#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 3.21 0.46 5.31 0.02 -1.26 -4.90 135.00 137.84 3myb s PRO 4 Ca 0.00 2.12 0.24 0.00 0.02 0.00 0.00 61.00 63.38 3myb s PRO 4 Cb 0.00 -2.24 1.09 0.00 0.02 0.00 0.00 34.50 33.36 3myb s PRO 4 CO 0.00 -1.10 1.91 -0.07 -0.33 0.00 0.00 177.00 177.41 3myb h LEU 5 N 1.49 0.00 -7.32 -5.54 3.38 -1.95 -3.42 115.31 101.94 3myb h LEU 5 Ca -0.51 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.07 3myb h LEU 5 Cb 1.29 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.65 3myb h LEU 5 CO 0.57 0.21 -0.75 -0.22 0.09 0.00 0.00 178.44 178.35 3myb s LEU 6 N -7.06 0.28 0.25 1.67 2.96 -1.26 -0.27 118.68 115.25 3myb s LEU 6 Ca -0.01 -0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 53.70 3myb s LEU 6 Cb 0.12 -0.23 -0.08 0.00 0.50 0.00 0.00 46.19 46.50 3myb s LEU 6 CO 0.63 -0.25 0.67 -0.76 -1.32 0.00 0.00 176.35 175.32 3myb s LEU 7 N 2.12 4.22 -0.06 -0.68 1.43 -0.28 -4.92 118.68 120.51 3myb s LEU 7 Ca 0.05 1.24 -0.01 0.00 -1.03 0.00 0.00 54.13 54.37 3myb s LEU 7 Cb -0.13 -3.72 0.03 0.00 0.03 0.00 0.00 46.19 42.40 3myb s LEU 7 CO -0.04 -0.06 0.01 -1.58 0.23 0.00 0.00 176.35 174.91 3myb s GLN 8 N -2.45 0.47 0.06 1.70 0.74 -1.26 -0.83 119.66 118.09 3myb s GLN 8 Ca 0.47 0.12 0.05 0.00 0.05 0.00 0.00 55.36 56.04 3myb s GLN 8 Cb -0.13 -0.80 -0.03 0.00 1.10 0.00 0.00 33.01 33.15 3myb s GLN 8 CO 0.19 -0.25 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.04 3myb s ASP 9 N 1.71 1.59 -0.04 6.67 1.01 -0.53 -5.00 116.67 122.09 3myb s ASP 9 Ca 0.00 -0.58 -0.02 0.00 0.71 0.00 0.00 52.55 52.66 3myb s ASP 9 Cb -0.13 -0.05 0.02 0.00 1.01 0.00 0.00 42.92 43.77 3myb s ASP 9 CO -0.04 -0.07 0.08 -0.60 0.21 0.00 0.00 175.17 174.76 3myb s ARG 10 N -1.61 0.07 0.36 8.23 3.52 -1.26 -0.32 118.95 127.94 3myb s ARG 10 Ca -0.02 0.18 0.02 0.00 -0.13 0.00 0.00 55.73 55.78 3myb s ARG 10 Cb -0.10 -0.06 0.07 0.00 -1.56 0.00 0.00 34.95 33.30 3myb s ARG 10 CO 0.02 -0.07 0.50 -0.40 -0.81 0.00 0.00 175.30 174.53 3myb n ASP 11 N 3.52 0.87 -0.31 -2.12 5.68 -0.84 -4.99 116.55 118.35 3myb n ASP 11 Ca -0.18 -1.68 0.09 0.00 -0.50 0.00 0.00 54.79 52.51 3myb n ASP 11 Cb 0.56 -0.30 0.42 0.00 -1.14 0.00 0.00 41.12 40.65 3myb n ASP 11 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3myb n GLU 12 N -1.88 1.40 0.00 0.11 4.71 -1.26 -3.43 120.64 120.29 3myb n GLU 12 Ca 0.09 -0.60 0.12 0.00 -0.01 0.00 0.00 57.16 56.75 3myb n GLU 12 Cb 0.32 -1.33 0.07 0.00 -1.01 0.00 0.00 31.44 29.50 3myb n GLU 12 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3myb n ARG 13 N -0.16 1.67 -0.98 3.49 1.74 -1.26 -4.96 116.66 116.20 3myb n ARG 13 Ca 0.14 -1.36 0.00 0.00 -0.77 0.00 0.00 57.85 55.86 3myb n ARG 13 Cb 0.20 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 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 1.38 0.45 3.56 -0.13 0.00 -1.22 -4.62 105.19 104.61 3myb n GLY 14 Ca 0.12 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 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 5.07 -0.20 1.61 1.01 -1.26 0.04 120.40 124.67 3myb s VAL 15 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 3myb s VAL 15 Cb 0.00 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 3myb s VAL 15 CO 0.00 -0.15 0.14 -0.69 0.00 0.00 0.00 175.10 174.41 3myb s VAL 16 N 2.26 5.40 -0.27 2.92 1.01 -0.39 -1.98 120.40 129.35 3myb s VAL 16 Ca 0.17 0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.29 3myb s VAL 16 Cb -0.16 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 3myb s VAL 16 CO 0.12 0.43 0.08 -0.89 0.00 0.00 0.00 175.10 174.85 3myb s THR 17 N 0.42 4.27 -0.25 3.92 2.01 0.56 -0.93 115.64 125.64 3myb s THR 17 Ca 0.09 -0.30 -0.09 0.00 0.31 0.00 0.00 61.69 61.69 3myb s THR 17 Cb -0.11 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 3myb s THR 17 CO -0.01 0.26 0.13 -0.76 -0.69 0.00 0.00 174.62 173.54 3myb s LEU 18 N 1.59 3.86 -0.29 4.42 1.43 -0.28 -1.45 118.68 127.96 3myb s LEU 18 Ca 0.05 -0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3myb s LEU 18 Cb -0.16 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.07 3myb s LEU 18 CO 0.04 0.02 -0.03 -0.89 0.23 0.00 0.00 176.35 175.72 3myb s THR 19 N 1.31 2.84 0.10 5.49 2.01 -0.01 -0.48 115.64 126.89 3myb s THR 19 Ca 0.06 -1.40 -0.34 0.00 0.31 0.00 0.00 61.69 60.32 3myb s THR 19 Cb -0.15 -2.62 -0.14 0.00 0.01 0.00 0.00 72.50 69.61 3myb s THR 19 CO 0.06 -0.07 1.62 0.18 -0.69 0.00 0.00 174.62 175.72 3myb n LEU 20 N 4.59 3.05 -2.74 4.42 4.77 -0.31 -1.12 117.00 129.66 3myb n LEU 20 Ca -0.14 1.06 -0.17 0.00 -0.03 0.00 0.00 56.01 56.74 3myb n LEU 20 Cb 0.43 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 3myb n LEU 20 CO 0.25 -0.30 -0.03 -3.20 -1.33 0.00 0.00 177.39 172.78 3myb n ASN 21 N 3.97 2.49 -3.31 -1.43 5.15 0.63 -0.91 115.26 121.85 3myb n ASN 21 Ca 0.18 -3.13 -0.27 0.00 -0.60 0.00 0.00 54.58 50.77 3myb n ASN 21 Cb 0.28 -0.53 -0.07 0.00 -0.53 0.00 0.00 39.78 38.93 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 -0.12 2.49 -0.09 1.20 1.74 -1.26 -4.49 116.66 116.12 3myb n ARG 22 Ca 0.22 -4.57 0.04 0.00 -0.77 0.00 0.00 57.85 52.77 3myb n ARG 22 Cb 0.70 -2.16 0.37 0.00 -1.02 0.00 0.00 32.46 30.36 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 3.91 0.67 0.00 5.56 0.13 -1.88 0.17 132.00 140.57 3myb h PRO 23 Ca 0.17 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.17 3myb h PRO 23 Cb 0.66 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 3myb h PRO 23 CO 0.80 0.44 -0.43 1.96 -0.23 0.00 0.00 178.00 180.54 3myb h GLN 24 N 0.69 0.00 -0.51 0.86 1.08 -1.94 -2.78 115.11 112.51 3myb h GLN 24 Ca 0.22 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.42 3myb h GLN 24 Cb 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 3myb h GLN 24 CO -0.06 0.43 0.00 0.00 -0.95 0.00 0.00 178.83 178.26 3myb n ALA 25 N -2.23 2.60 -3.35 3.87 0.00 -0.53 -4.91 120.51 115.96 3myb n ALA 25 Ca 0.02 -0.86 -0.24 0.00 0.00 0.00 0.00 53.44 52.35 3myb n ALA 25 Cb 0.66 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 19.17 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 0.74 -2.21 -2.60 0.00 3.72 -0.81 -2.53 117.46 113.78 3myb n PHE 26 Ca 0.15 0.69 -0.19 0.00 -0.05 0.00 0.00 57.45 58.05 3myb n PHE 26 Cb 0.46 -4.31 0.00 0.00 -0.94 0.00 0.00 39.48 34.70 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 -2.65 -5.24 -4.69 4.37 3.02 0.48 -1.08 115.26 109.47 3myb n ASN 27 Ca -0.04 -0.03 -0.39 0.00 -0.03 0.00 0.00 54.58 54.08 3myb n ASN 27 Cb 0.58 -4.35 0.03 0.00 -0.61 0.00 0.00 39.78 35.43 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 -2.47 1.04 -1.97 5.41 0.00 -1.05 -4.53 120.51 116.94 3myb n ALA 28 Ca -0.18 0.15 -0.42 0.00 0.00 0.00 0.00 53.44 52.99 3myb n ALA 28 Cb 0.64 -2.25 -0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 -0.45 7.12 -4.46 0.00 4.77 0.81 -4.79 117.00 120.01 3myb n LEU 29 Ca 0.10 -4.46 -0.28 0.00 -0.03 0.00 0.00 56.01 51.34 3myb n LEU 29 Cb 0.43 -1.54 0.27 0.00 -2.33 0.00 0.00 43.42 40.25 3myb n LEU 29 CO 0.54 1.43 0.50 -0.94 -1.33 0.00 0.00 177.39 177.59 3myb s SER 30 N 1.79 0.63 0.23 -1.43 1.04 -1.26 -3.92 113.70 110.78 3myb s SER 30 Ca 0.47 1.47 -0.07 0.00 0.48 0.00 0.00 55.95 58.30 3myb s SER 30 Cb 0.13 -2.28 0.26 0.00 0.10 0.00 0.00 66.02 64.24 3myb s SER 30 CO -0.05 -4.41 1.87 -0.33 0.98 0.00 0.00 173.24 171.31 3myb h GLU 31 N -2.77 1.03 -0.18 4.02 4.39 -1.96 -0.24 114.58 118.86 3myb h GLU 31 Ca -0.63 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 58.89 3myb h GLU 31 Cb 1.34 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 3myb h GLU 31 CO 0.50 0.68 -0.42 0.00 -1.16 0.00 0.00 179.01 178.61 3myb h ALA 32 N 1.36 0.95 -0.34 3.43 0.00 -1.98 -0.40 119.26 122.28 3myb h ALA 32 Ca 0.34 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3myb h ALA 32 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3myb h ALA 32 CO -0.12 0.63 -0.06 1.98 0.00 0.00 0.00 179.25 181.68 3myb h MET 33 N 0.35 0.64 -0.93 0.00 1.85 -1.72 -1.27 114.93 113.85 3myb h MET 33 Ca 0.03 -0.24 -0.00 0.00 -0.61 0.00 0.00 59.70 58.88 3myb h MET 33 Cb 0.88 -0.04 -0.05 0.00 0.43 0.00 0.00 31.60 32.82 3myb h MET 33 CO 0.07 0.80 0.57 -0.07 -0.40 0.00 0.00 176.91 177.88 3myb h LEU 34 N 0.43 1.12 -0.46 3.39 3.38 -0.84 -0.69 115.31 121.65 3myb h LEU 34 Ca 0.09 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3myb h LEU 34 Cb 0.55 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3myb h LEU 34 CO 0.03 0.86 0.18 0.00 0.09 0.00 0.00 178.44 179.59 3myb h ALA 35 N 1.31 0.59 -0.35 1.53 0.00 -0.85 0.26 119.26 121.76 3myb h ALA 35 Ca 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3myb h ALA 35 Cb -0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3myb