#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3myb s PRO 4 N 0.00 3.49 0.48 5.31 0.02 -1.26 -4.90 135.00 138.14 3myb s PRO 4 Ca 0.00 2.19 0.26 0.00 0.02 0.00 0.00 61.00 63.47 3myb s PRO 4 Cb 0.00 -2.45 1.21 0.00 0.02 0.00 0.00 34.50 33.28 3myb s PRO 4 CO 0.00 -0.90 1.96 -0.07 -0.33 0.00 0.00 177.00 177.66 3myb h LEU 5 N 1.93 0.00 -7.36 -5.54 3.38 -1.95 -3.41 115.31 102.36 3myb h LEU 5 Ca -0.50 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.03 3myb h LEU 5 Cb 1.28 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.64 3myb h LEU 5 CO 0.59 0.17 -0.76 -0.22 0.09 0.00 0.00 178.44 178.32 3myb s LEU 6 N -7.00 0.57 0.34 1.67 2.96 -1.26 -0.48 118.68 115.48 3myb s LEU 6 Ca -0.01 -0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 53.54 3myb s LEU 6 Cb 0.12 -0.38 -0.07 0.00 0.50 0.00 0.00 46.19 46.35 3myb s LEU 6 CO 0.61 -0.24 0.72 -0.76 -1.32 0.00 0.00 176.35 175.35 3myb s LEU 7 N 2.01 3.97 -0.06 -0.68 1.43 -0.17 -4.91 118.68 120.28 3myb s LEU 7 Ca 0.04 1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 54.25 3myb s LEU 7 Cb -0.13 -3.97 0.04 0.00 0.03 0.00 0.00 46.19 42.15 3myb s LEU 7 CO -0.06 -0.27 0.09 -1.58 0.23 0.00 0.00 176.35 174.76 3myb s GLN 8 N -3.37 -0.04 0.04 1.70 0.74 -1.26 -1.08 119.66 116.39 3myb s GLN 8 Ca 0.51 0.40 0.06 0.00 0.05 0.00 0.00 55.36 56.38 3myb s GLN 8 Cb -0.10 -0.52 -0.02 0.00 1.10 0.00 0.00 33.01 33.46 3myb s GLN 8 CO 0.25 -0.34 -0.16 -0.51 -0.55 0.00 0.00 175.29 173.97 3myb s ASP 9 N 2.20 1.91 -0.02 6.67 1.01 -0.60 -5.00 116.67 122.84 3myb s ASP 9 Ca 0.04 -0.48 0.02 0.00 0.71 0.00 0.00 52.55 52.84 3myb s ASP 9 Cb -0.12 -0.13 0.01 0.00 1.01 0.00 0.00 42.92 43.68 3myb s ASP 9 CO -0.04 0.07 -0.06 -0.60 0.21 0.00 0.00 175.17 174.75 3myb s ARG 10 N -1.18 0.68 0.05 8.23 3.52 -1.26 -0.49 118.95 128.50 3myb s ARG 10 Ca 0.03 -0.18 -0.00 0.00 -0.13 0.00 0.00 55.73 55.45 3myb s ARG 10 Cb -0.08 -0.67 0.01 0.00 -1.56 0.00 0.00 34.95 32.64 3myb s ARG 10 CO 0.01 0.05 0.07 -0.40 -0.81 0.00 0.00 175.30 174.22 3myb n ASP 11 N 3.41 0.08 -0.15 -2.12 5.68 -0.84 -4.99 116.55 117.62 3myb n ASP 11 Ca -0.19 -1.07 0.13 0.00 -0.50 0.00 0.00 54.79 53.16 3myb n ASP 11 Cb 0.54 -0.04 0.68 0.00 -1.14 0.00 0.00 41.12 41.16 3myb n ASP 11 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3myb n GLU 12 N -1.12 1.20 0.00 0.11 -0.00 -1.26 -3.60 120.64 115.97 3myb n GLU 12 Ca 0.01 -0.30 0.09 0.00 -0.00 0.00 0.00 57.16 56.96 3myb n GLU 12 Cb 0.04 -1.42 0.05 0.00 -0.00 0.00 0.00 31.44 30.11 3myb n GLU 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3myb n ARG 13 N -0.57 1.58 -0.71 3.44 1.74 -1.26 -4.96 116.66 115.92 3myb n ARG 13 Ca 0.19 -1.36 0.00 0.00 -0.77 0.00 0.00 57.85 55.91 3myb n ARG 13 Cb 0.16 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 3myb n ARG 13 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3myb n GLY 14 N 1.10 0.59 3.61 -0.13 0.00 -1.24 -4.62 105.19 104.51 3myb n GLY 14 Ca 0.10 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 3myb n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3myb s VAL 15 N -2.00 5.22 -0.19 1.61 1.01 -1.26 -0.43 120.40 124.35 3myb s VAL 15 Ca 0.00 0.47 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 3myb s VAL 15 Cb 0.00 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 3myb s VAL 15 CO 0.00 0.20 0.04 -0.69 0.00 0.00 0.00 175.10 174.65 3myb s VAL 16 N 1.88 4.52 -0.27 2.92 1.01 -0.29 -1.98 120.40 128.17 3myb s VAL 16 Ca 0.13 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 3myb s VAL 16 Cb -0.16 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 3myb s VAL 16 CO 0.10 0.44 0.11 -0.89 0.00 0.00 0.00 175.10 174.86 3myb s THR 17 N 0.62 4.51 -0.25 3.92 2.01 0.36 -0.73 115.64 126.08 3myb s THR 17 Ca 0.02 -0.23 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 3myb s THR 17 Cb -0.13 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 3myb s THR 17 CO 0.02 0.23 0.12 -0.76 -0.69 0.00 0.00 174.62 173.54 3myb s LEU 18 N 1.63 3.75 -0.28 4.42 1.43 -0.11 -1.55 118.68 127.97 3myb s LEU 18 Ca 0.06 -0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.07 3myb s LEU 18 Cb -0.16 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.09 3myb s LEU 18 CO 0.05 -0.01 -0.02 -0.89 0.23 0.00 0.00 176.35 175.71 3myb s THR 19 N 1.47 2.93 0.10 5.49 2.01 -0.24 -0.52 115.64 126.88 3myb s THR 19 Ca 0.06 -1.26 -0.34 0.00 0.31 0.00 0.00 61.69 60.46 3myb s THR 19 Cb -0.15 -2.62 -0.13 0.00 0.01 0.00 0.00 72.50 69.61 3myb s THR 19 CO 0.06 0.00 1.66 0.18 -0.69 0.00 0.00 174.62 175.84 3myb n LEU 20 N 4.63 3.24 -2.64 4.42 4.77 -0.26 -1.00 117.00 130.16 3myb n LEU 20 Ca -0.14 1.05 -0.17 0.00 -0.03 0.00 0.00 56.01 56.72 3myb n LEU 20 Cb 0.45 -1.42 0.01 0.00 -2.33 0.00 0.00 43.42 40.13 3myb n LEU 20 CO 0.26 -0.20 -0.01 -3.20 -1.33 0.00 0.00 177.39 172.91 3myb n ASN 21 N 4.28 2.65 -3.35 -1.43 5.15 0.37 -0.84 115.26 122.08 3myb n ASN 21 Ca 0.18 -3.12 -0.27 0.00 -0.60 0.00 0.00 54.58 50.78 3myb n ASN 21 Cb 0.29 -0.51 -0.07 0.00 -0.53 0.00 0.00 39.78 38.96 3myb n ASN 21 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3myb n ARG 22 N -0.19 2.45 -0.31 1.20 1.74 -1.26 -4.51 116.66 115.77 3myb n ARG 22 Ca 0.21 -4.57 0.01 0.00 -0.77 0.00 0.00 57.85 52.74 3myb n ARG 22 Cb 0.74 -2.17 0.20 0.00 -1.02 0.00 0.00 32.46 30.21 3myb n ARG 22 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3myb h PRO 23 N 4.02 1.11 0.00 5.56 0.13 -1.87 0.16 132.00 141.10 3myb h PRO 23 Ca 0.18 -0.07 -0.10 0.00 -0.87 0.00 0.00 66.00 65.15 3myb h PRO 23 Cb 0.66 -0.25 -0.01 0.00 0.13 0.00 0.00 31.00 31.53 3myb h PRO 23 CO 0.80 0.73 -0.47 1.96 -0.23 0.00 0.00 178.00 180.80 3myb h GLN 24 N 1.14 0.00 -0.27 0.86 4.20 -1.94 -2.49 115.11 116.60 3myb h GLN 24 Ca 0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 3myb h GLN 24 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 3myb h GLN 24 CO -0.11 0.47 0.00 0.00 -0.67 0.00 0.00 178.83 178.52 3myb n ALA 25 N -2.37 2.46 -3.30 3.87 0.00 -0.68 -4.92 120.51 115.58 3myb n ALA 25 Ca -0.01 -0.50 -0.24 0.00 0.00 0.00 0.00 53.44 52.69 3myb n ALA 25 Cb 0.53 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 19.03 3myb n ALA 25 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3myb n PHE 26 N 0.32 -2.15 -2.51 0.00 3.72 -0.83 -2.52 117.46 113.50 3myb n PHE 26 Ca 0.10 0.65 -0.18 0.00 -0.05 0.00 0.00 57.45 57.97 3myb n PHE 26 Cb 0.25 -4.25 -0.00 0.00 -0.94 0.00 0.00 39.48 34.53 3myb n PHE 26 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3myb n ASN 27 N -2.61 -5.05 -4.68 4.37 3.02 0.46 -1.45 115.26 109.32 3myb n ASN 27 Ca -0.05 0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 3myb n ASN 27 Cb 0.58 -4.22 0.00 0.00 -0.61 0.00 0.00 39.78 35.54 3myb n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3myb n ALA 28 N -2.29 1.01 -1.75 5.41 0.00 -1.05 -4.54 120.51 117.31 3myb n ALA 28 Ca -0.19 0.31 -0.41 0.00 0.00 0.00 0.00 53.44 53.15 3myb n ALA 28 Cb 0.65 -2.21 -0.01 0.00 0.00 0.00 0.00 19.45 17.87 3myb n ALA 28 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3myb n LEU 29 N 0.56 7.39 -4.47 0.00 4.77 0.11 -4.79 117.00 120.57 3myb n LEU 29 Ca 0.06 -4.34 -0.29 0.00 -0.03 0.00 0.00 56.01 51.41 3myb n LEU 29 Cb 0.37 -1.58 0.24 0.00 -2.33 0.00 0.00 43.42 40.12 3myb n LEU 29 CO 0.60 1.47 0.39 -1.54 -1.33 0.00 0.00 177.39 176.97 3myb n SER 30 N 4.76 -1.58 -0.19 -1.43 3.41 -1.26 -3.91 113.62 113.42 3myb n SER 30 Ca 0.57 -0.08 -0.00 0.00 -0.26 0.00 0.00 58.87 59.10 3myb n SER 30 Cb 0.34 -1.25 0.10 0.00 -0.26 0.00 0.00 64.21 63.13 3myb n SER 30 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3myb h GLU 31 N -2.51 0.35 -0.33 4.33 5.08 -1.96 0.02 114.58 119.55 3myb h GLU 31 Ca -0.58 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 57.66 3myb h GLU 31 Cb 1.33 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 3myb h GLU 31 CO 0.46 0.23 -0.19 0.00 -1.00 0.00 0.00 179.01 178.51 3myb h ALA 32 N 1.41 1.06 -0.40 3.43 0.00 -1.98 -0.28 119.26 122.51 3myb h ALA 32 Ca 0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3myb h ALA 32 Cb 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3myb h ALA 32 CO -0.32 0.57 0.19 1.98 0.00 0.00 0.00 179.25 181.68 3myb h MET 33 N 0.54 0.58 -0.80 0.00 1.85 -1.71 -1.05 114.93 114.34 3myb h MET 33 Ca 0.09 -0.09 -0.04 0.00 -0.61 0.00 0.00 59.70 59.05 3myb h MET 33 Cb 0.63 -0.10 -0.04 0.00 0.43 0.00 0.00 31.60 32.52 3myb h MET 33 CO 0.04 0.51 0.36 -0.07 -0.40 0.00 0.00 176.91 177.35 3myb h LEU 34 N 0.51 1.07 -0.62 3.39 3.38 -0.78 -0.99 115.31 121.28 3myb h LEU 34 Ca 0.14 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3myb h LEU 34 Cb 0.12 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3myb h LEU 34 CO -0.02 0.93 0.19 0.00 0.09 0.00 0.00 178.44 179.63 3myb h ALA 35 N 1.19 0.81 -0.62 1.53 0.00 -0.83 -0.01 119.26 121.33 3myb h ALA 35 Ca 0.27 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3myb h ALA 35 