.81 0.00 0.00 57.70 52.80 2oo0 n MET 386 Cb 0.57 -1.95 -0.04 0.00 -0.71 0.00 0.00 33.22 31.10 2oo0 n MET 386 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2oo0 h GLY 387 N 1.16 0.00 -6.63 3.03 0.00 -1.44 -3.44 103.07 95.75 2oo0 h GLY 387 Ca 0.33 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 47.03 2oo0 h GLY 387 CO 0.60 0.00 -0.59 0.00 0.00 0.00 0.00 176.54 176.55 2oo0 s ALA 388 N -3.16 3.29 -1.41 3.60 0.00 -1.26 -4.55 121.76 118.28 2oo0 s ALA 388 Ca -0.02 -0.91 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 2oo0 s ALA 388 Cb 0.09 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.27 2oo0 s ALA 388 CO 0.80 -0.09 1.02 0.66 0.00 0.00 0.00 175.76 178.15 2oo0 n TYR 389 N 4.11 -2.46 0.00 0.00 4.01 -0.63 -4.90 117.16 117.29 2oo0 n TYR 389 Ca -0.16 0.94 0.00 0.00 -0.16 0.00 0.00 57.90 58.52 2oo0 n TYR 389 Cb 0.52 -4.54 0.00 0.00 -0.31 0.00 0.00 39.34 35.01 2oo0 n TYR 389 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2oo0 n THR 390 N -4.70 0.00 0.11 -0.72 -2.24 -1.26 -4.00 114.28 101.47 2oo0 n THR 390 Ca -0.05 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.88 2oo0 n THR 390 Cb 0.57 -0.03 0.66 0.00 -2.10 0.00 0.00 70.33 69.44 2oo0 n THR 390 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2oo0 h VAL 391 N 0.00 0.86 0.00 2.28 -1.51 -1.84 -1.44 116.25 114.60 2oo0 h VAL 391 Ca 0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2oo0 h VAL 391 Cb 0.00 0.85 -0.00 0.00 -2.13 0.00 0.00 31.29 30.01 2oo0 h VAL 391 CO 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 177.57 176.34 2oo0 h ALA 392 N 1.85 1.40 0.00 5.19 0.00 -1.89 -2.97 119.26 122.84 2oo0 h ALA 392 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2oo0 h ALA 392 Cb 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2oo0 h ALA 392 CO -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 179.25 179.22 2oo0 n ALA 393 N -2.27 2.05 -1.79 0.00 0.00 -0.55 -5.01 120.51 112.94 2oo0 n ALA 393 Ca -0.03 -1.69 -0.36 0.00 0.00 0.00 0.00 53.44 51.36 2oo0 n ALA 393 Cb 0.09 -0.20 -0.05 0.00 0.00 0.00 0.00 19.45 19.28 2oo0 n ALA 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oo0 s ALA 394 N -1.70 3.11 0.45 0.00 0.00 -1.12 -4.94 121.76 117.56 2oo0 s ALA 394 Ca 0.14 0.58 0.05 0.00 0.00 0.00 0.00 51.96 52.74 2oo0 s ALA 394 Cb 0.12 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2oo0 s ALA 394 CO 0.01 -0.03 0.12 -1.54 0.00 0.00 0.00 175.76 174.32 2oo0 s SER 395 N -1.72 4.23 -0.39 0.00 1.04 0.45 -4.99 113.70 112.31 2oo0 s SER 395 Ca 0.57 -1.32 0.06 0.00 0.48 0.00 0.00 55.95 55.73 2oo0 s SER 395 Cb -0.18 -0.10 0.56 0.00 0.10 0.00 0.00 66.02 66.40 2oo0 s SER 395 CO 0.23 -0.67 1.68 0.35 0.98 0.00 0.00 173.24 175.81 2oo0 n THR 396 N -1.24 2.92 -1.54 2.02 -2.24 -1.26 -4.37 114.28 108.57 2oo0 n THR 396 Ca -0.07 -2.58 -0.48 0.00 -2.27 0.00 0.00 64.05 58.65 2oo0 n THR 396 Cb 0.66 -0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 68.33 2oo0 n THR 396 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2oo0 n PHE 397 N -1.09 0.91 -0.83 4.78 7.35 -1.26 -0.32 117.46 127.01 2oo0 n PHE 397 Ca 0.47 0.76 0.00 0.00 -0.76 0.00 0.00 57.45 57.93 2oo0 n PHE 397 Cb 1.22 -2.20 0.00 0.00 0.35 0.00 0.00 39.48 38.85 2oo0 n PHE 397 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2oo0 n ASN 398 N 1.72 -0.71 0.00 -2.13 5.03 -1.26 -3.29 