h ALA 35 CO -0.06 0.21 0.22 0.00 0.00 0.00 0.00 179.25 179.61 3myb h ALA 36 N 1.02 0.44 -0.55 0.00 0.00 -0.95 -1.04 119.26 118.19 3myb h ALA 36 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3myb h ALA 36 Cb 0.21 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3myb h ALA 36 CO -0.01 -0.08 0.33 -0.07 0.00 0.00 0.00 179.25 179.42 3myb h LEU 37 N 0.46 0.66 -0.32 0.00 3.38 -0.95 -1.11 115.31 117.43 3myb h LEU 37 Ca 0.13 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.07 3myb h LEU 37 Cb -0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3myb h LEU 37 CO -0.03 0.53 0.13 1.23 0.09 0.00 0.00 178.44 180.39 3myb h GLY 38 N 0.74 0.42 1.06 0.83 0.00 -0.66 -0.87 103.07 104.59 3myb h GLY 38 Ca 0.20 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.36 3myb h GLY 38 CO -0.04 0.05 0.06 -2.09 0.00 0.00 0.00 176.54 174.52 3myb h GLU 39 N 0.28 1.05 -0.07 4.80 4.22 -1.08 -0.31 114.58 123.47 3myb h GLU 39 Ca 0.14 -0.30 -0.01 0.00 0.08 0.00 0.00 59.36 59.27 3myb h GLU 39 Cb 0.10 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3myb h GLU 39 CO -0.13 1.00 0.01 0.00 -2.18 0.00 0.00 179.01 177.71 3myb h ALA 40 N 1.01 0.09 -0.41 2.92 0.00 -0.87 -0.83 119.26 121.17 3myb h ALA 40 Ca 0.18 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3myb h ALA 40 Cb 0.49 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3myb h ALA 40 CO 0.02 -0.28 -0.10 0.74 0.00 0.00 0.00 179.25 179.63 3myb h PHE 41 N -0.12 0.79 -0.66 0.00 0.04 -1.18 -1.11 116.94 114.69 3myb h PHE 41 Ca 0.02 -0.14 0.05 0.00 2.80 0.00 0.00 57.97 60.70 3myb h PHE 41 Cb 0.26 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.16 3myb h PHE 41 CO 0.01 0.79 0.38 0.78 -0.60 0.00 0.00 178.31 179.68 3myb h GLY 42 N 0.97 0.96 0.87 -1.45 0.00 -0.86 -0.94 103.07 102.63 3myb h GLY 42 Ca 0.11 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 3myb h GLY 42 CO 0.03 0.19 -0.08 -0.84 0.00 0.00 0.00 176.54 175.85 3myb h THR 43 N 0.72 1.29 -0.35 4.70 2.02 -0.84 -3.15 112.91 117.30 3myb h THR 43 Ca 0.29 -1.12 -0.04 0.00 0.77 0.00 0.00 66.41 66.30 3myb h THR 43 Cb 0.13 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3myb h THR 43 CO -0.15 0.35 0.03 -0.07 0.37 0.00 0.00 175.52 176.05 3myb h LEU 44 N 0.29 0.49 -1.98 2.58 3.38 -1.02 -2.67 115.31 116.38 3myb h LEU 44 Ca 0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3myb h LEU 44 Cb 0.57 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3myb h LEU 44 CO 0.03 0.54 -0.10 0.00 0.09 0.00 0.00 178.44 179.00 3myb h ALA 45 N 1.53 1.47 -0.01 1.53 0.00 -1.13 -1.93 119.26 120.71 3myb h ALA 45 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3myb h ALA 45 Cb 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3myb h ALA 45 CO 0.01 0.13 -0.07 0.39 0.00 0.00 0.00 179.25 179.71 3myb n GLU 46 N -3.89 1.47 -3.62 0.00 -0.58 -1.01 -4.79 120.64 108.23 3myb n GLU 46 Ca -0.02 -0.86 -0.40 0.00 -0.42 0.00 0.00 57.16 55.46 3myb n GLU 46 Cb 0.20 -1.48 -0.10 0.00 -0.57 0.00 0.00 31.44 29.49 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 -2.13 5.58 0.14 1.62 -1.08 -0.73 -4.95 116.67 115.12 3myb s ASP 47 Ca 0.34 -1.79 0.19 0.00 -0.52 0.00 0.00 52.55 50.77 3myb s ASP 47 Cb 0.21 -1.96 0.80 0.00 -1.46 0.00 0.00 42.92 40.50 3myb s ASP 47 CO 0.38 -0.61 1.58 -0.62 0.52 0.00 0.00 175.17 176.42 3myb n GLU 48 N 4.85 0.10 0.06 4.34 1.02 -1.26 -2.31 120.64 127.43 3myb n GLU 48 Ca -0.08 0.35 0.13 0.00 -0.02 0.00 0.00 57.16 57.55 3myb n GLU 48 Cb 0.42 -1.70 0.47 0.00 -0.02 0.00 0.00 31.44 30.61 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 -1.89 0.47 -4.70 1.62 3.41 -1.26 -4.81 113.62 106.46 3myb n SER 49 Ca 0.03 0.48 -0.42 0.00 -0.26 0.00 0.00 58.87 58.69 3myb n SER 49 Cb 0.19 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 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 -3.06 3.59 -0.15 -3.33 1.01 -0.98 -4.62 120.40 112.86 3myb s VAL 50 Ca 0.12 1.06 0.17 0.00 0.00 0.00 0.00 61.98 63.33 3myb s VAL 50 Cb 0.15 -3.68 -0.25 0.00 0.00 0.00 0.00 36.38 32.61 3myb s VAL 50 CO 0.58 0.03 0.15 0.54 0.00 0.00 0.00 175.10 176.41 3myb n ARG 51 N 4.76 0.91 -3.54 2.72 5.12 0.11 -4.76 116.66 121.96 3myb n ARG 51 Ca 0.12 -0.05 -0.11 0.00 -1.93 0.00 0.00 57.85 55.89 3myb n ARG 51 Cb 0.43 -1.47 -0.04 0.00 -1.16 0.00 0.00 32.46 30.22 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 -2.66 -1.87 -0.08 7.54 0.00 -1.20 -4.26 121.76 119.24 3myb s ALA 52 Ca -0.09 1.35 0.03 0.00 0.00 0.00 0.00 51.96 53.26 3myb s ALA 52 Cb 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.97 3myb s ALA 52 CO 0.77 -0.45 -0.18 0.08 0.00 0.00 0.00 175.76 175.98 3myb s VAL 53 N -1.82 1.58 -0.24 0.00 1.01 -0.30 -1.27 120.40 119.36 3myb s VAL 53 Ca -0.01 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 3myb s VAL 53 Cb -0.01 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 3myb s VAL 53 CO -0.01 0.45 0.11 -0.69 0.00 0.00 0.00 175.10 174.97 3myb s VAL 54 N 0.43 4.84 -0.46 2.92 1.01 -0.11 -0.79 120.40 128.24 3myb s VAL 54 Ca -0.15 0.00 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 3myb s VAL 54 Cb -0.16 -3.26 0.07 0.00 0.00 0.00 0.00 36.38 33.03 3myb s VAL 54 CO 0.06 0.34 0.37 -0.22 0.00 0.00 0.00 175.10 175.65 3myb s LEU 55 N 1.29 5.54 0.00 3.92 2.96 0.06 -1.13 118.68 131.34 3myb s LEU 55 Ca 0.06 -1.34 0.04 0.00 -0.22 0.00 0.00 54.13 52.67 3myb s LEU 55 Cb -0.15 -2.16 0.04 0.00 0.50 0.00 0.00 46.19 44.42 3myb s LEU 55 CO 0.05 -0.62 0.29 0.00 -1.32 0.00 0.00 176.35 174.75 3myb n ALA 56 N 5.16 0.73 -3.51 5.97 0.00 0.37 -0.86 120.51 128.37 3myb n ALA 56 Ca -0.12 -2.24 -0.14 0.00 0.00 0.00 0.00 53.44 50.93 3myb n ALA 56 Cb 0.44 1.01 -0.08 0.00 0.00 0.00 0.00 19.45 20.82 3myb n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3myb s ALA 57 N -2.82 -1.54 0.52 0.00 0.00 -1.26 -1.17 121.76 115.50 3myb s ALA 57 Ca 0.22 1.61 -0.13 0.00 0.00 0.00 0.00 51.96 53.66 3myb s ALA 57 Cb -0.02 -0.79 -0.06 0.00 0.00 0.00 0.00 23.12 22.24 3myb s ALA 57 CO 0.14 -0.31 0.95 -1.54 0.00 0.00 0.00 175.76 175.00 3myb s SER 58 N -0.01 6.49 0.32 0.00 1.04 -0.09 -4.91 113.70 116.53 3myb s SER 58 Ca -0.03 1.42 0.00 0.00 0.48 0.00 0.00 55.95 57.82 3myb s SER 58 Cb -0.04 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.63 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 -1.87 -0.68 0.14 7.32 0.00 -1.26 -4.28 105.19 104.57 3myb n GLY 59 Ca 0.05 -1.15 0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 -6.22 1.61 5.09 -1.93 -3.46 116.57 111.66 3myb h LYS 60 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 60.65 60.18 3myb h LYS 60 Cb 0.00 0.00 -0.07 0.00 0.10 0.00 0.00 32.23 32.26 3myb h LYS 60 CO 0.00 0.49 -0.57 0.00 -2.09 0.00 0.00 179.45 177.28 3myb s ALA 61 N -2.98 3.50 -0.02 0.07 0.00 -1.26 -4.35 121.76 116.72 3myb s ALA 61 Ca 0.04 -1.30 -0.05 0.00 0.00 0.00 0.00 51.96 50.65 3myb s ALA 61 Cb 0.08 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 3myb s ALA 61 CO 0.74 0.44 0.38 0.35 0.00 0.00 0.00 175.76 177.67 3myb h PHE 62 N 2.24 -0.18 -1.66 0.00 3.57 -1.33 -3.41 116.94 116.16 3myb h PHE 62 Ca -0.48 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.12 3myb h PHE 62 Cb 1.21 0.06 -0.22 0.00 2.79 0.00 0.00 35.95 39.79 3myb h PHE 62 CO 0.59 -0.11 0.07 0.00 -2.23 0.00 0.00 178.31 176.62 3myb n ALA 64 N 4.85 2.17 0.00 0.00 0.00 -0.24 -1.31 120.51 125.97 3myb n ALA 64 Ca -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3myb n ALA 64 Cb 0.53 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 1.05 -0.13 3.67 0.00 0.00 -1.12 -4.56 105.19 104.10 3myb n GLY 65 Ca 0.07 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 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 1.13 -2.73 1.61 8.25 -1.26 -0.13 115.22 122.08 3myb n HIS 66 Ca 0.00 0.40 -0.42 0.00 -0.26 0.00 0.00 57.72 57.44 3myb n HIS 66 Cb 0.00 -2.10 -0.04 0.00 1.12 0.00 0.00 29.99 28.97 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 -1.98 6.27 0.20 0.41 -1.08 -1.25 -4.60 116.67 114.63 3myb s ASP 67 Ca 0.73 -0.48 -0.05 0.00 -0.52 0.00 0.00 52.55 52.23 3myb s ASP 67 Cb -0.30 -2.48 0.15 0.00 -1.46 0.00 0.00 42.92 38.83 3myb s ASP 67 CO 0.50 -1.48 1.61 -0.07 0.52 0.00 0.00 175.17 176.26 3myb h LEU 68 N 11.74 0.82 -0.34 -1.34 3.38 -1.97 -1.12 115.31 126.48 3myb h LEU 68 Ca -0.27 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.40 3myb h LEU 68 Cb 1.