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3myb h ALA 35 CO -0.03 0.49 0.27 0.00 0.00 0.00 0.00 179.25 179.98 3myb h ALA 36 N 1.06 0.80 -0.41 0.00 0.00 -0.86 -1.19 119.26 118.66 3myb h ALA 36 Ca 0.20 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3myb h ALA 36 Cb 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3myb h ALA 36 CO -0.01 0.39 0.01 -0.07 0.00 0.00 0.00 179.25 179.58 3myb h LEU 37 N 0.86 0.69 -0.70 0.00 3.38 -0.95 -0.66 115.31 117.93 3myb h LEU 37 Ca 0.21 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3myb h LEU 37 Cb 0.17 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3myb h LEU 37 CO -0.02 0.83 0.40 1.23 0.09 0.00 0.00 178.44 180.97 3myb h GLY 38 N 0.54 1.03 0.93 0.83 0.00 -0.83 -0.65 103.07 104.91 3myb h GLY 38 Ca 0.12 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 3myb h GLY 38 CO 0.02 0.43 0.03 -2.09 0.00 0.00 0.00 176.54 174.93 3myb h GLU 39 N 0.96 0.64 -0.01 4.80 4.22 -1.07 -0.36 114.58 123.75 3myb h GLU 39 Ca 0.25 -0.19 -0.00 0.00 0.08 0.00 0.00 59.36 59.50 3myb h GLU 39 Cb 0.01 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 3myb h GLU 39 CO -0.04 0.72 0.01 0.00 -2.18 0.00 0.00 179.01 177.51 3myb h ALA 40 N 0.89 0.02 -0.12 2.92 0.00 -0.70 -0.96 119.26 121.31 3myb h ALA 40 Ca 0.11 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3myb h ALA 40 Cb 0.42 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3myb h ALA 40 CO 0.01 -0.40 -0.24 0.74 0.00 0.00 0.00 179.25 179.36 3myb h PHE 41 N -0.14 0.22 -0.64 0.00 0.04 -1.14 -1.34 116.94 113.94 3myb h PHE 41 Ca 0.00 -0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 3myb h PHE 41 Cb 0.16 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.23 3myb h PHE 41 CO -0.02 0.43 0.12 0.78 -0.60 0.00 0.00 178.31 179.02 3myb h GLY 42 N 0.92 1.14 0.80 -1.45 0.00 -0.77 -1.19 103.07 102.51 3myb h GLY 42 Ca 0.03 -0.75 -0.11 0.00 0.00 0.00 0.00 47.33 46.50 3myb h GLY 42 CO 0.04 0.69 -0.38 -0.84 0.00 0.00 0.00 176.54 176.05 3myb h THR 43 N 0.97 1.38 -0.33 4.70 2.02 -0.91 -3.21 112.91 117.53 3myb h THR 43 Ca 0.20 -1.71 -0.02 0.00 0.77 0.00 0.00 66.41 65.65 3myb h THR 43 Cb 0.42 2.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 3myb h THR 43 CO 0.01 0.51 0.12 -0.07 0.37 0.00 0.00 175.52 176.45 3myb h LEU 44 N 0.02 0.42 -2.34 2.58 3.38 -1.19 -2.42 115.31 115.77 3myb h LEU 44 Ca -0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3myb h LEU 44 Cb 1.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 3myb h LEU 44 CO 0.08 0.40 -0.04 0.00 0.09 0.00 0.00 178.44 178.97 3myb h ALA 45 N 1.66 1.20 -0.01 1.53 0.00 -1.21 -1.78 119.26 120.65 3myb h ALA 45 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3myb h ALA 45 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3myb h ALA 45 CO -0.01 0.05 -0.30 0.39 0.00 0.00 0.00 179.25 179.38 3myb n GLU 46 N -3.41 1.00 -3.59 0.00 -0.58 -0.91 -4.80 120.64 108.35 3myb n GLU 46 Ca -0.02 -0.67 -0.40 0.00 -0.42 0.00 0.00 57.16 55.64 3myb n GLU 46 Cb 0.16 -1.49 -0.09 0.00 -0.57 0.00 0.00 31.44 29.45 3myb n GLU 46 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3myb s ASP 47 N -2.46 5.66 0.23 1.62 -1.08 -0.67 -4.95 116.67 115.02 3myb s ASP 47 Ca 0.24 -1.64 0.22 0.00 -0.52 0.00 0.00 52.55 50.84 3myb s ASP 47 Cb 0.19 -1.99 0.94 0.00 -1.46 0.00 0.00 42.92 40.60 3myb s ASP 47 CO 0.52 -0.59 1.66 -0.62 0.52 0.00 0.00 175.17 176.66 3myb n GLU 48 N 4.91 0.16 0.05 4.34 1.02 -1.26 -2.31 120.64 127.55 3myb n GLU 48 Ca -0.09 0.43 0.14 0.00 -0.02 0.00 0.00 57.16 57.61 3myb n GLU 48 Cb 0.42 -1.83 0.52 0.00 -0.02 0.00 0.00 31.44 30.53 3myb n GLU 48 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3myb n SER 49 N -2.14 0.36 -4.71 1.62 3.41 -1.26 -4.82 113.62 106.09 3myb n SER 49 Ca 0.02 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.74 3myb n SER 49 Cb 0.20 -0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 3myb n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3myb s VAL 50 N -3.04 3.57 -0.14 -3.33 1.01 -0.98 -4.59 120.40 112.89 3myb s VAL 50 Ca 0.12 1.08 0.13 0.00 0.00 0.00 0.00 61.98 63.31 3myb s VAL 50 Cb 0.16 -3.69 -0.18 0.00 0.00 0.00 0.00 36.38 32.67 3myb s VAL 50 CO 0.56 0.05 0.05 0.54 0.00 0.00 0.00 175.10 176.30 3myb n ARG 51 N 4.47 1.62 -3.51 2.72 5.12 0.42 -4.79 116.66 122.71 3myb n ARG 51 Ca 0.12 -0.01 -0.12 0.00 -1.93 0.00 0.00 57.85 55.91 3myb n ARG 51 Cb 0.43 -1.37 -0.04 0.00 -1.16 0.00 0.00 32.46 30.32 3myb n ARG 51 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3myb s ALA 52 N -2.35 -1.79 -0.07 7.54 0.00 -1.21 -4.21 121.76 119.67 3myb s ALA 52 Ca -0.07 1.14 0.04 0.00 0.00 0.00 0.00 51.96 53.07 3myb s ALA 52 Cb 0.04 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.27 3myb s ALA 52 CO 0.59 -0.52 -0.19 0.08 0.00 0.00 0.00 175.76 175.73 3myb s VAL 53 N -2.18 1.62 -0.24 0.00 1.01 -0.20 -1.14 120.40 119.28 3myb s VAL 53 Ca -0.02 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 3myb s VAL 53 Cb -0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 3myb s VAL 53 CO -0.02 0.46 0.09 -0.69 0.00 0.00 0.00 175.10 174.95 3myb s VAL 54 N 0.35 4.65 -0.51 2.92 1.01 0.09 -0.77 120.40 128.14 3myb s VAL 54 Ca -0.13 -0.06 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 3myb s VAL 54 Cb -0.16 -3.16 0.10 0.00 0.00 0.00 0.00 36.38 33.16 3myb s VAL 54 CO 0.05 0.36 0.47 -0.22 0.00 0.00 0.00 175.10 175.76 3myb s LEU 55 N 1.28 5.78 0.50 3.92 2.96 0.35 -0.94 118.68 132.54 3myb s LEU 55 Ca 0.05 -1.48 0.05 0.00 -0.22 0.00 0.00 54.13 52.53 3myb s LEU 55 Cb -0.15 -2.22 0.01 0.00 0.50 0.00 0.00 46.19 44.33 3myb s LEU 55 CO 0.04 -0.77 0.28 0.00 -1.32 0.00 0.00 176.35 174.58 3myb s ALA 56 N 1.76 4.18 -0.11 5.97 0.00 0.32 -0.91 121.76 132.96 3myb s ALA 56 Ca 0.05 -1.31 -0.17 0.00 0.00 0.00 0.00 51.96 50.53 3myb s ALA 56 Cb -0.26 -0.54 0.04 0.00 0.00 0.00 0.00 23.12 22.36 3myb s ALA 56 CO 0.06 -0.30 0.42 0.00 0.00 0.00 0.00 175.76 175.94 3myb s ALA 57 N -2.74 -1.06 0.51 0.00 0.00 -1.26 -1.11 121.76 116.11 3myb s ALA 57 Ca 0.31 0.96 -0.10 0.00 0.00 0.00 0.00 51.96 53.13 3myb s ALA 57 Cb -0.00 -0.40 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 3myb s ALA 57 CO 0.19 -0.24 0.89 -1.54 0.00 0.00 0.00 175.76 175.06 3myb s SER 58 N -0.40 6.37 0.22 0.00 1.04 -0.02 -4.91 113.70 116.00 3myb s SER 58 Ca -0.05 1.23 0.00 0.00 0.48 0.00 0.00 55.95 57.61 3myb s SER 58 Cb -0.03 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.71 3myb s SER 58 CO 0.03 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.23 3myb n GLY 59 N -2.08 -1.02 0.11 7.32 0.00 -1.26 -4.29 105.19 103.96 3myb n GLY 59 Ca 0.04 -1.21 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 3myb n GLY 59 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3myb h LYS 60 N 0.00 0.00 -6.09 1.61 5.09 -1.94 -3.46 116.57 111.78 3myb h LYS 60 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 60.65 60.14 3myb h LYS 60 Cb 0.00 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 32.27 3myb h LYS 60 CO 0.00 0.73 -0.54 0.00 -2.09 0.00 0.00 179.45 177.55 3myb s ALA 61 N -2.94 3.77 -0.02 0.07 0.00 -1.26 -4.28 121.76 117.10 3myb s ALA 61 Ca 0.02 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.88 3myb s ALA 61 Cb 0.09 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.57 3myb s ALA 61 CO 0.78 0.67 0.51 0.35 0.00 0.00 0.00 175.76 178.06 3myb h PHE 62 N 2.79 -0.28 -1.50 0.00 3.57 -1.24 -3.41 116.94 116.86 3myb h PHE 62 Ca -0.47 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.14 3myb h PHE 62 Cb 1.18 0.09 -0.25 0.00 2.79 0.00 0.00 35.95 39.76 3myb h PHE 62 CO 0.59 -0.17 0.25 0.00 -2.23 0.00 0.00 178.31 176.74 3myb n ALA 64 N 4.26 2.51 0.00 0.00 0.00 -0.53 -1.47 120.51 125.27 3myb n ALA 64 Ca -0.16 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.14 3myb n ALA 64 Cb 0.56 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3myb n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3myb n GLY 65 N 1.46 -0.70 3.59 0.00 0.00 -1.12 -4.54 105.19 103.88 3myb n GLY 65 Ca 0.08 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.84 3myb n GLY 65 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3myb n HIS 66 N 0.00 0.50 -2.61 1.61 8.25 -1.26 0.09 115.22 121.80 3myb n HIS 66 Ca 0.00 0.41 -0.42 0.00 -0.26 0.00 0.00 57.72 57.45 3myb n HIS 66 Cb 0.00 -2.08 -0.03 0.00 1.12 0.00 0.00 29.99 29.00 3myb n HIS 66 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3myb s ASP 67 N -1.45 6.28 0.24 0.41 -1.08 -1.25 -4.59 116.67 115.21 3myb s ASP 67 Ca 0.74 -0.28 -0.02 0.00 -0.52 0.00 0.00 52.55 52.47 3myb s ASP 67 Cb -0.38 -2.54 0.26 0.00 -1.46 0.00 0.00 42.92 38.81 3myb s ASP 67 CO 0.50 -1.64 1.65 -0.07 0.52 0.00 0.00 175.17 176.13 3myb h LEU 68 N 12.36 0.65 -0.10 -1.34 3.38 -1.97 -0.87 115.31 127.43 3myb h LEU 68 Ca -0.27 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.48 3myb h LEU 68 Cb 1.