115.26 114.62 2oo0 n ASN 398 Ca 0.14 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.59 2oo0 n ASN 398 Cb 0.26 -1.13 0.00 0.00 -1.02 0.00 0.00 39.78 37.89 2oo0 n ASN 398 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oo0 n GLY 399 N -1.89 0.79 3.66 7.41 0.00 0.57 -5.03 105.19 110.69 2oo0 n GLY 399 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2oo0 n GLY 399 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oo0 s PHE 400 N -2.99 2.59 0.56 1.61 0.40 -1.21 -5.00 117.98 113.95 2oo0 s PHE 400 Ca 0.00 0.75 -0.15 0.00 -0.60 0.00 0.00 56.93 56.93 2oo0 s PHE 400 Cb 0.00 -3.64 -0.06 0.00 0.51 0.00 0.00 43.02 39.83 2oo0 s PHE 400 CO 0.00 -2.42 1.01 -0.65 0.70 0.00 0.00 175.22 173.86 2oo0 s GLN 401 N 3.50 3.72 0.28 0.44 -1.52 -1.26 -4.36 119.66 120.47 2oo0 s GLN 401 Ca 0.61 0.93 -0.29 0.00 -1.95 0.00 0.00 55.36 54.66 2oo0 s GLN 401 Cb -0.26 -2.10 -0.10 0.00 -0.22 0.00 0.00 33.01 30.33 2oo0 s GLN 401 CO 0.21 -0.46 1.30 1.03 -0.25 0.00 0.00 175.29 177.11 2oo0 s ARG 402 N -4.42 4.39 0.35 2.91 1.81 -1.26 -4.96 118.95 117.77 2oo0 s ARG 402 Ca 0.58 2.13 -0.28 0.00 -1.72 0.00 0.00 55.73 56.45 2oo0 s ARG 402 Cb -0.11 -3.12 -0.12 0.00 -0.45 0.00 0.00 34.95 31.15 2oo0 s ARG 402 CO 0.39 -0.18 1.36 -2.30 -0.68 0.00 0.00 175.30 173.89 2oo0 n PRO 403 N 1.51 2.32 -1.96 3.54 -0.02 -1.26 -4.95 135.00 134.17 2oo0 n PRO 403 Ca 0.02 0.81 -0.40 0.00 -2.02 0.00 0.00 63.50 61.92 2oo0 n PRO 403 Cb 0.42 -2.45 -0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2oo0 n PRO 403 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2oo0 s THR 404 N -1.06 2.40 -0.25 3.45 2.01 -1.25 -4.74 115.64 116.20 2oo0 s THR 404 Ca 0.55 0.38 -0.09 0.00 0.31 0.00 0.00 61.69 62.84 2oo0 s THR 404 Cb -0.54 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 2oo0 s THR 404 CO 0.62 0.07 0.12 -0.63 -0.69 0.00 0.00 174.62 174.11 2oo0 s ILE 405 N -1.20 4.88 -0.31 1.82 1.01 -1.26 -0.98 121.20 125.15 2oo0 s ILE 405 Ca 0.56 0.02 -0.09 0.00 0.00 0.00 0.00 60.65 61.14 2oo0 s ILE 405 Cb -0.41 -3.29 -0.00 0.00 0.01 0.00 0.00 42.46 38.77 2oo0 s ILE 405 CO 0.54 0.33 0.14 -0.31 0.00 0.00 0.00 174.94 175.63 2oo0 s TYR 406 N 1.41 3.17 0.20 3.97 2.02 -0.25 -4.72 117.35 123.16 2oo0 s TYR 406 Ca 0.06 -0.68 -0.17 0.00 -0.37 0.00 0.00 57.07 55.92 2oo0 s TYR 406 Cb -0.15 -2.33 -0.08 0.00 -0.40 0.00 0.00 41.96 39.00 2oo0 s TYR 406 CO 0.06 -0.49 0.65 0.71 -1.57 0.00 0.00 175.55 174.91 2oo0 s TYR 407 N 1.58 3.59 0.11 2.71 1.51 -0.72 -1.17 117.35 124.97 2oo0 s TYR 407 Ca 0.04 1.22 0.05 0.00 -1.01 0.00 0.00 57.07 57.37 2oo0 s TYR 407 Cb -0.17 -2.50 -0.04 0.00 -0.11 0.00 0.00 41.96 39.15 2oo0 s TYR 407 CO 0.05 0.34 -0.14 0.14 -1.11 0.00 0.00 175.55 174.84 2oo0 s VAL 408 N -1.56 1.24 -0.26 0.71 -7.23 -0.33 -0.27 120.40 112.70 2oo0 s VAL 408 Ca 0.42 -1.64 -0.19 0.00 -1.81 0.00 0.00 61.98 58.77 2oo0 s VAL 408 Cb -0.15 -1.43 0.07 0.00 0.56 0.00 0.00 36.38 35.43 2oo0 s VAL 408 CO 0.20 -0.40 0.66 -0.32 -0.31 0.00 0.00 175.10 174.93 2oo0 s MET 409 N -2.53 0.72 0.74 4.82 0.00 -0.65 -1.00 119.30 121.41 2oo0 s MET 409 Ca 0.07 1.05 -0.10 0.00 0.00 0.00 0.00 55.69 56.71 2oo0 s MET 409 Cb -0.05 0.25 0.06 0.00 0.00 0.00 0.00 34.83 35.08 2oo0 s MET 409 CO 0.02 -0.12 1.09 -1.54 0.00 0.00 0.00 175.02 174.47 2oo0 s SER 410 N 0.98 4.84 0.08 1.11 1.04 -1.26 -0.54 113.70 119.94 2oo0 s