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3myb h LEU 68 CO 1.18 1.03 0.22 0.50 0.09 0.00 0.00 178.44 181.46 3myb h LYS 69 N 0.70 0.45 -0.17 1.13 3.64 -1.99 -1.27 116.57 119.06 3myb h LYS 69 Ca 0.09 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 3myb h LYS 69 Cb 0.76 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 3myb h LYS 69 CO 0.06 0.30 -0.04 1.49 -2.27 0.00 0.00 179.45 178.98 3myb h GLU 70 N 0.46 0.33 0.00 1.90 4.81 -1.93 -3.22 114.58 116.94 3myb h GLU 70 Ca 0.12 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 3myb h GLU 70 Cb -0.05 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3myb h GLU 70 CO -0.03 0.60 -0.44 0.00 -0.73 0.00 0.00 179.01 178.41 3myb h MET 71 N 0.03 0.00 0.00 1.92 -0.00 -1.03 -2.90 114.93 112.95 3myb h MET 71 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.74 3myb h MET 71 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.08 3myb h MET 71 CO 0.02 0.44 0.00 -0.09 -0.00 0.00 0.00 176.91 177.28 3myb h ARG 72 N 0.00 0.00 -0.46 -0.10 9.65 -1.26 -3.38 114.38 118.83 3myb h ARG 72 Ca -0.00 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 58.82 3myb h ARG 72 Cb 0.92 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 3myb h ARG 72 CO 0.06 0.00 0.06 0.00 2.80 0.00 0.00 179.97 182.88 3myb h ALA 73 N 2.31 0.61 -2.58 2.80 0.00 -1.52 -3.36 119.26 117.53 3myb h ALA 73 Ca 0.00 -0.24 -0.60 0.00 0.00 0.00 0.00 54.91 54.07 3myb h ALA 73 Cb 0.69 -0.17 -0.39 0.00 0.00 0.00 0.00 17.79 17.92 3myb h ALA 73 CO 0.00 0.36 -0.87 -1.21 0.00 0.00 0.00 179.25 177.53 3myb s GLU 74 N -5.14 1.19 0.06 0.00 0.41 -1.26 -5.12 118.70 108.84 3myb s GLU 74 Ca -0.13 -2.25 -0.31 0.00 -0.41 0.00 0.00 54.97 51.88 3myb s GLU 74 Cb 0.11 -1.86 -0.05 0.00 -1.78 0.00 0.00 34.13 30.55 3myb s GLU 74 CO 0.80 -1.33 1.18 -1.25 -0.49 0.00 0.00 175.26 174.16 3myb s PRO 75 N -0.09 4.45 0.02 0.39 0.04 -1.26 -4.95 135.00 133.59 3myb s PRO 75 Ca 0.28 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 62.83 3myb s PRO 75 Cb -0.03 -3.35 0.05 0.00 0.04 0.00 0.00 34.50 31.21 3myb s PRO 75 CO -0.15 -0.23 0.52 -1.54 0.04 0.00 0.00 177.00 175.64 3myb s SER 76 N 1.01 -0.44 0.17 6.66 1.04 -1.26 -5.04 113.70 115.84 3myb s SER 76 Ca 0.58 0.27 -0.15 0.00 0.48 0.00 0.00 55.95 57.13 3myb s SER 76 Cb -0.29 0.47 0.10 0.00 0.10 0.00 0.00 66.02 66.41 3myb s SER 76 CO 0.29 -0.65 1.77 -0.09 0.98 0.00 0.00 173.24 175.54 3myb h ARG 77 N 3.01 0.37 -0.56 4.02 9.65 -2.00 -2.08 114.38 126.79 3myb h ARG 77 Ca -0.30 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.55 3myb h ARG 77 Cb 1.19 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 29.66 3myb h ARG 77 CO 0.41 0.24 0.32 1.49 2.80 0.00 0.00 179.97 185.23 3myb h GLU 78 N 0.38 0.78 -0.06 0.20 4.81 -1.99 0.00 114.58 118.71 3myb h GLU 78 Ca 0.19 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3myb h GLU 78 Cb 0.14 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3myb h GLU 78 CO -0.17 0.59 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.77 3myb h TYR 79 N 0.76 -0.04 -0.56 0.92 3.20 -1.84 -1.55 116.97 117.86 3myb h TYR 79 Ca 0.20 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.97 3myb h TYR 79 Cb 0.03 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3myb h TYR 79 CO -0.02 -0.03 -0.05 1.88 -1.64 0.00 0.00 178.16 178.31 3myb h TYR 80 N -0.00 1.11 -0.44 -3.82 0.05 -1.06 -0.53 116.97 112.27 3myb h TYR 80 Ca 0.03 -0.20 0.06 0.00 0.05 0.00 0.00 58.73 58.66 3myb h TYR 80 Cb 0.05 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 37.45 3myb h TYR 80 CO -0.12 1.01 0.16 0.93 -1.05 0.00 0.00 178.16 179.08 3myb h GLU 81 N 0.91 0.32 -0.37 4.88 4.39 -0.77 -0.28 114.58 123.66 3myb h GLU 81 Ca 0.16 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.75 3myb h GLU 81 Cb 0.60 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 3myb h GLU 81 CO 0.04 0.21 -0.10 0.87 -1.16 0.00 0.00 179.01 178.87 3myb h LYS 82 N 0.33 0.72 -0.06 2.33 1.79 -1.03 -1.06 116.57 119.59 3myb h LYS 82 Ca 0.21 -0.28 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3myb h LYS 82 Cb 0.20 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.81 3myb h LYS 82 CO -0.21 0.88 0.03 1.25 -1.08 0.00 0.00 179.45 180.32 3myb h LEU 83 N 0.52 0.08 -0.79 2.94 5.85 -0.79 -0.17 115.31 122.95 3myb h LEU 83 Ca 0.09 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3myb h LEU 83 Cb 0.62 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3myb h LEU 83 CO 0.04 0.15 -0.23 -0.26 -0.34 0.00 0.00 178.44 177.80 3myb h PHE 84 N 0.00 0.75 -0.78 1.25 0.04 -1.04 -1.46 116.94 115.69 3myb h PHE 84 Ca 0.02 -0.16 -0.03 0.00 2.80 0.00 0.00 57.97 60.60 3myb h PHE 84 Cb 0.09 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 3myb h PHE 84 CO -0.04 0.83 0.36 0.00 -0.60 0.00 0.00 178.31 178.87 3myb h ALA 85 N 1.17 1.16 -0.25 2.45 0.00 -0.98 -0.41 119.26 122.40 3myb h ALA 85 Ca 0.08 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3myb h ALA 85 Cb 0.70 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3myb h ALA 85 CO 0.05 0.63 -0.35 0.07 0.00 0.00 0.00 179.25 179.65 3myb h ARG 86 N 1.12 0.54 -0.29 0.00 -0.00 -0.53 0.30 114.38 115.52 3myb h ARG 86 Ca 0.27 -0.25 -0.01 0.00 -0.00 0.00 0.00 59.98 59.99 3myb h ARG 86 Cb 0.13 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 30.08 3myb h ARG 86 CO -0.03 0.81 0.14 0.00 -0.00 0.00 0.00 179.97 180.89 3myb h THR 88 N 0.33 1.06 -0.95 0.00 2.02 -0.77 -1.45 112.91 113.15 3myb h THR 88 Ca 0.10 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 3myb h THR 88 Cb 0.12 -0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 66.32 3myb h THR 88 CO -0.01 0.21 0.58 0.44 0.37 0.00 0.00 175.52 177.10 3myb h ASP 89 N 1.13 1.14 -0.68 4.18 3.32 -0.60 0.88 116.42 125.77 3myb h ASP 89 Ca 0.44 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.34 3myb h ASP 89 Cb 0.21 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 3myb h ASP 89 CO -0.19 0.86 0.12 0.58 -1.72 0.00 0.00 179.24 178.90 3myb h VAL 90 N 1.31 1.26 -0.21 -1.35 2.07 -0.92 -0.89 116.25 117.53 3myb h VAL 90 Ca 0.34 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3myb h VAL 90 Cb -0.07 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3myb h VAL 90 CO -0.07 0.39 -0.03 0.24 0.02 0.00 0.00 177.57 178.12 3myb h MET 91 N 1.06 0.39 -0.15 1.57 2.86 -0.46 -1.87 114.93 118.33 3myb h MET 91 Ca 0.21 -0.14 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 3myb h MET 91 Cb 0.43 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 3myb h MET 91 CO 0.01 0.62 -0.28 -0.07 1.06 0.00 0.00 176.91 178.25 3myb h LEU 92 N 0.12 0.27 -1.13 1.22 3.38 -0.80 -2.60 115.31 115.77 3myb h LEU 92 Ca 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3myb h LEU 92 Cb 0.47 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3myb h LEU 92 CO 0.02 0.55 0.37 0.00 0.09 0.00 0.00 178.44 179.47 3myb h ALA 93 N 1.47 1.33 -0.08 1.53 0.00 -0.70 0.24 119.26 123.04 3myb h ALA 93 Ca 0.04 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.85 3myb h ALA 93 Cb 0.62 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3myb h ALA 93 CO 0.05 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 180.61 3myb h ILE 94 N 0.98 0.86 0.00 0.00 2.04 -0.99 -1.01 117.51 119.39 3myb h ILE 94 Ca 0.25 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.06 3myb h ILE 94 Cb 0.05 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 3myb h ILE 94 CO -0.04 0.00 -0.24 -0.61 0.00 0.00 0.00 178.15 177.26 3myb h GLN 95 N -0.04 0.00 -0.02 2.37 4.15 -1.15 -2.92 115.11 117.50 3myb h GLN 95 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.47 3myb h GLN 95 Cb 0.11 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.80 3myb h GLN 95 CO -0.11 0.24 -0.23 0.54 -1.93 0.00 0.00 178.83 177.34 3myb n ARG 96 N -3.48 1.43 -1.90 1.69 1.74 0.04 -4.94 116.66 111.25 3myb n ARG 96 Ca -0.00 -1.05 -0.41 0.00 -0.77 0.00 0.00 57.85 55.61 3myb n ARG 96 Cb 0.41 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.36 3myb n ARG 96 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3myb s LEU 97 N -2.30 4.36 -0.05 0.55 2.96 -0.40 -4.88 118.68 118.93 3myb s LEU 97 Ca 0.26 2.87 0.00 0.00 -0.22 0.00 0.00 54.13 57.04 3myb s LEU 97 Cb 0.19 -3.64 0.07 0.00 0.50 0.00 0.00 46.19 43.31 3myb s LEU 97 CO 0.46 -0.79 1.18 -0.81 -1.32 0.00 0.00 176.35 175.07 3myb n PRO 98 N 1.55 1.13 -3.94 0.98 -0.05 -1.26 -4.68 135.00 128.73 3myb n PRO 98 Ca 0.05 -0.32 -0.10 0.00 -0.05 0.00 0.00 63.50 63.08 3myb n PRO 98 Cb 0.39 -1.12 -0.11 0.00 -0.05 0.00 0.00 33.50 32.61 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 -0.35 -0.03 0.47 0.55 0.00 -1.26 -4.46 121.76 116.68 3myb s ALA 99 Ca 0.06 -0.43 -0.24 0.00 0.00 0.00 0.00 51.96 51.35 3myb s ALA 99 Cb 0.05 0.13 -0.07 0.00 0.00 0.00 0.00 23.12 23.23 3myb s ALA 99 CO 0.01 -0.17 1.36 -2.14 0.00 0.00 0.00 175.76 174.82 3myb s PRO 100 N -1.40 3.60 -0.17 0.00 0.02 -1.26 -4.81 135.00 130.97 3myb s PRO 100 Ca -0.15 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.13 