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3myb h LEU 68 CO 1.23 0.89 0.00 0.50 0.09 0.00 0.00 178.44 181.15 3myb h LYS 69 N 0.56 0.03 -0.24 1.13 3.64 -2.00 -0.67 116.57 119.02 3myb h LYS 69 Ca 0.07 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3myb h LYS 69 Cb 0.74 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 3myb h LYS 69 CO 0.06 0.02 0.07 1.49 -2.27 0.00 0.00 179.45 178.82 3myb h GLU 70 N 0.04 0.38 -0.62 1.90 4.81 -1.93 -3.03 114.58 116.12 3myb h GLU 70 Ca 0.05 -0.09 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 3myb h GLU 70 Cb 0.05 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 3myb h GLU 70 CO -0.08 0.47 0.32 0.52 -0.73 0.00 0.00 179.01 179.51 3myb h MET 71 N 0.22 0.57 0.00 1.92 2.86 -1.00 -2.88 114.93 116.62 3myb h MET 71 Ca 0.08 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 3myb h MET 71 Cb 0.25 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 3myb h MET 71 CO -0.00 0.38 -0.05 -0.09 1.06 0.00 0.00 176.91 178.21 3myb h ARG 72 N 0.58 0.00 0.00 1.72 9.65 -1.02 -2.05 114.38 123.26 3myb h ARG 72 Ca 0.29 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.17 3myb h ARG 72 Cb 0.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 3myb h ARG 72 CO -0.21 0.05 0.00 0.00 2.80 0.00 0.00 179.97 182.61 3myb n ALA 73 N -2.12 2.18 -3.24 2.80 0.00 -1.09 -4.19 120.51 114.85 3myb n ALA 73 Ca 0.01 -0.09 -0.25 0.00 0.00 0.00 0.00 53.44 53.11 3myb n ALA 73 Cb 0.35 -1.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.33 3myb n ALA 73 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3myb n GLU 74 N -1.45 1.72 -2.43 0.00 -0.58 -0.77 -5.03 120.64 112.09 3myb n GLU 74 Ca 0.07 -3.97 -0.41 0.00 -0.42 0.00 0.00 57.16 52.44 3myb n GLU 74 Cb 0.27 -1.78 -0.01 0.00 -0.57 0.00 0.00 31.44 29.35 3myb n GLU 74 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 3myb n PRO 75 N 0.84 2.94 -3.95 3.49 -0.04 -1.26 -4.74 135.00 132.28 3myb n PRO 75 Ca 0.26 -3.10 -0.16 0.00 -0.04 0.00 0.00 63.50 60.46 3myb n PRO 75 Cb 0.49 -3.51 -0.16 0.00 -0.04 0.00 0.00 33.50 30.28 3myb n PRO 75 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3myb s SER 76 N 4.46 0.37 0.16 3.54 0.15 -1.26 -5.05 113.70 116.07 3myb s SER 76 Ca 0.55 -0.03 -0.15 0.00 0.70 0.00 0.00 55.95 57.02 3myb s SER 76 Cb 0.04 -0.17 0.05 0.00 -1.71 0.00 0.00 66.02 64.24 3myb s SER 76 CO 0.08 -0.07 1.81 -0.09 1.20 0.00 0.00 173.24 176.17 3myb h ARG 77 N 6.96 0.56 -0.80 5.44 9.65 -2.00 -1.85 114.38 132.34 3myb h ARG 77 Ca -0.39 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.47 3myb h ARG 77 Cb 1.15 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 29.56 3myb h ARG 77 CO 0.49 0.37 0.52 1.49 2.80 0.00 0.00 179.97 185.64 3myb h GLU 78 N 0.57 1.02 -0.25 0.20 4.57 -1.97 -0.05 114.58 118.67 3myb h GLU 78 Ca 0.17 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.33 3myb h GLU 78 Cb -0.03 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 28.30 3myb h GLU 78 CO -0.06 0.68 0.03 -0.92 -1.18 0.00 0.00 179.01 177.56 3myb h TYR 79 N 1.06 0.04 -0.48 0.92 3.20 -1.73 -1.76 116.97 118.22 3myb h TYR 79 Ca 0.30 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.08 3myb h TYR 79 Cb -0.09 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 3myb h TYR 79 CO -0.02 -0.00 -0.10 1.88 -1.64 0.00 0.00 178.16 178.28 3myb h TYR 80 N 0.12 1.01 -0.40 -3.82 0.05 -1.00 0.63 116.97 113.56 3myb h TYR 80 Ca 0.12 -0.21 0.08 0.00 0.05 0.00 0.00 58.73 58.76 3myb h TYR 80 Cb 0.13 -0.25 -0.07 0.00 1.01 0.00 0.00 36.73 37.55 3myb h TYR 80 CO -0.17 0.98 -0.05 0.93 -1.05 0.00 0.00 178.16 178.80 3myb h GLU 81 N 0.75 0.05 0.01 4.88 4.39 -0.85 -0.11 114.58 123.70 3myb h GLU 81 Ca 0.12 -0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.61 3myb h GLU 81 Cb 0.64 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 3myb h GLU 81 CO 0.04 0.03 -0.92 0.87 -1.16 0.00 0.00 179.01 177.88 3myb h LYS 82 N 0.05 0.28 -0.14 2.33 1.79 -1.07 -1.64 116.57 118.17 3myb h LYS 82 Ca 0.19 -0.31 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 3myb h LYS 82 Cb 0.29 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 3myb h LYS 82 CO -0.37 1.03 0.08 1.25 -1.08 0.00 0.00 179.45 180.36 3myb h LEU 83 N 0.15 0.18 -0.83 2.94 5.85 -0.59 0.01 115.31 123.02 3myb h LEU 83 Ca -0.06 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.47 3myb h LEU 83 Cb 1.56 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.53 3myb h LEU 83 CO 0.15 0.21 -0.34 -0.26 -0.34 0.00 0.00 178.44 177.86 3myb h PHE 84 N 0.14 0.55 -0.66 1.25 0.04 -1.03 -1.56 116.94 115.68 3myb h PHE 84 Ca 0.05 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.63 3myb h PHE 84 Cb 0.06 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.06 3myb h PHE 84 CO -0.04 0.76 0.22 0.00 -0.60 0.00 0.00 178.31 178.64 3myb h ALA 85 N 1.23 0.86 -0.59 2.45 0.00 -1.09 -0.95 119.26 121.18 3myb h ALA 85 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3myb h ALA 85 Cb 0.79 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3myb h ALA 85 CO 0.06 0.52 0.38 -0.09 0.00 0.00 0.00 179.25 180.13 3myb h ARG 86 N 0.95 0.78 -0.17 0.00 2.43 -0.66 0.13 114.38 117.84 3myb h ARG 86 Ca 0.21 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3myb h ARG 86 Cb 0.28 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3myb h ARG 86 CO -0.01 0.53 0.11 0.00 -1.51 0.00 0.00 179.97 179.09 3myb h THR 88 N 0.22 0.98 -1.00 0.00 2.02 -0.96 -1.08 112.91 113.09 3myb h THR 88 Ca 0.06 -0.32 0.03 0.00 0.77 0.00 0.00 66.41 66.96 3myb h THR 88 Cb 0.00 -0.03 -0.06 0.00 -1.74 0.00 0.00 68.15 66.33 3myb h THR 88 CO -0.01 0.17 0.65 0.44 0.37 0.00 0.00 175.52 177.14 3myb h ASP 89 N 0.93 1.10 -0.40 4.18 3.32 -0.60 0.85 116.42 125.79 3myb h ASP 89 Ca 0.41 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.40 3myb h ASP 89 Cb 0.29 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 3myb h ASP 89 CO -0.21 0.76 0.07 0.58 -1.72 0.00 0.00 179.24 178.71 3myb h VAL 90 N 1.27 1.24 -0.41 -1.35 2.07 -0.62 -0.67 116.25 117.78 3myb h VAL 90 Ca 0.39 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 3myb h VAL 90 Cb -0.02 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 3myb h VAL 90 CO -0.12 0.30 0.07 0.24 0.02 0.00 0.00 177.57 178.08 3myb h MET 91 N 0.51 0.68 -0.07 1.57 2.86 -0.74 -1.78 114.93 117.96 3myb h MET 91 Ca 0.12 -0.18 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 3myb h MET 91 Cb 0.37 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3myb h MET 91 CO 0.01 0.71 -0.45 -0.07 1.06 0.00 0.00 176.91 178.17 3myb h LEU 92 N 0.53 0.17 -1.02 1.22 3.38 -0.78 -2.59 115.31 116.21 3myb h LEU 92 Ca 0.13 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3myb h LEU 92 Cb 0.36 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3myb h LEU 92 CO 0.01 0.60 0.23 0.00 0.09 0.00 0.00 178.44 179.36 3myb h ALA 93 N 1.41 1.22 -0.09 1.53 0.00 -0.47 0.55 119.26 123.41 3myb h ALA 93 Ca 0.01 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.77 3myb h ALA 93 Cb 0.85 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3myb h ALA 93 CO 0.07 0.56 -0.08 0.82 0.00 0.00 0.00 179.25 180.62 3myb h ILE 94 N 0.91 0.78 0.00 0.00 2.04 -1.07 -0.93 117.51 119.25 3myb h ILE 94 Ca 0.21 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.03 3myb h ILE 94 Cb 0.21 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3myb h ILE 94 CO -0.02 0.00 -0.21 -0.61 0.00 0.00 0.00 178.15 177.31 3myb h GLN 95 N -0.09 0.00 0.00 2.37 4.15 -1.04 -2.91 115.11 117.59 3myb h GLN 95 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3myb h GLN 95 Cb 0.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.87 3myb h GLN 95 CO -0.14 0.21 -0.65 0.54 -1.93 0.00 0.00 178.83 176.86 3myb n ARG 96 N -3.53 0.15 -1.74 1.69 1.74 0.13 -4.94 116.66 110.16 3myb n ARG 96 Ca -0.01 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.68 3myb n ARG 96 Cb 0.37 -1.58 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 3myb n ARG 96 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3myb n LEU 97 N -1.78 4.32 -1.33 0.55 7.94 -0.37 -4.85 117.00 121.47 3myb n LEU 97 Ca 0.04 1.14 -0.03 0.00 -1.11 0.00 0.00 56.01 56.05 3myb n LEU 97 Cb 0.39 -1.59 0.02 0.00 0.53 0.00 0.00 43.42 42.76 3myb n LEU 97 CO 0.37 0.14 0.79 -0.81 -1.11 0.00 0.00 177.39 176.76 3myb n PRO 98 N 2.21 1.16 -3.82 1.96 -0.05 -1.26 -4.67 135.00 130.53 3myb n PRO 98 Ca 0.09 -0.35 -0.12 0.00 -0.05 0.00 0.00 63.50 63.07 3myb n PRO 98 Cb 0.36 -1.14 -0.09 0.00 -0.05 0.00 0.00 33.50 32.59 3myb n PRO 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3myb s ALA 99 N -0.39 -0.56 0.49 0.55 0.00 -1.26 -4.40 121.76 116.19 3myb s ALA 99 Ca 0.07 0.09 -0.22 0.00 0.00 0.00 0.00 51.96 51.90 3myb s ALA 99 Cb 0.05 0.10 -0.06 0.00 0.00 0.00 0.00 23.12 23.21 3myb s ALA 99 CO 0.01 -0.24 1.22 -2.14 0.00 0.00 0.00 175.76 174.61 3myb s PRO 100 N -1.36 3.53 -0.15 0.00 0.02 -1.26 -4.82 135.00 130.96 3myb s PRO 100 Ca -0.14 1.91 0.02 0.00 0.02 0.00 0.00 61.00 