SER 410 Ca -0.05 0.73 -0.29 0.00 0.48 0.00 0.00 55.95 56.82 2oo0 s SER 410 Cb -0.05 -1.36 -0.17 0.00 0.10 0.00 0.00 66.02 64.54 2oo0 s SER 410 CO -0.09 -1.65 1.67 1.23 0.98 0.00 0.00 173.24 175.38 2oo0 h GLY 411 N -0.78 -0.56 0.86 7.32 0.00 -1.95 -1.81 103.07 106.15 2oo0 h GLY 411 Ca -0.45 0.22 0.08 0.00 0.00 0.00 0.00 47.33 47.18 2oo0 h GLY 411 CO 0.63 -0.21 0.53 -2.55 0.00 0.00 0.00 176.54 174.95 2oo0 h PRO 412 N -0.54 0.80 -0.18 4.80 0.11 -1.95 -0.38 132.00 134.65 2oo0 h PRO 412 Ca -0.05 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 2oo0 h PRO 412 Cb 0.42 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 2oo0 h PRO 412 CO 0.08 0.53 0.07 0.00 -0.21 0.00 0.00 178.00 178.47 2oo0 h ALA 413 N 1.58 0.24 -0.62 -0.75 0.00 -1.93 -0.89 119.26 116.88 2oo0 h ALA 413 Ca 0.37 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.24 2oo0 h ALA 413 Cb 0.35 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2oo0 h ALA 413 CO -0.14 -0.17 0.29 2.35 0.00 0.00 0.00 179.25 181.59 2oo0 h TRP 414 N 0.14 0.53 -0.52 0.00 2.91 -0.82 -1.44 115.95 116.76 2oo0 h TRP 414 Ca 0.06 0.03 -0.04 0.00 1.13 0.00 0.00 58.89 60.06 2oo0 h TRP 414 Cb 0.18 -0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.66 2oo0 h TRP 414 CO -0.01 0.21 0.15 1.96 -1.03 0.00 0.00 178.44 179.72 2oo0 h GLN 415 N 0.53 0.81 -0.90 2.65 4.20 -0.94 -2.09 115.11 119.38 2oo0 h GLN 415 Ca 0.29 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2oo0 h GLN 415 Cb 0.27 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2oo0 h GLN 415 CO -0.23 0.76 0.57 1.25 -0.67 0.00 0.00 178.83 180.50 2oo0 h LEU 416 N 0.71 1.06 -0.62 1.46 5.85 -0.86 -0.96 115.31 121.94 2oo0 h LEU 416 Ca 0.17 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2oo0 h LEU 416 Cb 0.29 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2oo0 h LEU 416 CO -0.00 0.79 0.32 -0.03 -0.34 0.00 0.00 178.44 179.18 2oo0 h MET 417 N 1.23 0.88 -0.78 1.25 4.05 -0.95 -1.92 114.93 118.69 2oo0 h MET 417 Ca 0.33 -0.12 -0.03 0.00 -0.28 0.00 0.00 59.70 59.60 2oo0 h MET 417 Cb -0.10 -0.17 -0.04 0.00 -0.80 0.00 0.00 31.60 30.50 2oo0 h MET 417 CO -0.07 0.69 0.37 1.96 0.23 0.00 0.00 176.91 180.09 2oo0 h GLN 418 N 0.85 1.11 -0.28 0.39 1.08 -1.02 -1.70 115.11 115.55 2oo0 h GLN 418 Ca 0.22 -0.16 0.04 0.00 -1.45 0.00 0.00 58.65 57.30 2oo0 h GLN 418 Cb 0.08 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.27 2oo0 h GLN 418 CO -0.03 0.86 0.02 1.96 -0.95 0.00 0.00 178.83 180.69 2oo0 h GLN 419 N 1.10 0.11 -0.62 1.46 4.20 -0.75 -2.58 115.11 118.03 2oo0 h GLN 419 Ca 0.27 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.94 2oo0 h GLN 419 Cb 0.12 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 2oo0 h GLN 419 CO -0.03 0.07 0.28 0.74 -0.67 0.00 0.00 178.83 179.21 2oo0 h PHE 420 N 0.11 0.89 0.00 2.96 0.05 -1.06 -3.26 116.94 116.64 2oo0 h PHE 420 Ca 0.13 -0.04 -0.37 0.00 3.82 0.00 0.00 57.97 61.51 2oo0 h PHE 420 Cb 0.16 -0.28 -0.02 0.00 2.00 0.00 0.00 35.95 37.81 2oo0 h PHE 420 CO -0.19 0.67 1.56 0.94 -0.18 0.00 0.00 178.31 181.11 2oo0 n GLN 421 N -4.33 2.51 0.00 1.51 7.27 -0.67 -4.78 117.38 118.89 2oo0 n GLN 421 Ca 0.06 -1.43 0.00 0.00 0.07 0.00 0.00 57.00 55.69 2oo0 n GLN 421 Cb 0.15 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.48 2oo0 n GLN 421 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40