3myb s PRO 100 Cb -0.09 -2.54 0.01 0.00 0.02 0.00 0.00 34.50 31.90 3myb s PRO 100 CO -0.00 -0.83 -0.17 0.08 -0.33 0.00 0.00 177.00 175.75 3myb s VAL 101 N -1.27 2.36 -0.21 3.83 1.01 -1.26 -1.15 120.40 123.71 3myb s VAL 101 Ca 0.63 -0.85 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 3myb s VAL 101 Cb -0.40 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3myb s VAL 101 CO 0.50 0.52 -0.04 -0.63 0.00 0.00 0.00 175.10 175.46 3myb s ILE 102 N 1.13 3.51 0.02 2.22 1.01 0.03 -1.32 121.20 127.80 3myb s ILE 102 Ca 0.01 -0.46 -0.28 0.00 0.00 0.00 0.00 60.65 59.93 3myb s ILE 102 Cb -0.14 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.70 3myb s ILE 102 CO -0.07 0.43 0.88 0.00 0.00 0.00 0.00 174.94 176.18 3myb s ALA 103 N 1.26 3.26 -0.53 9.38 0.00 -0.12 -0.76 121.76 134.24 3myb s ALA 103 Ca 0.03 0.41 -0.12 0.00 0.00 0.00 0.00 51.96 52.29 3myb s ALA 103 Cb -0.14 -3.18 0.13 0.00 0.00 0.00 0.00 23.12 19.93 3myb s ALA 103 CO -0.01 -0.10 0.44 0.50 0.00 0.00 0.00 175.76 176.59 3myb s ARG 104 N 0.52 2.75 -0.41 0.00 3.52 -0.04 -1.31 118.95 123.97 3myb s ARG 104 Ca 0.45 -1.83 -0.08 0.00 -0.13 0.00 0.00 55.73 54.14 3myb s ARG 104 Cb -0.21 -4.09 0.08 0.00 -1.56 0.00 0.00 34.95 29.17 3myb s ARG 104 CO 0.25 -1.25 0.23 0.08 -0.81 0.00 0.00 175.30 173.81 3myb s VAL 105 N 1.31 4.09 -1.75 7.11 1.01 -0.15 -4.54 120.40 127.47 3myb s VAL 105 Ca 0.06 -1.43 0.15 0.00 0.00 0.00 0.00 61.98 60.76 3myb s VAL 105 Cb -0.26 -3.50 0.15 0.00 0.00 0.00 0.00 36.38 32.77 3myb s VAL 105 CO -0.00 -0.48 1.01 0.00 0.00 0.00 0.00 175.10 175.63 3myb n HIS 106 N 4.87 0.08 -2.45 5.22 -0.00 -1.26 -1.33 115.22 120.35 3myb n HIS 106 Ca -0.10 -0.07 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 3myb n HIS 106 Cb 0.43 -0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.42 3myb n HIS 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3myb n GLY 107 N 0.83 2.45 3.78 -1.39 0.00 -1.26 -4.55 105.19 105.04 3myb n GLY 107 Ca 0.09 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.90 2.20 -0.25 -0.61 -5.25 -1.26 -3.97 121.20 109.16 3myb s ILE 108 Ca 0.00 0.20 0.00 0.00 -0.99 0.00 0.00 60.65 59.86 3myb s ILE 108 Cb 0.00 -3.13 0.07 0.00 2.95 0.00 0.00 42.46 42.35 3myb s ILE 108 CO 0.00 0.05 0.00 0.00 -1.79 0.00 0.00 174.94 173.20 3myb s ALA 109 N -1.08 1.78 0.00 2.27 0.00 -0.29 -1.30 121.76 123.14 3myb s ALA 109 Ca 0.52 -1.40 0.07 0.00 0.00 0.00 0.00 51.96 51.15 3myb s ALA 109 Cb -0.45 -1.47 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 3myb s ALA 109 CO 0.60 -1.33 -0.20 0.95 0.00 0.00 0.00 175.76 175.78 3myb s THR 110 N 1.48 1.62 0.00 0.00 -4.23 -0.43 -1.66 115.64 112.43 3myb s THR 110 Ca -0.00 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 3myb s THR 110 Cb -0.18 -1.37 0.00 0.00 1.34 0.00 0.00 72.50 72.29 3myb s THR 110 CO -0.10 0.38 0.00 0.00 -0.54 0.00 0.00 174.62 174.36 3myb n ALA 111 N 2.36 0.00 0.29 3.99 0.00 0.17 -0.68 120.51 126.64 3myb n ALA 111 Ca -0.16 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.45 3myb n ALA 111 Cb 0.53 0.00 0.83 0.00 0.00 0.00 0.00 19.45 20.81 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 -0.93 1.00 -0.18 0.00 0.00 -1.90 -0.41 119.26 116.84 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 -0.46 0.78 0.00 0.00 0.00 179.25 179.57 3myb h GLY 113 N 0.77 0.50 1.04 0.00 0.00 -1.06 -0.89 103.07 103.43 3myb h GLY 113 Ca 0.00 -0.52 -0.16 0.00 0.00 0.00 0.00 47.33 46.65 3myb h GLY 113 CO 0.00 0.47 -0.45 0.00 0.00 0.00 0.00 176.54 176.56 3myb h GLN 115 N 0.49 0.24 -0.42 0.00 4.15 -1.05 -1.59 115.11 116.93 3myb h GLN 115 Ca 0.02 -0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.48 3myb h GLN 115 Cb 1.05 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.64 3myb h GLN 115 CO 0.10 0.16 0.13 -0.07 -1.93 0.00 0.00 178.83 177.23 3myb h LEU 116 N 0.25 0.12 -0.32 -2.39 3.38 -1.08 -0.03 115.31 115.24 3myb h LEU 116 Ca 0.36 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.40 3myb h LEU 116 Cb 0.57 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3myb h LEU 116 CO -0.46 0.10 0.17 0.58 0.09 0.00 0.00 178.44 178.92 3myb h VAL 117 N 0.29 1.00 -0.05 1.22 2.07 -1.35 -1.47 116.25 117.95 3myb h VAL 117 Ca 0.20 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 3myb h VAL 117 Cb 0.21 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 3myb h VAL 117 CO -0.22 0.06 -0.14 0.00 0.02 0.00 0.00 177.57 177.29 3myb h ALA 118 N 1.16 1.67 0.00 1.67 0.00 -0.78 -2.73 119.26 120.25 3myb h ALA 118 Ca 0.13 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 3myb h ALA 118 Cb 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3myb h ALA 118 CO -0.08 0.24 -0.92 0.52 0.00 0.00 0.00 179.25 179.02 3myb h MET 119 N 0.08 0.00 -7.04 0.00 2.07 -0.59 -3.46 114.93 105.99 3myb h MET 119 Ca 0.02 0.00 -0.55 0.00 -2.07 0.00 0.00 59.70 57.10 3myb h MET 119 Cb 0.30 0.00 0.14 0.00 -1.87 0.00 0.00 31.60 30.16 3myb h MET 119 CO 0.02 0.81 0.63 0.00 1.07 0.00 0.00 176.91 179.44 3myb h ASP 121 N 1.56 0.54 -5.20 0.00 3.32 -1.50 -3.45 116.42 111.68 3myb h ASP 121 Ca -0.51 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 56.34 3myb h ASP 121 Cb 1.30 -0.14 -0.16 0.00 0.22 0.00 0.00 39.33 40.55 3myb h ASP 121 CO 0.58 0.55 -0.65 -0.76 -1.72 0.00 0.00 179.24 177.24 3myb s LEU 122 N -9.20 2.35 -0.20 1.55 1.43 -1.10 -5.02 118.68 108.48 3myb s LEU 122 Ca -0.08 -0.90 -0.17 0.00 -1.03 0.00 0.00 54.13 51.95 3myb s LEU 122 Cb 0.16 0.28 0.05 0.00 0.03 0.00 0.00 46.19 46.71 3myb s LEU 122 CO 0.76 -0.58 0.53 0.00 0.23 0.00 0.00 176.35 177.29 3myb s ALA 123 N -3.61 -1.31 -0.15 4.21 0.00 -1.26 -0.95 121.76 118.68 3myb s ALA 123 Ca 0.04 1.55 0.01 0.00 0.00 0.00 0.00 51.96 53.56 3myb s ALA 123 Cb 0.06 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.27 3myb s ALA 123 CO -0.09 -0.26 -0.18 0.08 0.00 0.00 0.00 175.76 175.31 3myb s VAL 124 N 0.47 2.41 0.21 0.00 1.01 -0.43 -0.77 120.40 123.30 3myb s VAL 124 Ca -0.02 -0.85 0.11 0.00 0.00 0.00 0.00 61.98 61.22 3myb s VAL 124 Cb -0.04 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3myb s VAL 124 CO -0.02 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.42 3myb s ALA 125 N 0.86 2.69 0.51 5.51 0.00 -0.20 -0.98 121.76 130.14 3myb s ALA 125 Ca -0.05 -1.65 -0.07 0.00 0.00 0.00 0.00 51.96 50.19 3myb s ALA 125 Cb -0.15 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3myb s ALA 125 CO -0.02 0.40 0.84 0.95 0.00 0.00 0.00 175.76 177.94 3myb s THR 126 N -1.86 4.85 0.21 0.00 -4.23 -0.44 -1.48 115.64 112.70 3myb s THR 126 Ca 0.24 0.39 0.30 0.00 -1.18 0.00 0.00 61.69 61.44 3myb s THR 126 Cb -0.07 -3.86 0.33 0.00 1.34 0.00 0.00 72.50 70.24 3myb s THR 126 CO 0.12 -0.90 1.98 -0.09 -0.54 0.00 0.00 174.62 175.19 3myb h ARG 127 N 0.17 0.00 -0.01 3.99 2.43 -1.30 -1.43 114.38 118.22 3myb h ARG 127 Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3myb h ARG 127 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 3myb h ARG 127 CO 0.62 0.09 -0.44 -0.40 -1.51 0.00 0.00 179.97 178.33 3myb n ASP 128 N -3.28 1.35 -4.73 -3.80 5.75 -1.26 -4.36 116.55 106.22 3myb n ASP 128 Ca -0.00 -1.08 -0.41 0.00 -0.01 0.00 0.00 54.79 53.29 3myb n ASP 128 Cb 0.32 0.37 0.01 0.00 -1.03 0.00 0.00 41.12 40.78 3myb n ASP 128 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3myb n ALA 129 N -0.58 1.67 -2.60 2.12 0.00 -0.54 -4.85 120.51 115.72 3myb n ALA 129 Ca 0.10 0.27 -0.22 0.00 0.00 0.00 0.00 53.44 53.59 3myb n ALA 129 Cb 0.39 -2.33 -0.13 0.00 0.00 0.00 0.00 19.45 17.39 3myb n ALA 129 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3myb s ARG 130 N -2.27 1.03 -0.06 0.00 0.52 -1.25 -2.56 118.95 114.35 3myb s ARG 130 Ca 0.60 -0.98 0.04 0.00 -0.52 0.00 0.00 55.73 54.87 3myb s ARG 130 Cb -0.49 -1.14 0.00 0.00 0.52 0.00 0.00 34.95 33.85 3myb s ARG 130 CO 0.59 0.27 -0.18 -0.06 0.02 0.00 0.00 175.30 175.94 3myb s PHE 131 N -1.07 1.86 0.05 -0.53 0.40 -0.52 -1.13 117.98 117.03 3myb s PHE 131 Ca 0.03 -0.64 -0.12 0.00 -0.60 0.00 0.00 56.93 55.60 3myb s PHE 131 Cb -0.09 -1.27 0.01 0.00 0.51 0.00 0.00 43.02 42.18 3myb s PHE 131 CO 0.03 -0.26 0.26 0.00 0.70 0.00 0.00 175.22 175.95 3myb s ALA 132 N 0.28 -0.56 -0.85 5.36 0.00 -0.67 -0.36 121.76 124.97 3myb s ALA 132 Ca -0.10 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.74 3myb s ALA 132 Cb -0.14 0.32 0.23 0.00 0.00 0.00 0.00 23.12 23.54 3myb s ALA 132 CO 0.04 -0.41 0.85 1.33 0.00 0.00 0.00 175.76 177.57 3myb n VAL 133 N 0.56 3.08 -0.63 0.00 0.24 -1.26 -0.66 118.33 119.66 3myb n VAL 133 Ca -0.18 -5.23 0.07 0.00 -2.04 0.00 0.00 64.34 56.96 3myb n VAL 133 Cb 0.59 -2.26 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 1.82 5.02 -0.31 -1.34 3.41 -1.26 -4.32 