62.81 3myb s PRO 100 Cb -0.06 -2.33 0.01 0.00 0.02 0.00 0.00 34.50 32.14 3myb s PRO 100 CO 0.03 -0.78 -0.22 0.08 -0.33 0.00 0.00 177.00 175.78 3myb s VAL 101 N -1.48 2.05 -0.20 3.83 1.01 -1.26 -1.03 120.40 123.32 3myb s VAL 101 Ca 0.67 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 3myb s VAL 101 Cb -0.32 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.24 3myb s VAL 101 CO 0.38 0.55 -0.11 -0.63 0.00 0.00 0.00 175.10 175.29 3myb s ILE 102 N 0.91 2.81 0.07 2.22 1.01 0.05 -0.98 121.20 127.28 3myb s ILE 102 Ca -0.05 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.62 3myb s ILE 102 Cb -0.15 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 3myb s ILE 102 CO -0.04 0.48 1.01 0.00 0.00 0.00 0.00 174.94 176.38 3myb s ALA 103 N 1.35 3.24 -0.45 9.38 0.00 -0.37 -0.50 121.76 134.42 3myb s ALA 103 Ca 0.05 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 3myb s ALA 103 Cb -0.14 -3.33 0.11 0.00 0.00 0.00 0.00 23.12 19.77 3myb s ALA 103 CO -0.07 -0.17 0.30 0.50 0.00 0.00 0.00 175.76 176.32 3myb s ARG 104 N 0.47 2.37 -0.44 0.00 3.52 -0.09 -0.98 118.95 123.80 3myb s ARG 104 Ca 0.50 -1.74 -0.09 0.00 -0.13 0.00 0.00 55.73 54.28 3myb s ARG 104 Cb -0.24 -3.81 0.10 0.00 -1.56 0.00 0.00 34.95 29.44 3myb s ARG 104 CO 0.30 -1.13 0.29 0.08 -0.81 0.00 0.00 175.30 174.02 3myb s VAL 105 N 1.31 4.15 -1.53 7.11 1.01 -0.17 -4.47 120.40 127.81 3myb s VAL 105 Ca 0.06 -1.58 0.13 0.00 0.00 0.00 0.00 61.98 60.58 3myb s VAL 105 Cb -0.25 -3.63 0.09 0.00 0.00 0.00 0.00 36.38 32.59 3myb s VAL 105 CO -0.01 -0.61 0.88 0.00 0.00 0.00 0.00 175.10 175.35 3myb n HIS 106 N 4.89 0.00 -2.04 5.22 1.44 -1.26 -1.61 115.22 121.86 3myb n HIS 106 Ca -0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 3myb n HIS 106 Cb 0.42 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.53 3myb n HIS 106 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3myb n GLY 107 N 0.74 3.05 3.78 -1.39 0.00 -1.26 -4.62 105.19 105.48 3myb n GLY 107 Ca 0.07 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.90 3myb n GLY 107 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3myb s ILE 108 N -2.96 2.09 -0.25 -0.61 -5.25 -1.26 -3.96 121.20 109.01 3myb s ILE 108 Ca 0.00 0.08 -0.01 0.00 -0.99 0.00 0.00 60.65 59.74 3myb s ILE 108 Cb 0.00 -3.05 0.07 0.00 2.95 0.00 0.00 42.46 42.43 3myb s ILE 108 CO 0.00 0.02 0.02 0.00 -1.79 0.00 0.00 174.94 173.19 3myb s ALA 109 N -1.14 1.55 0.01 2.27 0.00 -0.15 -1.08 121.76 123.23 3myb s ALA 109 Ca 0.54 -1.26 0.07 0.00 0.00 0.00 0.00 51.96 51.31 3myb s ALA 109 Cb -0.46 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 3myb s ALA 109 CO 0.61 -1.33 -0.21 0.95 0.00 0.00 0.00 175.76 175.78 3myb s THR 110 N 1.60 1.68 0.00 0.00 -4.23 -0.54 -1.65 115.64 112.49 3myb s THR 110 Ca 0.01 -1.06 0.00 0.00 -1.18 0.00 0.00 61.69 59.46 3myb s THR 110 Cb -0.18 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.24 3myb s THR 110 CO -0.12 0.34 0.00 0.00 -0.54 0.00 0.00 174.62 174.30 3myb n ALA 111 N 2.20 0.00 0.31 3.99 0.00 0.32 -0.85 120.51 126.48 3myb n ALA 111 Ca -0.16 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.48 3myb n ALA 111 Cb 0.53 0.00 1.06 0.00 0.00 0.00 0.00 19.45 21.04 3myb n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3myb h ALA 112 N -1.00 1.00 -0.49 0.00 0.00 -1.89 -0.49 119.26 116.38 3myb h ALA 112 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 3myb h ALA 112 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3myb h ALA 112 CO 0.00 0.00 -0.20 0.78 0.00 0.00 0.00 179.25 179.83 3myb h GLY 113 N 0.35 1.07 1.57 0.00 0.00 -1.15 -0.86 103.07 104.05 3myb h GLY 113 Ca 0.00 -0.93 -0.15 0.00 0.00 0.00 0.00 47.33 46.25 3myb h GLY 113 CO 0.00 0.85 -0.54 0.00 0.00 0.00 0.00 176.54 176.85 3myb h GLN 115 N 0.35 0.47 -0.38 0.00 4.15 -1.09 -1.34 115.11 117.27 3myb h GLN 115 Ca 0.01 -0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.47 3myb h GLN 115 Cb 1.06 -0.11 -0.06 0.00 0.21 0.00 0.00 27.48 28.58 3myb h GLN 115 CO 0.10 0.31 -0.02 -0.07 -1.93 0.00 0.00 178.83 177.22 3myb h LEU 116 N 0.49 -0.20 -0.35 -2.39 3.38 -1.05 0.35 115.31 115.54 3myb h LEU 116 Ca 0.22 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.30 3myb h LEU 116 Cb 0.12 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3myb h LEU 116 CO -0.15 -0.06 0.20 0.58 0.09 0.00 0.00 178.44 179.10 3myb h VAL 117 N 0.08 1.03 0.00 1.22 2.07 -1.30 -1.41 116.25 117.94 3myb h VAL 117 Ca 0.19 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 3myb h VAL 117 Cb 0.27 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3myb h VAL 117 CO -0.33 0.07 -0.20 0.00 0.02 0.00 0.00 177.57 177.14 3myb h ALA 118 N 1.16 1.29 0.00 1.67 0.00 -0.70 -2.83 119.26 119.86 3myb h ALA 118 Ca 0.14 -0.18 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 3myb h ALA 118 Cb 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3myb h ALA 118 CO -0.07 0.25 -1.04 0.52 0.00 0.00 0.00 179.25 178.91 3myb h MET 119 N 0.00 0.00 -7.13 0.00 2.07 -0.62 -3.46 114.93 105.79 3myb h MET 119 Ca -0.00 0.00 -0.55 0.00 -2.07 0.00 0.00 59.70 57.08 3myb h MET 119 Cb 0.47 0.00 0.16 0.00 -1.87 0.00 0.00 31.60 30.36 3myb h MET 119 CO 0.03 0.58 0.47 0.00 1.07 0.00 0.00 176.91 179.06 3myb h ASP 121 N 0.24 0.00 -5.16 0.00 3.32 -1.36 -3.46 116.42 109.99 3myb h ASP 121 Ca -0.50 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 3myb h ASP 121 Cb 1.32 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.73 3myb h ASP 121 CO 0.52 0.46 -0.45 -0.76 -1.72 0.00 0.00 179.24 177.29 3myb s LEU 122 N -7.96 1.69 -0.19 1.55 1.43 -1.11 -5.02 118.68 109.06 3myb s LEU 122 Ca -0.02 -0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 52.20 3myb s LEU 122 Cb 0.14 0.81 0.05 0.00 0.03 0.00 0.00 46.19 47.22 3myb s LEU 122 CO 0.74 -0.67 0.51 0.00 0.23 0.00 0.00 176.35 177.16 3myb s ALA 123 N -3.70 -1.28 -0.13 4.21 0.00 -1.26 -1.24 121.76 118.37 3myb s ALA 123 Ca 0.04 1.49 0.03 0.00 0.00 0.00 0.00 51.96 53.52 3myb s ALA 123 Cb 0.05 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.30 3myb s ALA 123 CO -0.10 -0.25 -0.22 0.08 0.00 0.00 0.00 175.76 175.27 3myb s VAL 124 N 0.41 2.03 0.22 0.00 1.01 -0.16 -0.84 120.40 123.06 3myb s VAL 124 Ca -0.01 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.10 3myb s VAL 124 Cb -0.04 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 3myb s VAL 124 CO -0.01 0.55 -0.15 0.00 0.00 0.00 0.00 175.10 175.49 3myb s ALA 125 N 0.70 2.80 0.51 5.51 0.00 -0.14 -1.00 121.76 130.15 3myb s ALA 125 Ca -0.10 -1.63 -0.09 0.00 0.00 0.00 0.00 51.96 50.13 3myb s ALA 125 Cb -0.16 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.40 3myb s ALA 125 CO 0.01 0.39 0.87 0.95 0.00 0.00 0.00 175.76 177.98 3myb s THR 126 N -1.94 4.79 0.47 0.00 -4.23 -0.63 -1.28 115.64 112.81 3myb s THR 126 Ca 0.25 0.60 0.30 0.00 -1.18 0.00 0.00 61.69 61.66 3myb s THR 126 Cb -0.07 -3.82 0.33 0.00 1.34 0.00 0.00 72.50 70.27 3myb s THR 126 CO 0.14 -0.85 2.15 0.03 -0.54 0.00 0.00 174.62 175.55 3myb h ARG 127 N 0.36 0.00 -0.01 3.99 3.08 -1.39 -1.23 114.38 119.17 3myb h ARG 127 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3myb h ARG 127 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 3myb h ARG 127 CO 0.62 0.07 -0.33 -0.40 -1.07 0.00 0.00 179.97 178.86 3myb n ASP 128 N -3.62 1.44 -4.76 7.04 5.75 -1.26 -4.29 116.55 116.85 3myb n ASP 128 Ca -0.02 -1.16 -0.37 0.00 -0.01 0.00 0.00 54.79 53.24 3myb n ASP 128 Cb 0.18 0.26 0.01 0.00 -1.03 0.00 0.00 41.12 40.54 3myb n ASP 128 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3myb s ALA 129 N -2.47 2.76 0.04 2.12 0.00 -0.47 -4.87 121.76 118.87 3myb s ALA 129 Ca 0.23 1.00 0.03 0.00 0.00 0.00 0.00 51.96 53.22 3myb s ALA 129 Cb 0.19 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 3myb s ALA 129 CO 0.53 -0.95 -0.09 1.03 0.00 0.00 0.00 175.76 176.28 3myb s ARG 130 N -3.03 0.63 -0.04 0.00 0.52 -1.25 -2.38 118.95 113.39 3myb s ARG 130 Ca 0.71 -0.67 0.05 0.00 -0.52 0.00 0.00 55.73 55.29 3myb s ARG 130 Cb -0.30 -0.52 -0.01 0.00 0.52 0.00 0.00 34.95 34.65 3myb s ARG 130 CO 0.35 0.12 -0.18 -0.06 0.02 0.00 0.00 175.30 175.55 3myb s PHE 131 N -1.02 1.70 0.05 -0.53 0.40 -0.57 -0.98 117.98 117.03 3myb s PHE 131 Ca -0.04 -0.45 -0.19 0.00 -0.60 0.00 0.00 56.93 55.65 3myb s PHE 131 Cb -0.08 -1.13 0.04 0.00 0.51 0.00 0.00 43.02 42.36 3myb s PHE 131 CO 0.01 -0.13 0.45 0.00 0.70 0.00 0.00 175.22 176.24 3myb s ALA 132 N -0.08 -1.11 -0.84 5.36 0.00 -0.66 -0.24 121.76 124.20 3myb s ALA 132 Ca -0.01 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.34 3myb s ALA 132 Cb -0.10 0.38 0.22 0.00 0.00 0.00 0.00 23.12 23.61 3myb s ALA 132 CO 0.01 -0.48 0.77 1.33 0.00 0.00 0.00 175.76 177.40 3myb n VAL 133 N 0.44 2.81 -0.72 0.00 0.24 -1.26 -0.52 118.33 119.32 3myb n VAL 133 Ca -0.18 -5.15 0.09 0.00 -2.04 0.00 0.00 64.34 57.06 3myb n VAL 133 Cb 0.60 -2.27 0.36 0.00 -1.47 0.00 0.00 33.84 31.06 3myb n VAL 133 