#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bhx s LYS 2 N 0.00 -0.29 0.40 7.34 0.00 -1.26 -4.98 119.74 120.94 2bhx s LYS 2 Ca 0.00 0.55 -0.24 0.00 0.00 0.00 0.00 55.97 56.28 2bhx s LYS 2 Cb 0.00 -1.65 -0.09 0.00 0.00 0.00 0.00 37.83 36.09 2bhx s LYS 2 CO 0.00 -3.23 1.01 1.14 0.00 0.00 0.00 175.35 174.27 2bhx s GLN 3 N -4.82 4.22 -0.07 1.78 -2.07 -1.26 -5.05 119.66 112.39 2bhx s GLN 3 Ca 0.67 1.40 0.02 0.00 -1.82 0.00 0.00 55.36 55.64 2bhx s GLN 3 Cb -0.20 -2.50 0.01 0.00 -1.09 0.00 0.00 33.01 29.23 2bhx s GLN 3 CO 0.60 -0.07 -0.14 0.08 -1.32 0.00 0.00 175.29 174.44 2bhx s VAL 4 N -1.76 1.27 -0.18 3.63 1.01 -1.26 -4.43 120.40 118.68 2bhx s VAL 4 Ca 0.58 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2bhx s VAL 4 Cb -0.19 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.06 2bhx s VAL 4 CO 0.24 0.39 -0.18 -0.36 0.00 0.00 0.00 175.10 175.18 2bhx s PHE 5 N 0.65 2.71 -0.71 5.22 0.40 0.87 -4.99 117.98 122.12 2bhx s PHE 5 Ca -0.15 -1.63 -0.16 0.00 -0.60 0.00 0.00 56.93 54.39 2bhx s PHE 5 Cb -0.16 -1.87 0.16 0.00 0.51 0.00 0.00 43.02 41.66 2bhx s PHE 5 CO 0.04 -0.79 0.72 1.21 0.70 0.00 0.00 175.22 177.10 2bhx s ASN 6 N 1.31 6.47 -0.37 1.36 3.84 -1.26 -0.47 114.94 125.82 2bhx s ASN 6 Ca 0.04 -2.12 0.07 0.00 0.21 0.00 0.00 52.86 51.07 2bhx s ASN 6 Cb -0.13 -2.25 0.68 0.00 -0.55 0.00 0.00 41.25 38.99 2bhx s ASN 6 CO -0.12 -0.82 1.80 0.49 -2.79 0.00 0.00 177.10 175.67 2bhx n PHE 7 N 5.09 2.51 -1.75 0.43 3.01 0.11 -4.57 117.46 122.29 2bhx n PHE 7 Ca 0.02 -1.53 -0.39 0.00 1.01 0.00 0.00 57.45 56.56 2bhx n PHE 7 Cb 0.44 -0.77 0.04 0.00 -0.01 0.00 0.00 39.48 39.18 2bhx n PHE 7 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2bhx n ASN 8 N -0.73 2.78 -0.12 4.37 3.02 -1.16 -3.38 115.26 120.03 2bhx n ASN 8 Ca 0.48 1.00 0.13 0.00 -0.03 0.00 0.00 54.58 56.15 2bhx n ASN 8 Cb 1.46 -1.58 0.32 0.00 -0.61 0.00 0.00 39.78 39.37 2bhx n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bhx n ALA 9 N -0.90 3.29 0.00 5.41 0.00 -1.26 -4.59 120.51 122.45 2bhx n ALA 9 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2bhx n ALA 9 Cb 0.44 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2bhx n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhx n GLY 10 N 1.41 2.16 3.42 0.00 0.00 -1.26 -4.86 105.19 106.07 2bhx n GLY 10 Ca 0.09 0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 2bhx n GLY 10 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bhx n PRO 11 N 0.00 -1.81 -3.70 1.61 -0.02 -1.26 -5.05 135.00 124.78 2bhx n PRO 11 Ca 0.00 -0.50 -0.13 0.00 -2.02 0.00 0.00 63.50 60.85 2bhx n PRO 11 Cb 0.00 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 2bhx n PRO 11 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bhx n SER 12 N -3.53 -1.12 -4.70 2.55 3.41 -1.17 -4.77 113.62 104.29 2bhx n SER 12 Ca 0.03 -2.68 -0.41 0.00 -0.26 0.00 0.00 58.87 55.56 2bhx n SER 12 Cb 0.56 2.12 0.01 0.00 -0.26 0.00 0.00 64.21 66.64 2bhx n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bhx n ALA 13 N -1.00 1.34 -2.71 7.33 0.00 -1.26 -5.01 120.51 119.20 2bhx n ALA 13 Ca -0.12 0.28 -0.23 0.00 0.00 0.00 0.00 53.44 53.37 2bhx n ALA 13 Cb 0.51 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.63 2bhx n ALA 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bhx s LEU 14 N -1.60 3.44 0.02 0.00 1.02 -1.26 -4.65 118.68 115.65 2bhx s LEU 14 Ca 0.60 -0.46 -0.30 0.00 0.02 0.00 0.00 54.13 