113.62 116.64 3myb n SER 134 Ca 0.24 -2.67 0.07 0.00 -0.26 0.00 0.00 58.87 56.25 3myb n SER 134 Cb 0.37 -0.63 0.28 0.00 -0.26 0.00 0.00 64.21 63.98 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 4.20 1.38 1.55 5.00 0.00 -1.92 -1.11 103.07 112.17 3myb h GLY 135 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 47.33 47.00 3myb h GLY 135 CO 0.36 0.19 0.18 1.19 0.00 0.00 0.00 176.54 178.46 3myb h ILE 136 N 0.91 0.48 0.00 2.60 6.09 -1.54 -0.03 117.51 126.02 3myb h ILE 136 Ca 0.44 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.93 3myb h ILE 136 Cb 0.45 0.86 0.00 0.00 0.47 0.00 0.00 36.82 38.59 3myb h ILE 136 CO -0.20 0.00 0.00 0.78 -3.07 0.00 0.00 178.15 175.66 3myb h ASN 137 N 0.00 0.00 -0.26 2.19 2.35 -1.50 -1.41 115.58 116.95 3myb h ASN 137 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3myb h ASN 137 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 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 -2.42 1.49 -0.74 2.81 0.24 -0.09 -4.98 118.33 114.64 3myb n VAL 138 Ca 0.02 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.95 3myb n VAL 138 Cb 0.24 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 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 0.62 3.02 7.63 0.00 -0.53 -5.01 105.19 110.87 3myb n GLY 139 Ca 0.14 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 4.74 0.30 0.99 2.96 -0.78 -4.93 118.68 121.96 3myb s LEU 140 Ca 0.00 -2.37 -0.29 0.00 -0.22 0.00 0.00 54.13 51.25 3myb s LEU 140 Cb 0.00 -1.67 -0.13 0.00 0.50 0.00 0.00 46.19 44.90 3myb s LEU 140 CO 0.00 -0.37 1.34 0.33 -1.32 0.00 0.00 176.35 176.33 3myb n PHE 141 N 4.00 2.22 -1.22 5.38 7.35 -1.26 -1.76 117.46 132.17 3myb n PHE 141 Ca 0.04 0.50 -0.37 0.00 -0.76 0.00 0.00 57.45 56.85 3myb n PHE 141 Cb 0.39 -2.43 -0.03 0.00 0.35 0.00 0.00 39.48 37.76 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 6.62 0.04 -0.20 0.00 0.02 -1.99 0.58 113.55 118.62 3myb h SER 143 Ca 0.54 -0.10 -0.16 0.00 -0.84 0.00 0.00 61.79 61.24 3myb h SER 143 Cb 0.48 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.02 3myb h SER 143 CO 1.80 0.13 -0.49 0.71 -1.14 0.00 0.00 176.83 177.84 3myb h THR 144 N -0.06 1.31 -0.13 -2.27 1.35 -2.01 -2.83 112.91 108.28 3myb h THR 144 Ca 0.01 -1.71 -0.02 0.00 -0.55 0.00 0.00 66.41 64.13 3myb h THR 144 Cb 0.10 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 3myb h THR 144 CO -0.00 0.54 -0.03 -0.65 -0.25 0.00 0.00 175.52 175.13 3myb h PRO 145 N 0.38 0.19 -0.30 4.72 0.11 -1.87 -2.28 132.00 132.95 3myb h PRO 145 Ca -0.00 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 3myb h PRO 145 Cb 1.10 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3myb h PRO 145 CO 0.11 0.24 0.11 0.78 -0.21 0.00 0.00 178.00 179.02 3myb h GLY 146 N 0.47 0.45 0.56 -0.55 0.00 -0.69 -0.51 103.07 102.80 3myb h GLY 146 Ca 0.04 -0.21 0.04 0.00 0.00 0.00 0.00 47.33 47.21 3myb h GLY 146 CO 0.01 0.20 -0.07 -2.08 0.00 0.00 0.00 176.54 174.59 3myb h VAL 147 N 0.42 0.76 -0.20 4.60 2.07 -1.17 -0.64 116.25 122.09 3myb h VAL 147 Ca 0.11 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.50 3myb h VAL 147 Cb 0.11 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3myb h VAL 147 CO -0.01 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 177.22 3myb h ALA 148 N 1.15 0.32 -0.53 1.67 0.00 -1.48 -3.21 119.26 117.17 3myb h ALA 148 Ca 0.10 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 3myb h ALA 148 Cb 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3myb h ALA 148 CO -0.22 0.38 0.27 1.25 0.00 0.00 0.00 179.25 180.94 3myb h LEU 149 N 0.28 0.68 0.00 0.00 5.85 -1.03 -1.88 115.31 119.21 3myb h LEU 149 Ca 0.01 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3myb h LEU 149 Cb 0.95 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.81 3myb h LEU 149 CO 0.08 0.60 0.00 -1.54 -0.34 0.00 0.00 178.44 177.24 3myb n SER 150 N -4.60 0.00 -0.97 1.25 3.41 -0.25 -1.52 113.62 110.94 3myb n SER 150 Ca 0.03 0.04 0.10 0.00 -0.26 0.00 0.00 58.87 58.78 3myb n SER 150 Cb 0.10 -0.28 0.16 0.00 -0.26 0.00 0.00 64.21 63.94 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 -1.28 2.21 -0.01 4.33 1.74 -0.71 -4.46 116.66 118.48 3myb n ARG 151 Ca 0.08 -2.03 -0.01 0.00 -0.77 0.00 0.00 57.85 55.11 3myb n ARG 151 Cb 0.13 -1.44 -0.02 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 1.26 4.23 -4.30 0.55 5.03 -0.58 -5.10 115.26 116.34 3myb n ASN 152 Ca 0.16 0.00 -0.16 0.00 0.87 0.00 0.00 54.58 55.45 3myb n ASN 152 Cb 0.54 0.60 -0.10 0.00 -1.02 0.00 0.00 39.78 39.80 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 -2.08 1.13 0.85 2.41 -7.23 -0.57 -4.15 120.40 110.76 3myb s VAL 153 Ca -0.02 -2.06 -0.11 0.00 -1.81 0.00 0.00 61.98 57.99 3myb s VAL 153 Cb 0.01 -2.14 0.11 0.00 0.56 0.00 0.00 36.38 34.92 3myb s VAL 153 CO 0.13 -0.50 1.14 -0.83 -0.31 0.00 0.00 175.10 174.73 3myb s GLY 154 N -3.26 1.77 0.10 2.32 0.00 -1.26 -4.60 107.32 102.39 3myb s GLY 154 Ca 0.24 0.55 -0.25 0.00 0.00 0.00 0.00 44.72 45.26 3myb s GLY 154 CO 0.06 0.95 1.69 3.21 0.00 0.00 0.00 173.10 179.00 3myb h ARG 155 N -1.48 -0.23 -0.75 2.90 3.08 -1.97 -0.05 114.38 115.88 3myb h ARG 155 Ca -0.44 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.58 3myb h ARG 155 Cb 1.26 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.33 3myb h ARG 155 CO 0.45 -0.15 0.27 0.87 -1.07 0.00 0.00 179.97 180.33 3myb h LYS 156 N -0.24 1.13 -0.47 0.04 1.57 -1.99 0.76 116.57 117.37 3myb h LYS 156 Ca 0.02 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.53 3myb h LYS 156 Cb 0.25 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3myb h LYS 156 CO -0.06 0.94 0.11 0.00 -0.57 0.00 0.00 179.45 179.87 3myb h ALA 157 N 1.19 0.62 -0.18 3.86 0.00 -1.87 -1.86 119.26 121.02 3myb h ALA 157 Ca 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3myb h ALA 157 Cb 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3myb h ALA 157 CO -0.01 0.32 0.09 0.00 0.00 0.00 0.00 179.25 179.64 3myb h ALA 158 N 0.97 0.23 -0.51 0.00 0.00 -0.65 -1.89 119.26 117.41 3myb h ALA 158 Ca 0.15 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3myb h ALA 158 Cb 0.34 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3myb h ALA 158 CO 0.00 -0.21 0.33 0.35 0.00 0.00 0.00 179.25 179.72 3myb h PHE 159 N 0.16 0.63 -0.51 0.00 3.04 -0.79 -0.60 116.94 118.87 3myb h PHE 159 Ca 0.06 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.06 3myb h PHE 159 Cb 0.11 -0.21 -0.04 0.00 2.56 0.00 0.00 35.95 38.37 3myb h PHE 159 CO -0.03 0.39 0.29 1.49 -2.02 0.00 0.00 178.31 178.43 3myb h GLU 160 N 0.68 0.55 -0.56 1.11 4.81 -1.21 -0.75 114.58 119.21 3myb h GLU 160 Ca 0.19 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 3myb h GLU 160 Cb -0.06 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 3myb h GLU 160 CO -0.05 0.36 0.30 0.52 -0.73 0.00 0.00 179.01 179.42 3myb h MET 161 N 0.57 0.79 -0.29 1.92 2.86 -0.96 -2.21 114.93 117.61 3myb h MET 161 Ca 0.21 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.65 3myb h MET 161 Cb 0.06 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 3myb h MET 161 CO -0.12 0.61 -0.22 -0.07 1.06 0.00 0.00 176.91 178.18 3myb h LEU 162 N 0.76 0.69 0.00 1.22 3.38 -0.68 -0.16 115.31 120.51 3myb h LEU 162 Ca 0.20 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 3myb h LEU 162 Cb 0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3myb h LEU 162 CO -0.03 0.99 -0.52 -0.37 0.09 0.00 0.00 178.44 178.60 3myb h VAL 163 N 0.40 0.60 0.00 1.22 -1.51 -1.14 -3.37 116.25 112.45 3myb h VAL 163 Ca 0.05 -1.88 -0.30 0.00 -1.23 0.00 0.00 66.70 63.35 3myb h VAL 163 Cb 0.77 2.25 -0.06 0.00 -2.13 0.00 0.00 31.29 32.11 3myb h VAL 163 CO 0.06 0.34 -2.26 0.35 -1.23 0.00 0.00 177.57 174.83 3myb n THR 164 N -3.13 1.17 -1.00 7.19 -2.24 -0.84 -5.00 114.28 110.42 3myb n THR 164 Ca 0.01 -0.79 -0.00 0.00 -2.27 0.00 0.00 64.05 61.00 3myb n THR 164 Cb 0.69 -0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 68.50 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 1.65 0.35 3.84 3.38 0.00 -0.07 -4.88 105.19 109.45 3myb n GLY 165 Ca -0.27 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.63 4.02 0.42 1.61 2.02 -1.26 -4.40 118.70 120.48 3myb s GLU 166 Ca 0.00 0.99 -0.24 0.00 0.02 0.00 0.00 54.97 55.74 3myb s GLU 166 Cb 0.00 -2.15 -0.08 0.00 0.10 0.00 0.00 34.13 32.00 3myb s GLU 166 CO 0.00 -0.21 1.15 -0.06 0.02 0.00 0.00 175.26 176.16 3myb s PHE 167 N -2.52 3.03 -0.06 1.61 0.08 -1.26 -4.60 117.98 114.26 3myb s PHE 167 Ca 0.60 1.56 0.04 0.00 0.12 0.00 0.00 56.93 59.25 3myb s PHE 167 Cb -0.10 -3.35 -0.02 0.00 -0.57 0.00 0.00 43.02 38.99 3myb s PHE 167 CO 0.27 -1.28 -0.19 0.08 -0.10 0.00 0.00 175.22 174.00 