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3myb n SER 134 N 1.92 4.95 -0.26 -1.34 3.41 -1.26 -4.35 113.62 116.69 3myb n SER 134 Ca 0.23 -2.62 0.16 0.00 -0.26 0.00 0.00 58.87 56.38 3myb n SER 134 Cb 0.37 -0.60 0.44 0.00 -0.26 0.00 0.00 64.21 64.16 3myb n SER 134 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3myb h GLY 135 N 3.86 1.10 2.00 5.00 0.00 -1.92 -0.83 103.07 112.27 3myb h GLY 135 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 3myb h GLY 135 CO 0.30 0.02 -0.03 1.19 0.00 0.00 0.00 176.54 178.02 3myb h ILE 136 N 0.56 0.64 0.00 2.60 6.09 -1.58 0.30 117.51 126.12 3myb h ILE 136 Ca 0.47 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.82 3myb h ILE 136 Cb 0.96 1.08 0.00 0.00 0.47 0.00 0.00 36.82 39.33 3myb h ILE 136 CO -0.21 0.03 0.00 0.78 -3.07 0.00 0.00 178.15 175.68 3myb h ASN 137 N 0.00 0.00 -0.32 2.19 2.35 -1.45 -0.83 115.58 117.52 3myb h ASN 137 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3myb h ASN 137 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3myb h ASN 137 CO 0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 3myb n VAL 138 N -3.03 1.85 -0.84 2.81 0.24 -0.01 -4.97 118.33 114.39 3myb n VAL 138 Ca -0.01 -1.54 0.00 0.00 -2.04 0.00 0.00 64.34 60.75 3myb n VAL 138 Cb 0.19 0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.58 3myb n VAL 138 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3myb n GLY 139 N -0.04 0.65 3.03 7.63 0.00 -0.32 -5.01 105.19 111.13 3myb n GLY 139 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3myb n GLY 139 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3myb s LEU 140 N 0.00 4.82 0.21 0.99 2.96 -0.59 -4.93 118.68 122.13 3myb s LEU 140 Ca 0.00 -2.51 -0.32 0.00 -0.22 0.00 0.00 54.13 51.08 3myb s LEU 140 Cb 0.00 -1.71 -0.14 0.00 0.50 0.00 0.00 46.19 44.83 3myb s LEU 140 CO 0.00 -0.37 1.35 0.33 -1.32 0.00 0.00 176.35 176.34 3myb n PHE 141 N 3.84 1.91 -1.22 5.38 7.35 -1.26 -1.88 117.46 131.58 3myb n PHE 141 Ca 0.04 0.50 -0.38 0.00 -0.76 0.00 0.00 57.45 56.85 3myb n PHE 141 Cb 0.38 -2.41 -0.03 0.00 0.35 0.00 0.00 39.48 37.77 3myb n PHE 141 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3myb h SER 143 N 6.75 0.02 -0.15 0.00 0.02 -1.99 0.09 113.55 118.29 3myb h SER 143 Ca 0.53 -0.18 -0.19 0.00 -0.84 0.00 0.00 61.79 61.10 3myb h SER 143 Cb 0.50 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.05 3myb h SER 143 CO 1.81 0.19 -0.67 0.71 -1.14 0.00 0.00 176.83 177.73 3myb h THR 144 N -0.16 1.30 -0.53 -2.27 1.35 -2.01 -2.76 112.91 107.84 3myb h THR 144 Ca 0.00 -1.90 -0.02 0.00 -0.55 0.00 0.00 66.41 63.95 3myb h THR 144 Cb 0.18 2.02 -0.03 0.00 -1.73 0.00 0.00 68.15 68.59 3myb h THR 144 CO -0.00 0.59 0.26 -0.65 -0.25 0.00 0.00 175.52 175.47 3myb h PRO 145 N 0.41 0.73 -0.59 4.72 0.11 -1.87 -2.16 132.00 133.35 3myb h PRO 145 Ca -0.04 -0.08 0.05 0.00 0.11 0.00 0.00 66.00 66.03 3myb h PRO 145 Cb 1.30 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 3myb h PRO 145 CO 0.14 0.56 0.39 0.78 -0.21 0.00 0.00 178.00 179.66 3myb h GLY 146 N 0.83 0.74 0.41 -0.55 0.00 -0.77 -0.31 103.07 103.43 3myb h GLY 146 Ca 0.19 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.30 3myb h GLY 146 CO -0.03 0.20 -0.25 -2.08 0.00 0.00 0.00 176.54 174.39 3myb h VAL 147 N 0.62 0.43 -0.23 4.60 2.07 -1.11 0.07 116.25 122.70 3myb h VAL 147 Ca 0.25 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.71 3myb h VAL 147 Cb 0.20 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3myb h VAL 147 CO -0.07 0.00 -0.06 0.00 0.02 0.00 0.00 177.57 177.46 3myb h ALA 148 N 0.48 0.32 -0.57 1.67 0.00 -1.48 -3.23 119.26 116.45 3myb h ALA 148 Ca 0.07 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.72 3myb h ALA 148 Cb 0.47 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3myb h ALA 148 CO -0.23 0.12 0.37 1.25 0.00 0.00 0.00 179.25 180.76 3myb h LEU 149 N 0.19 0.63 0.00 0.00 5.85 -1.00 -1.97 115.31 119.02 3myb h LEU 149 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3myb h LEU 149 Cb 0.53 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3myb h LEU 149 CO 0.02 0.45 0.00 -1.54 -0.34 0.00 0.00 178.44 177.04 3myb n SER 150 N -4.71 0.00 -0.91 1.25 3.41 0.00 -1.27 113.62 111.40 3myb n SER 150 Ca 0.04 -0.28 0.10 0.00 -0.26 0.00 0.00 58.87 58.47 3myb n SER 150 Cb 0.04 -0.14 0.14 0.00 -0.26 0.00 0.00 64.21 63.99 3myb n SER 150 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3myb n ARG 151 N -1.14 2.08 -0.01 4.33 1.74 -0.75 -4.43 116.66 118.48 3myb n ARG 151 Ca 0.11 -1.93 -0.01 0.00 -0.77 0.00 0.00 57.85 55.25 3myb n ARG 151 Cb 0.10 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 3myb n ARG 151 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3myb n ASN 152 N 1.19 4.13 -4.24 0.55 5.03 -0.39 -5.10 115.26 116.43 3myb n ASN 152 Ca 0.14 0.00 -0.14 0.00 0.87 0.00 0.00 54.58 55.46 3myb n ASN 152 Cb 0.52 0.78 -0.10 0.00 -1.02 0.00 0.00 39.78 39.96 3myb n ASN 152 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 3myb s VAL 153 N -2.14 1.03 0.92 2.41 -7.23 -0.49 -4.12 120.40 110.79 3myb s VAL 153 Ca -0.02 -2.03 -0.11 0.00 -1.81 0.00 0.00 61.98 58.02 3myb s VAL 153 Cb 0.02 -1.89 0.12 0.00 0.56 0.00 0.00 36.38 35.19 3myb s VAL 153 CO 0.15 -0.71 0.97 0.61 -0.31 0.00 0.00 175.10 175.81 3myb n GLY 154 N -0.19 -0.77 0.14 2.32 0.00 -1.26 -4.57 105.19 100.86 3myb n GLY 154 Ca -0.10 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 3myb n GLY 154 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3myb h ARG 155 N -1.79 -0.27 -0.69 1.61 3.08 -1.98 -0.87 114.38 113.48 3myb h ARG 155 Ca -0.43 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.56 3myb h ARG 155 Cb 1.27 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.36 3myb h ARG 155 CO 0.39 -0.13 0.14 0.87 -1.07 0.00 0.00 179.97 180.18 3myb h LYS 156 N -0.34 1.12 -0.64 0.04 1.57 -1.99 0.19 116.57 116.52 3myb h LYS 156 Ca -0.03 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 3myb h LYS 156 Cb 0.26 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 3myb h LYS 156 CO 0.05 1.01 0.34 0.00 -0.57 0.00 0.00 179.45 180.28 3myb h ALA 157 N 1.07 0.82 -0.19 3.86 0.00 -1.89 -1.67 119.26 121.26 3myb h ALA 157 Ca 0.21 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3myb h ALA 157 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3myb h ALA 157 CO 0.01 0.35 0.01 0.00 0.00 0.00 0.00 179.25 179.62 3myb h ALA 158 N 1.16 0.26 -0.42 0.00 0.00 -0.94 -1.85 119.26 117.48 3myb h ALA 158 Ca 0.23 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3myb h ALA 158 Cb 0.06 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3myb h ALA 158 CO -0.03 -0.04 0.26 0.35 0.00 0.00 0.00 179.25 179.78 3myb h PHE 159 N 0.10 0.48 -0.42 0.00 3.04 -0.84 -0.63 116.94 118.67 3myb h PHE 159 Ca 0.06 0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.05 3myb h PHE 159 Cb 0.37 -0.16 -0.04 0.00 2.56 0.00 0.00 35.95 38.68 3myb h PHE 159 CO 0.03 0.29 0.21 1.49 -2.02 0.00 0.00 178.31 178.30 3myb h GLU 160 N 0.52 0.40 -0.51 1.11 4.81 -1.21 -0.89 114.58 118.81 3myb h GLU 160 Ca 0.16 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3myb h GLU 160 Cb -0.02 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 3myb h GLU 160 CO -0.06 0.27 0.34 0.52 -0.73 0.00 0.00 179.01 179.34 3myb h MET 161 N 0.42 0.66 -0.50 1.92 2.86 -0.95 -1.60 114.93 117.75 3myb h MET 161 Ca 0.18 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 3myb h MET 161 Cb 0.09 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 3myb h MET 161 CO -0.13 0.44 -0.07 -0.07 1.06 0.00 0.00 176.91 178.14 3myb h LEU 162 N 0.68 0.92 0.00 1.22 3.38 -0.70 -0.30 115.31 120.51 3myb h LEU 162 Ca 0.19 -0.34 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 3myb h LEU 162 Cb -0.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3myb h LEU 162 CO -0.05 1.04 -0.72 1.62 0.09 0.00 0.00 178.44 180.42 3myb h VAL 163 N 0.78 0.69 0.00 1.22 3.04 -1.10 -3.37 116.25 117.51 3myb h VAL 163 Ca 0.13 -2.05 -0.24 0.00 -1.01 0.00 0.00 66.70 63.54 3myb h VAL 163 Cb 0.61 2.27 -0.04 0.00 -2.01 0.00 0.00 31.29 32.11 3myb h VAL 163 CO 0.04 0.39 -2.09 0.35 -1.01 0.00 0.00 177.57 175.26 3myb n THR 164 N -3.11 1.01 -0.99 3.17 -2.24 -0.61 -4.99 114.28 106.51 3myb n THR 164 Ca -0.01 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 3myb n THR 164 Cb 0.74 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 3myb n THR 164 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3myb n GLY 165 N 1.55 0.31 3.82 3.38 0.00 -0.12 -4.89 105.19 109.24 3myb n GLY 165 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 3myb n GLY 165 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3myb s GLU 166 N -0.78 3.55 0.45 1.61 0.41 -1.26 -4.41 118.70 118.27 3myb s GLU 166 Ca 0.00 1.07 -0.23 0.00 -0.41 0.00 0.00 54.97 55.40 3myb s GLU 166 Cb 0.00 -2.07 -0.08 0.00 -1.78 0.00 0.00 34.13 30.20 3myb s GLU 166 CO 0.00 -0.61 1.10 -0.06 -0.49 0.00 0.00 175.26 175.20 3myb s PHE 167 N -2.60 3.02 -0.06 1.61 0.08 -1.26 -4.58 117.98 114.20 3myb s PHE 167 Ca 0.61 1.58 0.05 0.00 0.12 0.00 0.00 56.93 59.29 3myb s PHE 167 Cb -0.13 -3.23 -0.02 0.00 -0.57 0.00 0.00 43.02 39.07 3myb s PHE 167 CO 0.37 -1.08 -0.21 0.08 -0.10 0.00 0.00 175.22 174.27 3myb s VAL 168 N -1.67 2.39 0.90 -0.44 1.01 0.67 -4.94 120.40 118.32 3myb s VAL 168 Ca 0.63 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 3myb s VAL 168 Cb -0.24 -1.90 0.13 0.00 0.00 0.00 0.00 36.38 34.38 3myb s VAL 168 CO 0.29 0.57 1.10 -0.94 0.00 0.00 0.00 175.10 176.12 3myb s SER 169 N -0.28 3.28 0.18 3.32 1.04 -1.26 -1.51 113.70 118.47 3myb s SER 169 Ca 0.00 1.72 -0.11 0.00 0.48 0.00 0.00 55.95 58.05 3myb s SER 169 Cb -0.13 -2.36 0.09 0.00 0.10 0.00 0.00 66.02 63.72 3myb s SER 169 CO 0.03 -2.79 1.72 0.00 0.98 0.00 0.00 173.24 173.18 3myb h ALA 170 N -1.66 0.82 -0.51 5.32 0.00 -1.66 0.23 119.26 121.81 3myb h ALA 170 Ca -0.48 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.26 3myb h ALA 170 Cb 1.