3myb s VAL 168 N -1.50 2.62 0.83 -0.44 1.01 0.51 -4.94 120.40 118.49 3myb s VAL 168 Ca 0.60 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 3myb s VAL 168 Cb -0.28 -2.01 0.09 0.00 0.00 0.00 0.00 36.38 34.18 3myb s VAL 168 CO 0.35 0.57 1.09 -0.94 0.00 0.00 0.00 175.10 176.18 3myb s SER 169 N -0.39 4.06 0.18 3.32 1.04 -1.26 -1.44 113.70 119.21 3myb s SER 169 Ca 0.04 1.66 -0.13 0.00 0.48 0.00 0.00 55.95 58.00 3myb s SER 169 Cb -0.12 -2.36 0.13 0.00 0.10 0.00 0.00 66.02 63.77 3myb s SER 169 CO 0.02 -2.30 1.81 0.00 0.98 0.00 0.00 173.24 173.76 3myb h ALA 170 N -1.31 0.71 -0.64 5.32 0.00 -1.69 -0.08 119.26 121.57 3myb h ALA 170 Ca -0.46 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.36 3myb h ALA 170 Cb 1.25 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3myb h ALA 170 CO 0.53 0.02 0.06 -0.44 0.00 0.00 0.00 179.25 179.43 3myb h ASP 171 N 0.63 1.05 -0.71 0.00 3.32 -1.89 -0.82 116.42 118.00 3myb h ASP 171 Ca 0.23 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 57.00 3myb h ASP 171 Cb 0.05 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 3myb h ASP 171 CO -0.11 1.07 0.47 0.44 -1.72 0.00 0.00 179.24 179.38 3myb h ASP 172 N 1.00 0.80 -0.77 6.45 3.32 -1.85 -1.39 116.42 123.98 3myb h ASP 172 Ca 0.19 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.20 3myb h ASP 172 Cb 0.49 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 3myb h ASP 172 CO 0.02 0.58 0.40 0.00 -1.72 0.00 0.00 179.24 178.52 3myb h ALA 173 N 1.26 0.99 -0.51 3.45 0.00 -0.59 -0.94 119.26 122.92 3myb h ALA 173 Ca 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3myb h ALA 173 Cb -0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 3myb h ALA 173 CO -0.06 0.52 0.28 -0.22 0.00 0.00 0.00 179.25 179.77 3myb h LYS 174 N 1.07 0.70 -0.75 0.00 3.64 -0.76 -0.25 116.57 120.22 3myb h LYS 174 Ca 0.27 -0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.66 3myb h LYS 174 Cb 0.07 -0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 31.68 3myb h LYS 174 CO -0.04 0.54 0.39 0.78 -2.27 0.00 0.00 179.45 178.85 3myb h GLY 175 N 0.67 1.14 2.00 5.01 0.00 -0.71 -2.43 103.07 108.75 3myb h GLY 175 Ca 0.18 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 3myb h GLY 175 CO -0.03 0.07 -0.43 1.41 0.00 0.00 0.00 176.54 177.56 3myb h LEU 176 N 0.65 0.00 0.00 3.11 3.38 -0.85 -3.48 115.31 118.13 3myb h LEU 176 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 3myb h LEU 176 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3myb h LEU 176 CO -0.27 0.43 0.00 0.61 0.09 0.00 0.00 178.44 179.31 3myb n GLY 177 N 0.24 1.07 0.11 0.83 0.00 -0.61 -4.29 105.19 102.55 3myb n GLY 177 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -8.86 0.99 5.85 -1.25 -3.44 115.31 108.60 3myb h LEU 178 Ca 0.00 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.35 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 0.60 -0.66 0.68 -0.34 0.00 0.00 178.44 178.72 3myb s VAL 179 N -2.91 1.00 -0.18 1.05 -7.23 -1.23 -4.67 120.40 106.23 3myb s VAL 179 Ca 0.01 -2.03 -0.04 0.00 -1.81 0.00 0.00 61.98 58.11 3myb s VAL 179 Cb 0.08 -2.32 -0.22 0.00 0.56 0.00 0.00 36.38 34.49 3myb s VAL 179 CO 0.78 -0.34 0.10 0.59 -0.31 0.00 0.00 175.10 175.92 3myb n ASN 180 N -0.40 2.06 -3.89 4.85 4.13 0.05 -4.43 115.26 117.63 3myb n ASN 180 Ca -0.05 0.08 -0.11 0.00 1.68 0.00 0.00 54.58 56.17 3myb n ASN 180 Cb 0.64 -0.68 -0.12 0.00 -1.54 0.00 0.00 39.78 38.07 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 -2.53 0.18 -0.08 3.52 1.81 -1.13 -5.04 118.95 115.67 3myb s ARG 181 Ca -0.28 -0.16 0.01 0.00 -1.72 0.00 0.00 55.73 53.57 3myb s ARG 181 Cb 0.08 0.07 0.02 0.00 -0.45 0.00 0.00 34.95 34.67 3myb s ARG 181 CO 0.69 -0.03 -0.08 0.08 -0.68 0.00 0.00 175.30 175.28 3myb s VAL 182 N -0.54 0.92 0.25 3.52 1.01 -1.26 -1.04 120.40 123.27 3myb s VAL 182 Ca -0.06 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.65 3myb s VAL 182 Cb -0.04 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 3myb s VAL 182 CO -0.00 0.33 0.07 0.68 0.00 0.00 0.00 175.10 176.18 3myb s VAL 183 N 1.23 0.67 0.57 2.92 -7.23 -0.55 -4.93 120.40 113.09 3myb s VAL 183 Ca -0.05 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.92 3myb s VAL 183 Cb -0.14 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 3myb s VAL 183 CO -0.02 -0.10 1.31 0.00 -0.31 0.00 0.00 175.10 175.98 3myb s ALA 184 N -3.67 2.70 0.28 1.32 0.00 -1.26 -0.83 121.76 120.30 3myb s ALA 184 Ca 0.35 1.23 0.03 0.00 0.00 0.00 0.00 51.96 53.57 3myb s ALA 184 Cb 0.07 -3.53 0.69 0.00 0.00 0.00 0.00 23.12 20.35 3myb s ALA 184 CO 0.12 -1.34 1.69 -1.35 0.00 0.00 0.00 175.76 174.89 3myb h PRO 185 N 1.24 0.37 0.00 0.00 0.11 -1.94 -0.40 132.00 131.37 3myb h PRO 185 Ca -0.51 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3myb h PRO 185 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3myb h PRO 185 CO 0.56 0.24 0.00 0.87 -0.21 0.00 0.00 178.00 179.47 3myb h LYS 186 N 0.38 0.00 -0.07 1.05 6.56 -2.04 -2.84 116.57 119.61 3myb h LYS 186 Ca 0.54 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.13 3myb h LYS 186 Cb 1.02 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.68 3myb h LYS 186 CO -0.53 0.00 0.00 0.00 -2.06 0.00 0.00 179.45 176.86 3myb n ALA 187 N -2.03 2.49 0.01 3.86 0.00 -0.17 -4.59 120.51 120.10 3myb n ALA 187 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 53.44 52.69 3myb n ALA 187 Cb 0.24 -0.94 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 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 3.83 0.06 -0.72 0.00 5.85 -1.43 -1.21 115.31 121.69 3myb h LEU 188 Ca 0.00 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 3myb h LEU 188 Cb 0.82 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 3myb h LEU 188 CO 0.00 0.12 0.44 0.44 -0.34 0.00 0.00 178.44 179.10 3myb h ASP 189 N -0.00 0.87 -0.48 1.25 3.32 -1.82 -0.68 116.42 118.87 3myb h ASP 189 Ca 0.02 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 3myb h ASP 189 Cb 0.07 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3myb h ASP 189 CO -0.00 0.67 0.23 0.44 -1.72 0.00 0.00 179.24 178.86 3myb h ASP 190 N 0.98 0.62 -0.59 6.45 3.32 -1.80 -1.68 116.42 123.72 3myb h ASP 190 Ca 0.26 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 3myb h ASP 190 Cb -0.03 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 3myb h ASP 190 CO -0.05 0.58 0.25 -0.08 -1.72 0.00 0.00 179.24 178.22 3myb h GLU 191 N 0.62 0.88 -0.31 3.56 4.57 -0.74 -1.03 114.58 122.13 3myb h GLU 191 Ca 0.16 -0.16 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 3myb h GLU 191 Cb 0.12 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 3myb h GLU 191 CO -0.02 0.75 0.07 0.82 -1.18 0.00 0.00 179.01 179.44 3myb h ILE 192 N 0.82 0.86 -0.77 2.32 1.08 -1.04 -2.57 117.51 118.20 3myb h ILE 192 Ca 0.20 -0.06 -0.04 0.00 -0.39 0.00 0.00 64.86 64.57 3myb h ILE 192 Cb 0.19 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 34.57 3myb h ILE 192 CO -0.02 0.03 0.34 -0.08 -0.69 0.00 0.00 178.15 177.74 3myb h GLU 193 N 0.18 1.13 -0.59 2.37 4.57 -1.08 0.43 114.58 121.59 3myb h GLU 193 Ca 0.14 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.16 3myb h GLU 193 Cb 0.15 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 3myb h GLU 193 CO -0.18 0.89 0.38 0.00 -1.18 0.00 0.00 179.01 178.91 3myb h ALA 194 N 1.26 0.75 -0.09 2.92 0.00 -0.98 0.11 119.26 123.23 3myb h ALA 194 Ca 0.26 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3myb h ALA 194 Cb 0.15 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3myb h ALA 194 CO -0.03 0.15 -0.04 1.98 0.00 0.00 0.00 179.25 181.32 3myb h MET 195 N 0.77 0.18 -0.49 0.00 1.85 -1.02 -2.93 114.93 113.30 3myb h MET 195 Ca 0.22 -0.08 0.02 0.00 -0.61 0.00 0.00 59.70 59.25 3myb h MET 195 Cb -0.06 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 31.93 3myb h MET 195 CO -0.06 0.54 0.29 0.28 -0.40 0.00 0.00 176.91 177.56 3myb h VAL 196 N -0.18 1.04 -0.80 -5.77 2.07 -0.79 -2.45 116.25 109.38 3myb h VAL 196 Ca 0.02 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.38 3myb h VAL 196 Cb 0.48 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 3myb h VAL 196 CO 0.01 0.11 0.52 0.77 0.02 0.00 0.00 177.57 179.00 3myb h SER 197 N 0.58 0.84 -0.48 0.57 4.64 -0.79 -1.06 113.55 117.85 3myb h SER 197 Ca 0.20 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.38 3myb h SER 197 Cb 0.03 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3myb h SER 197 CO -0.09 0.58 -0.21 0.11 -0.87 0.00 0.00 176.83 176.35 3myb h LYS 198 N 0.98 1.00 -0.15 4.77 1.57 -1.25 -2.75 116.57 120.74 3myb h LYS 198 Ca 0.32 -0.42 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 3myb h LYS 198 Cb 0.04 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 3myb h LYS 198 CO -0.09 1.10 -0.06 0.82 -0.57 0.00 0.00 179.45 180.65 3myb h ILE 199 N 0.87 1.30 0.00 1.86 2.04 -1.00 -3.19 117.51 119.38 3myb h ILE 199 Ca 0.11 -1.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 3myb h ILE 199 Cb 0.79 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 3myb h ILE 199 CO 0.07 0.31 -0.19 -0.37 0.00 0.00 0.00 178.15 177.97 3myb h VAL 200 N -0.02 0.68 0.00 1.67 -1.51 -1.21 -1.96 116.25 113.90 3myb h VAL 200 Ca 0.04 -0.80 -0.05 0.00 -1.23 0.00 0.00 66.70 64.65 3myb h VAL 200 Cb 0.51 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 3myb h VAL 200 CO 0.02 0.18 -0.25 0.00 -1.23 0.00 0.00 177.57 176.29 3myb h ALA 201 N 1.81 1.44 -2.24 5.19 0.00 -1.47 -3.37 119.26 120.62 3myb h ALA 201 Ca -0.00 -0.23 -0.48 0.00 0.00 0.00 0.00 54.91 54.20 3myb h ALA 201 Cb 0.49 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.26 3myb h ALA 201 CO 0.02 0.31 0.38 0.15 0.00 0.00 0.00 179.25 180.11 3myb s LYS 202 N -4.30 3.85 0.30 0.00 -0.14 -0.74 -4.80 119.74 113.91 3myb s LYS 202 Ca -0.03 0.88 -0.29 0.00 -1.36 0.00 0.00 55.97 55.17 3myb s LYS 202 Cb 0.14 -2.13 -0.10 0.00 -1.68 0.00 0.00 37.83 34.06 3myb s LYS 202 CO 0.68 -0.34 1.37 -2.14 -0.76 0.00 0.00 175.35 174.16 3myb s PRO 203 N -4.35 4.30 0.17 -1.68 0.02 -1.26 -4.91 135.00 127.29 3myb s PRO 203 Ca 0.58 2.27 -0.14 0.00 0.02 0.00 0.00 61.00 63.73 3myb s PRO 203 Cb -0.10 -3.08 0.13 0.00 0.02 0.00 0.00 34.50 31.47 3myb s PRO 203 CO 0.37 -0.30 1.73 -0.09 -0.33 0.00 0.00 177.00 178.38 3myb h ARG 204 N 3.97 0.25 -0.68 5.54 1.12 -1.92 -2.50 114.38 120.17 3myb h ARG 204 Ca -0.48 -0.02 0.11 0.00 -1.11 0.00 0.00 59.98 58.49 3myb h ARG 204 Cb 1.22 -0.06 -0.08 0.00 -0.01 0.00 0.00 29.97 31.04 3myb h ARG 204 CO 0.70 0.17 0.26 0.00 -3.11 0.00 0.00 179.97 177.99 3myb h ALA 205 N 1.31 0.91 -0.25 2.80 0.00 -1.95 0.00 119.26 122.09 3myb h ALA 205 Ca 0.21 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 3myb h ALA 205 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3myb h ALA 205 CO -0.25 -0.19 -0.17 0.00 0.00 0.00 0.00 179.25 178.64 3myb h ALA 206 N 1.48 0.36 -0.34 0.00 0.00 -1.88 -1.58 119.26 117.30 3myb h ALA 206 Ca 0.36 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3myb h ALA 206 Cb 0.48 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3myb h ALA 206 CO -0.35 0.27 0.21 0.28 0.00 0.00 0.00 179.25 179.66 3myb h VAL 207 N 0.28 1.11 -0.14 0.00 2.07 -1.10 -0.33 116.25 118.15 3myb h VAL 207 Ca 0.05 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3myb h VAL 207 Cb 0.70 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 3myb h VAL 207 CO 0.05 0.11 0.06 0.00 0.02 0.00 0.00 177.57 177.80 3myb h ALA 208 N 1.09 0.18 -0.63 1.67 0.00 -0.88 -0.28 119.26 120.40 3myb h ALA 208 Ca 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3myb h ALA 208 Cb -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3myb h ALA 208 CO -0.02 -0.24 0.23 0.52 0.00 0.00 0.00 179.25 179.73 3myb h MET 209 N 0.08 0.96 -0.22 0.00 2.86 -1.27 -2.66 114.93 114.68 3myb h MET 209 Ca 0.05 -0.19 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 3myb h MET 209 Cb 0.15 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 3myb h MET 209 CO -0.00 0.83 -0.14 0.78 1.06 0.00 0.00 176.91 179.43 3myb h GLY 210 N 0.90 0.52 0.95 8.32 0.00 -0.96 -1.77 103.07 111.02 3myb h GLY 210 Ca 0.21 -0.49 0.01 0.00 0.00 0.00 0.00 47.33 47.05 3myb h GLY 210 CO -0.01 0.45 0.10 1.70 0.00 0.00 0.00 176.54 178.78 3myb h LYS 211 N 0.18 0.21 -0.20 4.80 3.64 -1.00 0.53 116.57 124.73 3myb h LYS 211 Ca 0.04 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3myb h LYS 211 Cb 0.66 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 3myb h LYS 211 CO 0.04 0.14 0.05 0.00 -2.27 0.00 0.00 179.45 177.41 3myb h ALA 212 N 1.09 0.21 -0.43 5.00 0.00 -1.45 -2.56 119.26 121.12 3myb h ALA 212 Ca 0.07 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3myb h ALA 212 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3myb h ALA 212 CO -0.04 -0.38 0.28 1.25 0.00 0.00 0.00 179.25 180.36 3myb h LEU 213 N 0.14 0.48 -0.57 0.00 7.12 -1.18 -2.62 115.31 118.68 3myb h LEU 213 Ca 0.09 -0.01 0.11 0.00 0.13 0.00 0.00 57.88 58.20 3myb h LEU 213 Cb 0.07 -0.12 -0.11 0.00 -0.53 0.00 0.00 40.66 39.97 3myb h LEU 213 CO -0.10 0.34 -0.22 0.15 -0.13 0.00 0.00 178.44 178.49 3myb h PHE 214 N 0.57 -0.53 0.00 1.25 3.04 -0.48 -0.21 116.94 120.58 3myb h PHE 214 Ca 0.16 0.06 -0.10 0.00 3.98 0.00 0.00 57.97 62.07 3myb h PHE 214 Cb -0.05 0.32 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 3myb h PHE 214 CO -0.05 -0.31 -0.48 1.88 -2.02 0.00 0.00 178.31 177.33 3myb h TYR 215 N -0.08 0.00 -0.20 0.41 0.05 -1.41 -2.76 116.97 112.99 3myb h TYR 215 Ca 0.26 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.01 3myb h TYR 215 Cb 0.49 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 3myb h TYR 215 CO -0.53 0.48 -0.01 0.00 -1.05 0.00 0.00 178.16 177.05 3myb h ARG 216 N 0.00 0.35 0.00 4.88 3.08 -0.95 -3.32 114.38 118.43 3myb h ARG 216 Ca -0.00 -0.11 -0.16 0.00 0.07 0.00 0.00 59.98 59.77 3myb h ARG 216 Cb 1.28 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 3myb h ARG 216 CO 0.06 0.56 -0.76 -0.56 -1.07 0.00 0.00 179.97 178.20 3myb h GLN 217 N 0.10 0.00 0.00 0.04 -0.00 -1.05 -2.92 115.11 111.28 3myb h GLN 217 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.70 3myb h GLN 217 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.88 3myb h GLN 217 CO 0.01 0.76 0.00 0.97 -0.00 0.00 0.00 178.83 180.57 3myb h ILE 218 N 0.00 0.00 -0.33 1.86 2.10 -1.58 -2.79 117.51 116.77 3myb h ILE 218 Ca -0.01 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 65.53 3myb h ILE 218 Cb 1.35 1.35 0.00 0.00 -1.09 0.00 0.00 36.82 38.43 3myb h ILE 218 CO 0.10 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 176.55 3myb n GLU 219 N -2.93 2.28 -3.91 2.19 1.02 -1.10 -4.96 120.64 113.22 3myb n GLU 219 Ca 0.00 -1.93 -0.20 0.00 -0.02 0.00 0.00 57.16 55.02 3myb n GLU 219 Cb 0.26 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.15 3myb n GLU 219 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3myb n THR 220 N 1.14 0.00 -1.73 2.62 5.66 -1.05 -5.14 114.28 115.78 3myb n THR 220 Ca 0.18 -1.90 -0.32 0.00 -3.05 0.00 0.00 64.05 58.97 3myb n THR 220 Cb 0.52 0.69 0.04 0.00 -1.55 0.00 0.00 70.33 70.03 3myb n THR 220 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3myb s ASP 221 N -2.99 5.48 0.31 1.09 -4.77 -1.26 -4.80 116.67 109.72 3myb s ASP 221 Ca 0.17 1.70 0.01 0.00 -3.30 0.00 0.00 52.55 51.13 3myb s ASP 221 Cb 0.01 -2.51 0.50 0.00 -1.09 0.00 0.00 42.92 39.82 3myb s ASP 221 CO 0.12 -1.37 1.87 -0.29 0.70 0.00 0.00 175.17 176.20 3myb h ILE 222 N -0.31 1.21 -0.16 2.11 2.10 -1.99 0.65 117.51 121.12 3myb h ILE 222 Ca -0.45 -0.72 -0.04 0.00 1.08 0.00 0.00 64.86 64.72 3myb h ILE 222 Cb 1.21 0.69 -0.00 0.00 -1.09 0.00 0.00 36.82 37.63 3myb h ILE 222 CO 0.57 0.27 -0.07 -0.08 -1.08 0.00 0.00 178.15 177.76 3myb h GLU 223 N 0.72 0.33 -0.74 2.19 4.81 -1.99 -1.27 114.58 118.63 3myb h GLU 223 Ca 0.16 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3myb h GLU 223 Cb 0.25 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 3myb h GLU 223 CO -0.01 0.63 0.45 0.77 -0.73 0.00 0.00 179.01 180.12 3myb h SER 224 N 0.01 0.88 -0.41 1.04 0.02 -1.87 -2.13 113.55 111.09 3myb h SER 224 Ca 0.04 -0.06 0.05 0.00 -0.84 0.00 0.00 61.79 60.98 3myb h SER 224 Cb 0.53 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.80 3myb h SER 224 CO 0.02 0.68 0.14 0.00 -1.14 0.00 0.00 176.83 176.53 3myb h ALA 225 N 1.24 0.48 -0.25 3.77 0.00 -0.68 -2.25 119.26 121.56 3myb h ALA 225 Ca 0.26 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 3myb h ALA 225 Cb -0.04 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3myb h ALA 225 CO -0.05 -0.25 -0.18 1.88 0.00 0.00 0.00 179.25 180.64 3myb h TYR 226 N 0.29 0.49 -0.22 0.00 0.05 -0.92 0.70 116.97 117.37 3myb h TYR 226 Ca 0.19 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.87 3myb h TYR 226 Cb 0.18 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 3myb h TYR 226 CO -0.16 0.61 0.07 0.00 -1.05 0.00 0.00 178.16 177.64 3myb h ALA 227 N 1.40 0.29 -0.37 3.88 0.00 -0.95 -0.49 119.26 123.01 3myb h ALA 227 Ca 0.07 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3myb h ALA 227 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3myb h ALA 227 CO 0.04 -0.09 0.04 0.22 0.00 0.00 0.00 179.25 179.46 3myb h ASP 228 N 0.19 0.60 -0.70 0.00 1.82 -1.19 -2.47 116.42 114.67 3myb h ASP 228 Ca 0.07 -0.28 -0.03 0.00 -0.39 0.00 0.00 57.03 56.41 3myb h ASP 228 Cb 0.22 