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 3myb h ALA 170 CO 0.50 0.46 0.32 0.22 0.00 0.00 0.00 179.25 180.75 3myb h ASP 171 N 0.89 0.53 -0.58 0.00 3.58 -1.89 -0.62 116.42 118.33 3myb h ASP 171 Ca 0.21 -0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.56 3myb h ASP 171 Cb 0.24 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 3myb h ASP 171 CO -0.01 0.38 0.02 0.44 -2.88 0.00 0.00 179.24 177.19 3myb h ASP 172 N 0.64 1.00 -0.90 2.28 3.32 -1.85 -1.92 116.42 118.99 3myb h ASP 172 Ca 0.20 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 56.99 3myb h ASP 172 Cb -0.02 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.22 3myb h ASP 172 CO -0.07 1.04 0.59 0.00 -1.72 0.00 0.00 179.24 179.08 3myb h ALA 173 N 1.06 1.14 -0.19 3.45 0.00 -0.38 0.07 119.26 124.41 3myb h ALA 173 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3myb h ALA 173 Cb 0.52 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3myb h ALA 173 CO 0.03 0.52 0.11 -0.22 0.00 0.00 0.00 179.25 179.68 3myb h LYS 174 N 1.20 0.27 -0.78 0.00 3.64 -0.91 -0.62 116.57 119.37 3myb h LYS 174 Ca 0.33 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.74 3myb h LYS 174 Cb -0.11 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.61 3myb h LYS 174 CO -0.08 0.26 0.51 0.78 -2.27 0.00 0.00 179.45 178.65 3myb h GLY 175 N 0.21 1.07 2.00 5.01 0.00 -0.78 -2.05 103.07 108.53 3myb h GLY 175 Ca 0.07 -0.34 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 3myb h GLY 175 CO -0.01 0.26 -0.52 1.41 0.00 0.00 0.00 176.54 177.68 3myb h LEU 176 N 0.85 0.00 0.00 3.11 3.38 -0.75 -3.48 115.31 118.42 3myb h LEU 176 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3myb h LEU 176 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3myb h LEU 176 CO -0.11 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.54 3myb n GLY 177 N 0.39 0.95 0.08 0.83 0.00 -0.76 -4.32 105.19 102.36 3myb n GLY 177 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 3myb n GLY 177 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3myb h LEU 178 N 0.00 0.00 -8.74 0.99 5.85 -1.29 -3.45 115.31 108.67 3myb h LEU 178 Ca 0.00 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.38 3myb h LEU 178 Cb 0.00 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 40.89 3myb h LEU 178 CO 0.00 0.90 -0.68 0.68 -0.34 0.00 0.00 178.44 179.00 3myb s VAL 179 N -2.81 1.04 -0.16 1.05 -7.23 -1.21 -4.68 120.40 106.41 3myb s VAL 179 Ca 0.01 -2.04 -0.02 0.00 -1.81 0.00 0.00 61.98 58.12 3myb s VAL 179 Cb 0.10 -2.08 -0.23 0.00 0.56 0.00 0.00 36.38 34.72 3myb s VAL 179 CO 0.81 -0.54 0.21 0.59 -0.31 0.00 0.00 175.10 175.85 3myb n ASN 180 N -0.29 1.93 -3.95 4.85 4.13 -0.02 -4.43 115.26 117.48 3myb n ASN 180 Ca -0.08 0.12 -0.10 0.00 1.68 0.00 0.00 54.58 56.21 3myb n ASN 180 Cb 0.62 -0.62 -0.12 0.00 -1.54 0.00 0.00 39.78 38.13 3myb n ASN 180 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 3myb s ARG 181 N -2.55 0.26 -0.06 3.52 1.81 -1.14 -5.05 118.95 115.75 3myb s ARG 181 Ca -0.24 -0.48 0.00 0.00 -1.72 0.00 0.00 55.73 53.29 3myb s ARG 181 Cb 0.07 0.09 0.02 0.00 -0.45 0.00 0.00 34.95 34.69 3myb s ARG 181 CO 0.73 -0.04 -0.04 0.08 -0.68 0.00 0.00 175.30 175.35 3myb s VAL 182 N -1.17 0.55 0.18 3.52 1.01 -1.26 -0.97 120.40 122.26 3myb s VAL 182 Ca -0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.76 3myb s VAL 182 Cb -0.08 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 3myb s VAL 182 CO -0.01 0.25 0.10 0.68 0.00 0.00 0.00 175.10 176.12 3myb s VAL 183 N 1.24 0.05 0.60 2.92 -7.23 -0.41 -4.90 120.40 112.67 3myb s VAL 183 Ca -0.06 -1.97 -0.18 0.00 -1.81 0.00 0.00 61.98 57.96 3myb s VAL 183 Cb -0.14 -2.34 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 3myb s VAL 183 CO -0.02 -0.16 1.17 0.00 -0.31 0.00 0.00 175.10 175.78 3myb s ALA 184 N -4.11 2.53 0.25 1.32 0.00 -1.26 -0.98 121.76 119.50 3myb s ALA 184 Ca 0.34 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 3myb s ALA 184 Cb 0.07 -3.41 0.50 0.00 0.00 0.00 0.00 23.12 20.28 3myb s ALA 184 CO 0.08 -1.15 1.68 -1.35 0.00 0.00 0.00 175.76 175.02 3myb h PRO 185 N 0.73 0.25 0.00 0.00 0.11 -1.95 0.83 132.00 131.97 3myb h PRO 185 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3myb h PRO 185 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3myb h PRO 185 CO 0.55 0.16 0.00 0.87 -0.21 0.00 0.00 178.00 179.37 3myb h LYS 186 N 0.25 0.00 -0.08 1.05 6.56 -2.04 -2.60 116.57 119.72 3myb h LYS 186 Ca 0.44 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.03 3myb h LYS 186 Cb 0.77 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.43 3myb h LYS 186 CO -0.54 0.00 0.00 0.00 -2.06 0.00 0.00 179.45 176.85 3myb n ALA 187 N -2.00 2.45 0.01 3.86 0.00 0.26 -4.64 120.51 120.45 3myb n ALA 187 Ca -0.01 -0.72 -0.12 0.00 0.00 0.00 0.00 53.44 52.58 3myb n ALA 187 Cb 0.14 -0.77 -0.07 0.00 0.00 0.00 0.00 19.45 18.74 3myb n ALA 187 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3myb h LEU 188 N 4.41 0.05 -0.80 0.00 5.85 -1.20 -0.92 115.31 122.69 3myb h LEU 188 Ca 0.00 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.54 3myb h LEU 188 Cb 0.94 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 3myb h LEU 188 CO 0.00 0.22 0.52 0.44 -0.34 0.00 0.00 178.44 179.28 3myb h ASP 189 N -0.12 0.93 -0.66 1.25 3.32 -1.82 -1.33 116.42 118.00 3myb h ASP 189 Ca 0.01 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 3myb h ASP 189 Cb 0.19 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 3myb h ASP 189 CO -0.00 0.69 0.11 0.44 -1.72 0.00 0.00 179.24 178.76 3myb h ASP 190 N 1.09 1.05 -0.50 6.45 3.32 -1.80 -1.08 116.42 124.94 3myb h ASP 190 Ca 0.29 -0.25 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 3myb h ASP 190 Cb -0.11 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.15 3myb h ASP 190 CO -0.06 1.03 -0.06 -0.08 -1.72 0.00 0.00 179.24 178.35 3myb h GLU 191 N 1.03 0.92 -0.25 3.56 4.57 -0.77 -1.06 114.58 122.58 3myb h GLU 191 Ca 0.20 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 3myb h GLU 191 Cb 0.43 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 3myb h GLU 191 CO 0.01 0.98 0.16 0.82 -1.18 0.00 0.00 179.01 179.80 3myb h ILE 192 N 0.78 1.06 -0.61 2.32 1.08 -1.09 -2.72 117.51 118.32 3myb h ILE 192 Ca 0.13 -0.11 -0.03 0.00 -0.39 0.00 0.00 64.86 64.46 3myb h ILE 192 Cb 0.60 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 3myb h ILE 192 CO 0.04 0.06 0.26 -0.08 -0.69 0.00 0.00 178.15 177.73 3myb h GLU 193 N 0.33 0.89 -0.65 2.37 4.57 -1.02 0.35 114.58 121.42 3myb h GLU 193 Ca 0.09 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3myb h GLU 193 Cb -0.03 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.37 3myb h GLU 193 CO -0.02 0.72 0.43 0.00 -1.18 0.00 0.00 179.01 178.96 3myb h ALA 194 N 1.41 0.83 -0.08 2.92 0.00 -0.92 0.89 119.26 124.31 3myb h ALA 194 Ca 0.21 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3myb h ALA 194 Cb 0.15 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3myb h ALA 194 CO -0.02 0.26 -0.13 1.98 0.00 0.00 0.00 179.25 181.34 3myb h MET 195 N 0.89 0.22 -0.47 0.00 1.85 -1.12 -2.79 114.93 113.52 3myb h MET 195 Ca 0.24 -0.14 0.05 0.00 -0.61 0.00 0.00 59.70 59.25 3myb h MET 195 Cb -0.10 0.01 -0.05 0.00 0.43 0.00 0.00 31.60 31.90 3myb h MET 195 CO -0.05 0.71 0.20 0.28 -0.40 0.00 0.00 176.91 177.64 3myb h VAL 196 N -0.24 0.90 -0.36 -5.77 2.07 -0.84 -2.41 116.25 109.59 3myb h VAL 196 Ca 0.01 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 3myb h VAL 196 Cb 0.69 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3myb h VAL 196 CO 0.03 0.07 0.11 0.77 0.02 0.00 0.00 177.57 178.57 3myb h SER 197 N 0.39 0.48 -0.38 0.57 4.64 -0.81 -0.34 113.55 118.10 3myb h SER 197 Ca 0.21 -0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 61.36 3myb h SER 197 Cb 0.18 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3myb h SER 197 CO -0.19 0.47 -0.20 0.11 -0.87 0.00 0.00 176.83 176.15 3myb h LYS 198 N 0.52 0.81 -0.05 4.77 1.57 -1.18 -2.82 116.57 120.19 3myb h LYS 198 Ca 0.12 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 3myb h LYS 198 Cb 0.17 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 3myb h LYS 198 CO -0.01 0.99 0.01 0.82 -0.57 0.00 0.00 179.45 180.69 3myb h ILE 199 N 0.61 1.23 0.00 1.86 2.04 -0.92 -3.15 117.51 119.18 3myb h ILE 199 Ca 0.08 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 3myb h ILE 199 Cb 0.75 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.42 3myb h ILE 199 CO 0.06 0.19 -0.04 -0.37 0.00 0.00 0.00 178.15 177.98 3myb h VAL 200 N -0.17 0.12 0.00 1.67 -1.51 -1.09 -1.53 116.25 113.74 3myb h VAL 200 Ca 0.02 -0.59 -0.06 0.00 -1.23 0.00 0.00 66.70 64.84 3myb h VAL 200 Cb 0.30 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 30.96 3myb h VAL 200 CO 0.00 0.04 -0.30 0.00 -1.23 0.00 0.00 177.57 176.08 3myb h ALA 201 N 1.96 1.21 -2.27 5.19 0.00 -1.45 -3.36 119.26 120.53 3myb h ALA 201 Ca -0.00 -0.27 -0.49 0.00 0.00 0.00 0.00 54.91 54.15 3myb h ALA 201 Cb 0.51 -0.05 0.04 0.00 0.00 0.00 0.00 17.79 18.29 3myb h ALA 201 CO 0.01 0.38 0.39 0.15 0.00 0.00 0.00 179.25 180.18 3myb s LYS 202 N -3.97 3.75 0.34 0.00 -0.14 -0.58 -4.81 119.74 114.33 3myb s LYS 202 Ca -0.02 0.88 -0.29 0.00 -1.36 0.00 0.00 55.97 55.18 3myb s LYS 202 Cb 0.13 -2.10 -0.10 0.00 -1.68 0.00 0.00 37.83 34.07 3myb s LYS 202 CO 0.67 -0.44 1.35 -2.14 -0.76 0.00 0.00 175.35 174.04 3myb s PRO 203 N -4.57 4.30 0.20 -1.68 0.02 -1.26 -4.93 135.00 127.08 3myb s PRO 203 Ca 0.57 2.30 -0.10 0.00 0.02 0.00 0.00 61.00 63.79 3myb s PRO 203 Cb -0.11 -3.05 0.22 0.00 0.02 0.00 0.00 34.50 31.58 3myb s PRO 203 CO 0.42 -0.28 1.80 -0.09 -0.33 0.00 0.00 177.00 178.52 3myb h ARG 204 N 3.36 0.59 -0.53 5.54 1.12 -1.93 -2.64 114.38 119.89 3myb h ARG 204 Ca -0.49 -0.04 0.03 0.00 -1.11 0.00 0.00 59.98 58.37 3myb h ARG 204 Cb 1.23 -0.13 -0.04 0.00 -0.01 0.00 0.00 29.97 31.02 3myb h ARG 204 CO 0.66 0.39 0.30 0.00 -3.11 0.00 0.00 179.97 178.21 3myb h ALA 205 N 1.34 0.68 -0.50 2.80 0.00 -1.95 -0.57 119.26 121.05 3myb h ALA 205 Ca 0.28 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3myb h ALA 205 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3myb h ALA 205 CO -0.19 -0.00 0.24 0.00 0.00 0.00 0.00 179.25 179.30 3myb h ALA 206 N 1.25 0.64 -0.47 0.00 0.00 -1.90 -0.91 119.26 117.88 3myb h ALA 206 Ca 0.22 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3myb h ALA 206 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3myb h ALA 206 CO -0.11 0.21 -0.15 0.28 0.00 0.00 0.00 179.25 179.47 3myb h VAL 207 N 0.66 1.27 -0.04 0.00 2.07 -1.11 -0.61 116.25 118.50 3myb h VAL 207 Ca 0.17 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 3myb h VAL 207 Cb 0.13 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3myb h VAL 207 CO -0.02 0.44 -0.00 0.00 0.02 0.00 0.00 177.57 178.01 3myb h ALA 208 N 0.87 0.06 -0.57 1.67 0.00 -0.98 0.25 119.26 120.56 3myb h ALA 208 Ca 0.11 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3myb h ALA 208 Cb 0.71 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3myb h ALA 208 CO 0.05 -0.27 0.37 0.52 0.00 0.00 0.00 179.25 179.93 3myb h MET 209 N -0.22 0.73 -0.14 0.00 2.86 -1.16 -2.59 114.93 114.41 3myb h MET 209 Ca 0.01 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3myb h MET 209 Cb 0.33 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 3myb h MET 209 CO 0.00 0.49 0.01 0.78 1.06 0.00 0.00 176.91 179.24 3myb h GLY 210 N 0.76 0.26 0.88 8.32 0.00 -0.98 -1.84 103.07 110.47 3myb h GLY 210 Ca 0.21 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.37 3myb h GLY 210 CO -0.05 0.17 0.33 1.70 0.00 0.00 0.00 176.54 178.69 3myb h LYS 211 N -0.01 0.63 -0.26 4.80 3.64 -0.93 0.11 116.57 124.56 3myb h LYS 211 Ca 0.04 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3myb h LYS 211 Cb 0.35 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 3myb h LYS 211 CO 0.01 0.42 0.15 0.00 -2.27 0.00 0.00 179.45 177.76 3myb h ALA 212 N 1.24 0.33 -0.45 5.00 0.00 -1.41 -2.73 119.26 121.23 3myb h ALA 212 Ca 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3myb h ALA 212 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3myb h ALA 212 CO -0.09 -0.17 0.25 1.25 0.00 0.00 0.00 179.25 180.49 3myb h LEU 213 N 0.32 0.56 -0.51 0.00 7.12 -1.12 -2.38 115.31 119.30 3myb h LEU 213 Ca 0.09 -0.08 0.10 0.00 0.13 0.00 0.00 57.88 58.12 3myb h LEU 213 Cb 0.02 -0.14 -0.10 0.00 -0.53 0.00 0.00 40.66 39.91 3myb h LEU 213 CO -0.02 0.48 -0.23 0.15 -0.13 0.00 0.00 178.44 178.69 3myb h PHE 214 N 0.59 -0.58 0.00 1.25 3.57 -0.48 -0.27 116.94 121.02 3myb h PHE 214 Ca 0.16 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.67 3myb h PHE 214 Cb 0.04 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 3myb h PHE 214 CO -0.02 -0.31 -0.20 1.88 -2.23 0.00 0.00 178.31 177.42 3myb h TYR 215 N -0.11 0.00 -0.23 0.41 0.05 -1.39 -2.51 116.97 113.19 3myb h TYR 215 Ca 0.24 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.93 3myb h TYR 215 Cb 0.48 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.22 3myb h TYR 215 CO -0.52 0.20 -0.19 0.00 -1.05 0.00 0.00 178.16 176.60 3myb h ARG 216 N 0.00 0.54 0.00 4.88 3.08 -0.74 -3.34 114.38 118.79 3myb h ARG 216 Ca -0.00 -0.27 -0.17 0.00 0.07 0.00 0.00 59.98 59.60 3myb h ARG 216 Cb 1.08 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 3myb h ARG 216 CO 0.03 0.85 -0.83 -0.56 -1.07 0.00 0.00 179.97 178.39 3myb h GLN 217 N 0.24 0.00 0.00 0.04 -0.00 -1.03 -3.28 115.11 111.08 3myb h GLN 217 Ca 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.68 3myb h GLN 217 Cb 0.73 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.21 3myb h GLN 217 CO 0.05 0.83 -0.04 0.97 -0.00 0.00 0.00 178.83 180.64 3myb h ILE 218 N 0.00 0.14 -0.26 1.86 2.10 -1.57 -2.68 117.51 117.10 3myb h ILE 218 Ca -0.01 -0.46 -0.11 0.00 1.08 0.00 0.00 64.86 65.37 3myb h ILE 218 Cb 1.60 1.40 -0.06 0.00 -1.09 0.00 0.00 36.82 38.66 3myb h ILE 218 CO 0.11 0.04 -0.11 -1.84 -1.08 0.00 0.00 178.15 175.27 3myb n GLU 219 N -3.20 1.96 -4.56 2.19 0.28 -1.24 -4.98 120.64 111.10 3myb n GLU 219 Ca -0.01 -3.08 -0.27 0.00 -0.16 0.00 0.00 57.16 53.64 3myb n GLU 219 Cb 0.25 -1.77 -0.08 0.00 1.43 0.00 0.00 31.44 31.28 3myb n GLU 219 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 3myb s THR 220 N -3.13 0.62 0.70 3.84 -1.32 -1.01 -5.14 115.64 110.19 3myb s THR 220 Ca 0.42 -2.00 -0.12 0.00 -1.21 0.00 0.00 61.69 58.78 3myb s THR 220 Cb 0.38 -2.27 0.01 0.00 -1.51 0.00 0.00 72.50 69.11 3myb s THR 220 CO 0.01 0.00 1.07 1.51 -2.21 0.00 0.00 174.62 175.00 3myb s ASP 221 N -3.66 5.16 0.27 8.08 1.47 -1.26 -4.82 116.67 121.90 3myb s ASP 221 Ca 0.20 1.75 -0.00 0.00 1.18 0.00 0.00 52.55 55.67 3myb s ASP 221 Cb 0.02 -2.51 0.37 0.00 -0.34 0.00 0.00 42.92 40.45 3myb s ASP 221 CO 0.13 -1.59 1.75 -0.29 0.68 0.00 0.00 175.17 175.85 3myb h ILE 222 N -0.58 1.24 -0.16 2.11 2.10 -1.99 -0.15 117.51 120.09 3myb h ILE 222 Ca -0.44 -1.06 -0.04 0.00 1.08 0.00 0.00 64.86 64.40 3myb h ILE 222 Cb 1.22 1.02 -0.00 0.00 -1.09 0.00 0.00 36.82 37.96 3myb h ILE 222 CO 0.55 0.36 -0.04 -0.08 -1.08 0.00 0.00 178.15 177.86 3myb h GLU 223 N 0.64 0.31 -0.91 2.19 4.81 -2.00 -0.68 114.58 118.95 3myb h GLU 223 Ca 0.12 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3myb h GLU 223 Cb 0.51 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 3myb h GLU 223 CO 0.03 0.58 0.58 0.77 -0.73 0.00 0.00 179.01 180.24 3myb h SER 224 N 0.01 1.06 -0.43 1.04 0.02 -1.88 -2.37 113.55 111.00 3myb h SER 224 Ca 0.04 -0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 3myb h SER 224 Cb 0.47 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 3myb h SER 224 CO 0.02 0.78 0.22 0.00 -1.14 0.00 0.00 176.83 176.71 3myb h ALA 225 N 1.32 0.54 -0.21 3.77 0.00 -0.81 -2.10 119.26 121.77 3myb h ALA 225 Ca 0.33 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 3myb h ALA 225 Cb -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3myb h ALA 225 CO -0.07 -0.13 -0.22 1.88 0.00 0.00 0.00 179.25 180.71 3myb h TYR 226 N 0.44 0.41 -0.32 0.00 0.05 -0.91 0.39 116.97 117.04 3myb h TYR 226 Ca 0.19 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.87 3myb h TYR 226 Cb 0.09 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 3myb h TYR 226 CO -0.10 0.57 0.09 0.00 -1.05 0.00 0.00 178.16 177.67 3myb h ALA 227 N 1.44 0.42 -0.21 3.88 0.00 -0.89 1.00 119.26 124.89 3myb h ALA 227 Ca 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3myb h ALA 227 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3myb h ALA 227 CO 0.04 0.06 0.03 0.22 0.00 0.00 0.00 179.25 179.61 3myb h ASP 228 N 0.35 0.33 -0.87 0.00 1.82 -1.18 -2.62 116.42 114.25 3myb h ASP 228 Ca 0.10 -0.26 0.02 0.00 -0.39 0.00 0.00 57.03 56.50 3myb h ASP 228 Cb 0.27 -0.09 -0.05 0.00 0.68 0.00 0.00 39.33 40.14 3myb h ASP 228 CO -0.00 0.50 0.57 0.00 -1.61 0.00 0.00 179.24 178.70 3myb h ALA 229 N 0.84 1.13 -0.31 -0.78 0.00 -0.79 0.15 119.26 119.49 3myb h ALA 229 Ca 0.06 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3myb h ALA 229 Cb 0.31 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3myb h ALA 229 CO 0.00 0.46 0.02 0.78 0.00 0.00 0.00 179.25 180.51 3myb h GLY 230 N 1.14 0.58 1.36 0.00 0.00 -0.77 0.13 103.07 105.51 3myb h GLY 230 Ca 0.33 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 3myb h GLY 230 CO -0.09 0.38 -0.22 0.00 0.00 0.00 0.00 176.54 176.60 3myb h THR 231 N 0.34 1.27 -0.39 4.70 1.03 -1.27 -1.02 112.91 117.57 3myb h THR 231 Ca 0.09 -1.32 -0.01 0.00 -0.01 0.00 0.00 66.41 65.16 3myb h THR 231 Cb 0.40 1.22 -0.02 0.00 -1.07 0.00 0.00 68.15 68.68 3myb h THR 231 CO 0.01 0.44 0.21 0.74 -0.01 0.00 0.00 175.52 176.91 3myb h THR 232 N 0.65 1.15 -0.16 0.00 2.02 -0.76 -1.86 112.91 113.95 3myb h THR 232 Ca 0.09 -0.40 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 3myb h THR 232 Cb 0.72 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 3myb h THR 232 CO 0.06 0.16 -0.39 -0.03 0.37 0.00 0.00 175.52 175.68 3myb h MET 233 N 0.50 0.35 -0.49 6.66 4.05 -0.48 0.60 114.93 126.12 3myb h MET 233 Ca 0.14 -0.16 -0.01 0.00 -0.28 0.00 0.00 59.70 59.38 3myb h MET 233 Cb 0.06 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.84 3myb h MET 233 CO -0.02 0.69 0.26 0.00 0.23 0.00 0.00 176.91 178.06 3myb h ALA 234 N 1.30 0.63 -0.42 0.39 0.00 -1.05 0.28 119.26 120.39 3myb h ALA 234 Ca 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3myb h ALA 234 Cb 0.82 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3myb h ALA 234 CO 0.07 0.16 0.18 0.00 0.00 0.00 0.00 179.25 179.66 3myb h ASN 236 N 0.53 1.14 0.45 0.00 -0.00 -0.65 -2.25 115.58 114.80 3myb h ASN 236 Ca 0.14 -0.03 -0.04 0.00 -0.00 0.00 0.00 56.30 56.38 3myb h ASN 236 Cb 0.16 -0.28 -0.01 0.00 -0.00 0.00 0.00 38.32 38.19 3myb h ASN 236 CO -0.01 0.82 -0.18 -0.03 -0.00 0.00 0.00 177.43 178.03 3myb h MET 237 N 1.34 0.00 -0.00 6.67 4.05 -0.76 -1.48 114.93 124.76 3myb h MET 237 Ca 0.37 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.79 3myb h MET 237 Cb -0.15 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.65 3myb h MET 237 CO -0.08 0.18 -0.06 -1.33 0.23 0.00 0.00 176.91 175.84 3myb n MET 238 N -3.70 0.83 -2.26 0.39 2.81 -0.85 -3.95 117.12 110.38 3myb n MET 238 Ca -0.02 -0.24 -0.41 0.00 -1.81 0.00 0.00 57.70 55.23 3myb n MET 238 Cb 0.29 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.28 3myb n MET 238 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3myb s ASP 239 N -2.34 6.97 0.43 7.83 2.15 -0.56 -4.90 116.67 126.25 3myb s ASP 239 Ca 0.34 2.50 0.15 0.00 0.43 0.00 0.00 52.55 55.97 3myb s ASP 239 Cb 0.21 -2.64 1.04 0.00 -0.30 0.00 0.00 42.92 41.23 3myb s ASP 239 CO 0.44 -0.39 1.94 -0.65 -0.17 0.00 0.00 175.17 176.33 3myb h PRO 240 N 3.83 0.40 0.00 4.34 0.11 -1.88 -1.52 132.00 137.29 3myb h PRO 240 Ca -0.48 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.52 3myb h PRO 240 Cb 1.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3myb h PRO 240 CO 0.68 0.27 -0.45 0.77 -0.21 0.00 0.00 178.00 179.05 3myb h SER 241 N 0.42 0.00 -0.09 -2.05 0.02 -1.92 0.18 113.55 110.11 3myb h SER 241 Ca 0.34 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.23 3myb h SER 241 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 3myb h SER 241 CO -0.10 0.45 -0.17 0.00 -1.14 0.00 0.00 176.83 175.87 3myb h ALA 242 N 1.55 0.14 -0.33 3.77 0.00 -1.55 0.34 119.26 123.18 3myb h ALA 242 Ca -0.00 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.60 3myb h ALA 242 Cb 0.87 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 3myb h ALA 242 CO 0.06 0.06 0.07 -0.07 0.00 0.00 0.00 179.25 179.36 3myb h LEU 243 N -0.18 0.01 -0.48 0.00 3.38 -1.27 0.13 115.31 116.89 3myb h LEU 243 Ca 0.00 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 3myb h LEU 243 Cb 0.75 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3myb h LEU 243 CO 0.04 0.04 -0.14 -0.08 0.09 0.00 0.00 178.44 178.39 3myb h GLU 244 N 0.18 0.95 -0.62 1.13 4.57 -0.98 -1.97 114.58 117.84 3myb h GLU 244 Ca 0.16 -0.37 -0.01 0.00 -1.18 0.00 0.00 59.36 57.96 3myb h GLU 244 Cb 0.17 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 3myb h GLU 244 CO -0.21 1.04 0.36 0.78 -1.18 0.00 0.00 179.01 179.80 3myb h GLY 245 N 0.80 0.92 0.87 1.92 0.00 0.04 0.12 103.07 107.75 3myb h GLY 245 Ca 0.12 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 3myb h GLY 245 CO 0.05 0.38 -0.14 -2.08 0.00 0.00 0.00 176.54 174.76 3myb h VAL 246 N 0.85 1.30 -0.54 4.60 2.07 -1.00 -2.54 116.25 120.99 3myb h VAL 246 Ca 0.22 -1.23 0.08 0.00 0.82 0.00 0.00 66.70 66.59 3myb h VAL 246 Cb 0.01 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3myb h VAL 246 CO -0.04 0.39 0.16 0.28 0.02 0.00 0.00 177.57 178.38 3myb h SER 247 N 0.28 0.11 -0.80 0.57 0.02 -1.15 -1.48 113.55 111.11 3myb h SER 247 Ca 0.06 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3myb h SER 247 Cb 0.65 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.24 3myb h SER 247 CO 0.04 0.08 0.48 0.00 -1.14 0.00 0.00 176.83 176.29 3myb h ALA 248 N 1.39 1.02 -0.28 3.77 0.00 -0.93 -0.49 119.26 123.74 3myb h ALA 248 Ca 0.27 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3myb h ALA 248 Cb 0.34 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3myb h ALA 248 CO -0.30 0.49 0.17 0.35 0.00 0.00 0.00 179.25 179.96 3myb h PHE 249 N 1.10 0.32 -0.07 0.00 3.57 -0.98 -0.58 116.94 120.29 3myb h PHE 249 Ca 0.29 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.76 3myb h PHE 249 Cb -0.03 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3myb h PHE 249 CO -0.00 0.19 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.09 3myb h LEU 250 N 0.35 0.10 -2.33 0.59 3.38 -0.79 -2.37 115.31 114.25 3myb h LEU 250 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3myb h LEU 250 Cb -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3myb h LEU 250 CO -0.05 0.23 0.00 -0.62 0.09 0.00 0.00 178.44 178.09 3myb n GLU 251 N -4.35 2.48 -3.70 1.13 1.02 -0.24 -4.97 120.64 112.01 3myb n GLU 251 Ca -0.02 -2.28 -0.24 0.00 -0.02 0.00 0.00 57.16 54.61 3myb n GLU 251 Cb 0.22 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.16 3myb n GLU 251 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3myb n LYS 252 N 1.38 -3.68 -4.10 3.49 5.02 -0.35 -5.00 118.16 114.91 3myb n LYS 252 Ca 0.21 0.57 -0.11 0.00 -2.02 0.00 0.00 58.31 56.97 3myb n LYS 252 Cb 0.55 -4.91 -0.08 0.00 -0.02 0.00 0.00 35.03 30.57 3myb n LYS 252 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3myb s ARG 253 N -5.94 1.28 0.33 1.97 1.70 -0.49 -5.05 118.95 112.76 3myb s ARG 253 Ca 0.14 -1.44 -0.28 0.00 -0.47 0.00 0.00 55.73 53.68 3myb s ARG 253 Cb -0.04 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.59 3myb s ARG 253 CO 0.83 -0.46 1.13 -0.98 -1.08 0.00 0.00 175.30 174.74 3myb s ARG 254 N -4.08 4.41 0.24 3.89 1.70 -1.26 -4.26 118.95 119.59 3myb s ARG 254 Ca 0.30 1.82 -0.30 0.00 -0.47 0.00 0.00 55.73 57.09 3myb s ARG 254 Cb 0.04 -2.97 -0.09 0.00 -0.57 0.00 0.00 34.95 31.36 3myb s ARG 254 CO 0.09 -0.01 1.14 -1.25 -1.08 0.00 0.00 175.30 174.19 3myb s PRO 255 N -1.83 4.58 -1.31 3.89 0.04 -1.26 -4.92 135.00 134.18 3myb s PRO 255 Ca 0.50 1.84 -0.14 0.00 0.04 0.00 0.00 61.00 63.23 3myb s PRO 255 Cb -0.31 -3.21 0.11 0.00 0.04 0.00 0.00 34.50 31.13 3myb s PRO 255 CO 0.40 0.09 1.79 0.39 0.04 0.00 0.00 177.00 179.71 3myb n GLU 256 N 1.69 3.26 0.01 4.56 1.02 -1.26 -4.69 120.64 125.22 3myb n GLU 256 Ca 0.01 -3.34 0.11 0.00 -0.02 0.00 0.00 57.16 53.92 3myb n GLU 256 Cb 0.45 -3.21 0.09 0.00 -0.02 0.00 0.00 31.44 28.74 3myb n GLU 256 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 3myb n TRP 257 N 6.24 0.11 -3.09 -0.32 8.01 -1.26 -4.96 117.44 122.16 3myb n TRP 257 Ca 0.45 0.03 -0.22 0.00 -1.31 0.00 0.00 57.50 56.44 3myb n TRP 257 Cb 0.42 -0.27 0.02 0.00 -2.01 0.00 0.00 31.31 29.47 3myb n TRP 257 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 3myb n HIS 258 N -1.67 -1.85 -4.02 -5.99 8.25 -1.26 -5.00 115.22 103.67 3myb n HIS 258 Ca 0.04 0.46 -0.25 0.00 -0.26 0.00 0.00 57.72 57.71 3myb n HIS 258 Cb 0.37 -3.83 -0.04 0.00 1.12 0.00 0.00 29.99 27.61 3myb n HIS 258 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3myb s THR 259 N -3.05 4.88 0.28 1.59 -4.23 -1.26 -5.08 115.64 108.77 3myb s THR 259 Ca 0.31 -0.98 -0.30 0.00 -1.18 0.00 0.00 61.69 59.55 3myb s THR 259 Cb -0.15 -3.54 -0.11 0.00 1.34 0.00 0.00 72.50 70.04 3myb s THR 259 CO 0.39 -0.17 1.51 -2.84 -0.54 0.00 0.00 174.62 172.97 3myb s PRO 260 N -3.38 4.20 0.00 3.99 0.02 -1.26 -4.95 135.00 133.62 3myb s PRO 260 Ca 0.33 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.79 3myb s PRO 260 Cb -0.10 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3myb s PRO 260 CO 0.26 -0.52 0.50 1.04 -0.33 0.00 0.00 177.00 177.95