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.04 3myb h ASP 228 CO -0.00 0.73 0.33 0.00 -1.61 0.00 0.00 179.24 178.68 3myb h ALA 229 N 0.90 1.22 -0.26 -0.78 0.00 -0.73 -0.87 119.26 118.74 3myb h ALA 229 Ca 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3myb h ALA 229 Cb 0.39 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3myb h ALA 229 CO 0.01 0.59 -0.09 0.78 0.00 0.00 0.00 179.25 180.54 3myb h GLY 230 N 1.08 0.57 1.14 0.00 0.00 -0.99 0.13 103.07 104.99 3myb h GLY 230 Ca 0.25 -0.48 -0.13 0.00 0.00 0.00 0.00 47.33 46.97 3myb h GLY 230 CO -0.03 0.44 -0.20 0.00 0.00 0.00 0.00 176.54 176.76 3myb h THR 231 N 0.27 1.27 -0.54 4.70 1.03 -1.28 -0.74 112.91 117.61 3myb h THR 231 Ca 0.06 -1.36 -0.01 0.00 -0.01 0.00 0.00 66.41 65.09 3myb h THR 231 Cb 0.57 1.10 -0.03 0.00 -1.07 0.00 0.00 68.15 68.72 3myb h THR 231 CO 0.03 0.47 0.29 0.74 -0.01 0.00 0.00 175.52 177.04 3myb h THR 232 N 0.85 1.19 -0.22 0.00 2.02 -1.03 -1.66 112.91 114.06 3myb h THR 232 Ca 0.12 -0.50 -0.11 0.00 0.77 0.00 0.00 66.41 66.69 3myb h THR 232 Cb 0.77 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 3myb h THR 232 CO 0.06 0.21 -0.33 -0.03 0.37 0.00 0.00 175.52 175.80 3myb h MET 233 N 0.73 0.47 -0.59 6.66 4.05 -0.57 -0.38 114.93 125.29 3myb h MET 233 Ca 0.19 -0.20 -0.09 0.00 -0.28 0.00 0.00 59.70 59.32 3myb h MET 233 Cb 0.07 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 3myb h MET 233 CO -0.03 0.74 0.03 0.00 0.23 0.00 0.00 176.91 177.89 3myb h ALA 234 N 1.25 0.80 -0.30 0.39 0.00 -0.90 0.89 119.26 121.38 3myb h ALA 234 Ca 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3myb h ALA 234 Cb 0.77 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3myb h ALA 234 CO 0.06 0.61 0.10 0.00 0.00 0.00 0.00 179.25 180.02 3myb h ASN 236 N 0.33 1.02 0.31 0.00 -0.00 -0.76 -1.88 115.58 114.61 3myb h ASN 236 Ca 0.10 -0.01 -0.03 0.00 -0.00 0.00 0.00 56.30 56.36 3myb h ASN 236 Cb 0.23 -0.23 -0.00 0.00 -0.00 0.00 0.00 38.32 38.31 3myb h ASN 236 CO -0.00 0.70 -0.14 -0.03 -0.00 0.00 0.00 177.43 177.96 3myb h MET 237 N 1.19 0.00 -0.00 6.67 4.05 -0.67 -1.23 114.93 124.94 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 -0.00 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 3myb h MET 237 CO -0.12 0.14 -0.22 -1.33 0.23 0.00 0.00 176.91 175.61 3myb n MET 238 N -3.83 0.26 -2.16 0.39 2.81 -0.72 -3.96 117.12 109.92 3myb n MET 238 Ca -0.02 -0.10 -0.41 0.00 -1.81 0.00 0.00 57.70 55.36 3myb n MET 238 Cb 0.24 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.23 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 -2.81 6.83 0.42 7.83 2.15 -0.46 -4.89 116.67 125.74 3myb s ASP 239 Ca 0.18 2.63 0.15 0.00 0.43 0.00 0.00 52.55 55.95 3myb s ASP 239 Cb 0.19 -2.64 1.03 0.00 -0.30 0.00 0.00 42.92 41.19 3myb s ASP 239 CO 0.57 -0.49 1.90 -0.65 -0.17 0.00 0.00 175.17 176.33 3myb h PRO 240 N 3.52 0.43 0.00 4.34 0.11 -1.88 -1.80 132.00 136.73 3myb h PRO 240 Ca -0.48 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.48 3myb h PRO 240 Cb 1.22 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3myb h PRO 240 CO 0.66 0.29 -0.58 0.77 -0.21 0.00 0.00 178.00 178.93 3myb h SER 241 N 0.45 0.00 -0.17 -2.05 0.02 -1.91 -0.54 113.55 109.35 3myb h SER 241 Ca 0.40 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.27 3myb h SER 241 Cb 0.89 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.43 3myb h SER 241 CO -0.14 0.58 -0.19 0.00 -1.14 0.00 0.00 176.83 175.94 3myb h ALA 242 N 1.42 0.25 -0.38 3.77 0.00 -1.57 0.15 119.26 122.90 3myb h ALA 242 Ca -0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3myb h ALA 242 Cb 1.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3myb h ALA 242 CO 0.08 0.17 0.23 -0.07 0.00 0.00 0.00 179.25 179.66 3myb h LEU 243 N 0.06 0.45 -0.52 0.00 3.38 -1.27 -1.09 115.31 116.32 3myb h LEU 243 Ca 0.02 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 3myb h LEU 243 Cb 0.73 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3myb h LEU 243 CO 0.05 0.35 -0.10 -0.08 0.09 0.00 0.00 178.44 178.75 3myb h GLU 244 N 0.50 0.98 -0.54 1.13 4.57 -1.16 -1.62 114.58 118.45 3myb h GLU 244 Ca 0.14 -0.36 -0.08 0.00 -1.18 0.00 0.00 59.36 57.87 3myb h GLU 244 Cb -0.02 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 3myb h GLU 244 CO -0.03 1.04 0.02 0.78 -1.18 0.00 0.00 179.01 179.65 3myb h GLY 245 N 0.85 0.97 0.82 1.92 0.00 -0.41 0.52 103.07 107.74 3myb h GLY 245 Ca 0.13 -0.66 -0.10 0.00 0.00 0.00 0.00 47.33 46.71 3myb h GLY 245 CO 0.05 0.61 -0.30 -2.08 0.00 0.00 0.00 176.54 174.82 3myb h VAL 246 N 0.84 1.36 -0.78 4.60 2.07 -1.21 -2.20 116.25 120.92 3myb h VAL 246 Ca 0.16 -1.55 0.05 0.00 0.82 0.00 0.00 66.70 66.18 3myb h VAL 246 Cb 0.46 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 3myb h VAL 246 CO 0.02 0.47 0.48 0.28 0.02 0.00 0.00 177.57 178.83 3myb h SER 247 N 0.10 0.76 -0.23 0.57 0.02 -1.06 -1.94 113.55 111.77 3myb h SER 247 Ca 0.01 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3myb h SER 247 Cb 0.89 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 3myb h SER 247 CO 0.07 0.50 0.15 0.00 -1.14 0.00 0.00 176.83 176.41 3myb h ALA 248 N 1.36 0.30 -0.44 3.77 0.00 -0.87 -0.61 119.26 122.77 3myb h ALA 248 Ca 0.33 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.31 3myb h ALA 248 Cb 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 3myb h ALA 248 CO -0.15 -0.23 -0.02 0.35 0.00 0.00 0.00 179.25 179.20 3myb h PHE 249 N 0.31 -0.07 -0.18 0.00 3.57 -1.10 -1.39 116.94 118.08 3myb h PHE 249 Ca 0.09 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 3myb h PHE 249 Cb -0.03 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 3myb h PHE 249 CO -0.06 -0.12 -0.15 -0.07 -2.23 0.00 0.00 178.31 175.68 3myb h LEU 250 N 0.08 0.28 -1.98 0.59 3.38 -0.86 -2.50 115.31 114.31 3myb h LEU 250 Ca 0.22 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3myb h LEU 250 Cb 0.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3myb h LEU 250 CO -0.39 0.46 0.00 -0.62 0.09 0.00 0.00 178.44 177.98 3myb n GLU 251 N -4.24 2.25 -3.60 1.13 1.02 -0.28 -4.97 120.64 111.96 3myb n GLU 251 Ca -0.00 -1.94 -0.21 0.00 -0.02 0.00 0.00 57.16 54.99 3myb n GLU 251 Cb 0.30 -1.44 0.05 0.00 -0.02 0.00 0.00 31.44 30.33 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 1.09 -4.27 -4.10 3.49 5.02 -0.59 -5.01 118.16 113.79 3myb n LYS 252 Ca 0.18 0.66 -0.11 0.00 -2.02 0.00 0.00 58.31 57.03 3myb n LYS 252 Cb 0.47 -5.22 -0.08 0.00 -0.02 0.00 0.00 35.03 30.18 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 -5.68 1.32 0.30 1.97 1.70 -0.77 -5.05 118.95 112.74 3myb s ARG 253 Ca 0.13 -1.43 -0.28 0.00 -0.47 0.00 0.00 55.73 53.68 3myb s ARG 253 Cb -0.03 0.36 -0.09 0.00 -0.57 0.00 0.00 34.95 34.61 3myb s ARG 253 CO 0.80 -0.49 1.03 -0.98 -1.08 0.00 0.00 175.30 174.58 3myb s ARG 254 N -4.08 4.59 0.33 3.89 1.70 -1.26 -4.24 118.95 119.88 3myb s ARG 254 Ca 0.30 1.60 -0.28 0.00 -0.47 0.00 0.00 55.73 56.88 3myb s ARG 254 Cb 0.04 -3.03 -0.09 0.00 -0.57 0.00 0.00 34.95 31.29 3myb s ARG 254 CO 0.09 0.23 1.16 -1.25 -1.08 0.00 0.00 175.30 174.45 3myb s PRO 255 N -1.67 4.40 -1.20 3.89 0.04 -1.26 -4.94 135.00 134.25 3myb s PRO 255 Ca 0.47 1.89 -0.10 0.00 0.04 0.00 0.00 61.00 63.30 3myb s PRO 255 Cb -0.27 -2.99 0.20 0.00 0.04 0.00 0.00 34.50 31.49 3myb s PRO 255 CO 0.34 -0.04 1.55 0.39 0.04 0.00 0.00 177.00 179.28 3myb n GLU 256 N 0.73 3.64 0.02 4.56 1.02 -1.26 -4.72 120.64 124.63 3myb n GLU 256 Ca 0.01 -3.93 0.11 0.00 -0.02 0.00 0.00 57.16 53.33 3myb n GLU 256 Cb 0.45 -2.86 0.05 0.00 -0.02 0.00 0.00 31.44 29.06 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 4.01 0.17 -3.86 -0.32 8.01 -1.26 -4.98 117.44 119.20 3myb n TRP 257 Ca 0.34 0.05 -0.29 0.00 -1.31 0.00 0.00 57.50 56.30 3myb n TRP 257 Cb 0.39 -0.33 0.03 0.00 -2.01 0.00 0.00 31.31 29.39 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 -1.79 -2.32 -4.15 -5.99 8.25 -1.26 -5.00 115.22 102.95 3myb n HIS 258 Ca 0.03 0.91 -0.25 0.00 -0.26 0.00 0.00 57.72 58.15 3myb n HIS 258 Cb 0.40 -4.13 -0.06 0.00 1.12 0.00 0.00 29.99 27.32 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 -3.34 4.15 0.34 1.59 -4.23 -1.26 -5.10 115.64 107.80 3myb s THR 259 Ca 0.59 -1.33 -0.29 0.00 -1.18 0.00 0.00 61.69 59.48 3myb s THR 259 Cb -0.29 -3.15 -0.11 0.00 1.34 0.00 0.00 72.50 70.29 3myb s THR 259 CO 0.82 -0.19 1.49 -2.84 -0.54 0.00 0.00 174.62 173.37 3myb s PRO 260 N -3.27 4.14 0.00 3.99 0.02 -1.26 -4.94 135.00 133.68 3myb s PRO 260 Ca 0.30 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.85 3myb s PRO 260 Cb -0.09 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.43 3myb s PRO 260 CO 0.22 -0.52 0.49 1.04 -0.33 0.00 0.00 177.00 177.90