53.98 2bhx s LEU 14 Cb -0.52 -1.98 -0.06 0.00 0.02 0.00 0.00 46.19 43.66 2bhx s LEU 14 CO 0.59 0.00 1.35 -2.16 0.02 0.00 0.00 176.35 176.15 2bhx s PRO 15 N -3.63 4.31 0.26 1.29 0.04 -1.26 -4.91 135.00 131.10 2bhx s PRO 15 Ca 0.31 1.92 -0.07 0.00 0.04 0.00 0.00 61.00 63.20 2bhx s PRO 15 Cb -0.07 -3.50 0.46 0.00 0.04 0.00 0.00 34.50 31.43 2bhx s PRO 15 CO 0.22 -0.50 1.59 0.87 0.04 0.00 0.00 177.00 179.22 2bhx h LYS 16 N 7.51 0.02 -0.29 4.56 1.79 -1.98 -0.09 116.57 128.10 2bhx h LYS 16 Ca -0.38 -0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.14 2bhx h LYS 16 Cb 1.19 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.82 2bhx h LYS 16 CO 0.88 0.02 0.20 -1.35 -1.08 0.00 0.00 179.45 178.12 2bhx h PRO 17 N 0.03 0.14 -0.31 3.15 0.11 -1.98 0.27 132.00 133.40 2bhx h PRO 17 Ca 0.45 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.42 2bhx h PRO 17 Cb 0.76 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 2bhx h PRO 17 CO -0.84 0.09 -0.31 0.00 -0.21 0.00 0.00 178.00 176.74 2bhx h ALA 18 N 1.85 0.87 -0.06 -0.75 0.00 -1.29 -0.59 119.26 119.30 2bhx h ALA 18 Ca 0.13 -0.40 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 2bhx h ALA 18 Cb 0.34 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2bhx h ALA 18 CO -0.02 0.63 -0.86 -0.07 0.00 0.00 0.00 179.25 178.94 2bhx h LEU 19 N 0.57 0.65 -0.46 0.00 3.38 -0.98 -1.53 115.31 116.94 2bhx h LEU 19 Ca 0.07 -0.47 -0.13 0.00 0.09 0.00 0.00 57.88 57.44 2bhx h LEU 19 Cb 0.81 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2bhx h LEU 19 CO 0.07 1.25 -0.20 -0.33 0.09 0.00 0.00 178.44 179.32 2bhx h GLU 20 N 0.33 0.95 -0.05 1.13 5.08 -0.41 -0.35 114.58 121.27 2bhx h GLU 20 Ca -0.07 -0.41 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2bhx h GLU 20 Cb 1.47 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.69 2bhx h GLU 20 CO 0.16 1.07 0.03 -0.09 -1.00 0.00 0.00 179.01 179.18 2bhx h ARG 21 N 0.80 0.07 -0.80 2.33 2.43 -1.10 -0.72 114.38 117.39 2bhx h ARG 21 Ca 0.11 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2bhx h ARG 21 Cb 0.77 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.26 2bhx h ARG 21 CO 0.06 0.12 0.50 0.00 -1.51 0.00 0.00 179.97 179.14 2bhx h ALA 22 N 0.95 1.07 -0.39 2.80 0.00 -1.04 -2.65 119.26 119.99 2bhx h ALA 22 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2bhx h ALA 22 Cb 0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2bhx h ALA 22 CO -0.00 0.28 0.19 0.37 0.00 0.00 0.00 179.25 180.09 2bhx h GLN 23 N 0.95 0.56 -0.56 0.00 4.15 -0.71 -1.98 115.11 117.52 2bhx h GLN 23 Ca 0.33 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.63 2bhx h GLN 23 Cb 0.08 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 2bhx h GLN 23 CO -0.14 0.50 0.20 -0.22 -1.93 0.00 0.00 178.83 177.24 2bhx h LYS 24 N 0.49 0.83 -0.49 1.69 3.64 -0.81 -2.90 116.57 119.02 2bhx h LYS 24 Ca 0.13 -0.14 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2bhx h LYS 24 Cb 0.12 -0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 31.73 2bhx h LYS 24 CO -0.02 0.70 0.10 -0.85 -2.27 0.00 0.00 179.45 177.11 2bhx n GLU 25 N -4.31 3.24 0.17 1.90 0.28 -1.03 -4.66 120.64 116.23 2bhx n GLU 25 Ca 0.04 -3.03 0.02 0.00 -0.16 0.00 0.00 57.16 54.04 2bhx n GLU 25 Cb 0.18 -2.03 0.34 0.00 1.43 0.00 0.00 31.44 31.37 2bhx n GLU 25 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2bhx h LEU 26 N 2.20 0.03 0.00 -1.84 5.85 -1.15 -2.85 115.31 117.55 2bhx h LEU 26 Ca 0.14 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2bhx h LEU 26 Cb 1.88 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.88 2bhx h LEU 26 CO 0.48 0.40 -1.80 0.18 -0.34 0.00 0.00 178.44 177.36 2bhx n LEU 27 N -4.09 0.34 -3.46 2.25 4.77 -1.26 -4.04 117.00 111.51 2bhx n LEU 27 Ca -0.02 0.15 -0.25 0.00 -0.03 0.00 0.00 56.01 55.86 2bhx n LEU 27 Cb 0.41 0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.51 2bhx n LEU 27 CO 0.39 0.13 -0.27 0.21 -1.33 0.00 0.00 177.39 176.53 2bhx s ASN 28 N -5.20 2.62 -0.20 -1.43 2.47 -1.08 -2.83 114.94 109.29 2bhx s ASN 28 Ca -0.06 -1.44 -0.12 0.00 0.42 0.00 0.00 52.86 51.66 2bhx s ASN 28 Cb 0.10 -0.03 -0.05 0.00 -1.45 0.00 0.00 41.25 39.82 2bhx s ASN 28 CO 0.85 -0.37 0.23 0.12 -3.72 0.00 0.00 177.10 174.21 2bhx s PHE 29 N 1.80 3.38 -1.52 0.43 5.36 0.26 -4.36 117.98 123.33 2bhx s PHE 29 Ca 0.13 0.42 -0.13 0.00 -0.96 0.00 0.00 56.93 56.38 2bhx s PHE 29 Cb -0.17 -2.31 0.08 0.00 -0.34 0.00 0.00 43.02 40.28 2bhx s PHE 29 CO -0.22 0.14 0.97 -1.71 -1.46 0.00 0.00 175.22 172.95 2bhx n ASN 30 N 3.98 -4.65 -1.23 6.13 4.05 -1.26 -1.37 115.26 120.90 2bhx n ASN 30 Ca -0.13 -0.78 -0.15 0.00 0.45 0.00 0.00 54.58 53.97 2bhx n ASN 30 Cb 0.52 -3.91 -0.07 0.00 1.23 0.00 0.00 39.78 37.55 2bhx n ASN 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2bhx n ASP 31 N -2.85 -5.30 0.03 1.20 8.00 -1.26 -4.85 116.55 111.52 2bhx n ASP 31 Ca 0.02 0.38 0.13 0.00 0.71 0.00 0.00 54.79 56.04 2bhx n ASP 31 Cb 0.53 -4.34 0.50 0.00 -0.02 0.00 0.00 41.12 37.79 2bhx n ASP 31 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2bhx n THR 32 N -2.22 0.18 -1.35 -3.53 -2.24 -0.47 -4.90 114.28 99.75 2bhx n THR 32 Ca -0.15 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 2bhx n THR 32 Cb 0.61 -0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 2bhx n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bhx n GLN 33 N -1.73 -1.12 -4.27 -0.78 1.13 -1.26 -4.96 117.38 104.38 2bhx n GLN 33 Ca 0.06 0.89 -0.22 0.00 -1.94 0.00 0.00 57.00 55.79 2bhx n GLN 33 Cb 0.37 -5.02 -0.12 0.00 0.11 0.00 0.00 30.24 25.58 2bhx n GLN 33 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2bhx s MET 34 N -2.90 1.09 0.69 -1.09 -1.94 -1.22 -4.77 119.30 109.15 2bhx s MET 34 Ca 0.00 -1.17 -0.16 0.00 -1.71 0.00 0.00 55.69 52.65 2bhx s MET 34 Cb 0.00 -1.27 0.02 0.00 2.01 0.00 0.00 34.83 35.59 2bhx s MET 34 CO 0.00 0.28 1.19 0.45 -0.01 0.00 0.00 175.02 176.93 2bhx s SER 35 N -2.03 4.57 0.53 3.03 0.15 -1.13 -0.58 113.70 118.24 2bhx s SER 35 Ca 0.07 2.30 0.25 0.00 0.70 0.00 0.00 55.95 59.26 2bhx s SER 35 Cb -0.09 -2.58 1.48 0.00 -1.71 0.00 0.00 66.02 63.12 2bhx s SER 35 CO 0.04 -2.01 2.13 1.62 1.20 0.00 0.00 173.24 176.22 2bhx h VAL 36 N 0.00 0.69 0.00 4.45 3.04 -1.84 0.27 116.25 122.86 2bhx h VAL 36 Ca -0.48 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2bhx h VAL 36 Cb 1.29 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.77 2bhx h VAL 36 CO 0.52 0.08 0.00 0.23 -1.01 0.00 0.00 177.57 177.39 2bhx n MET 37 N -3.90 0.11 -0.07 4.17 2.81 -1.26 -2.94 117.12 116.04 2bhx n MET 37 Ca -0.02 0.37 0.08 0.00 -1.81 0.00 0.00 57.70 56.32 2bhx n MET 37 Cb 0.17 -1.72 0.11 0.00 -0.71 0.00 0.00 33.22 31.07 2bhx n MET 37 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2bhx n GLU 38 N -1.93 1.66 -3.07 0.03 1.02 0.08 -5.00 120.64 113.42 2bhx n GLU 38 Ca 0.02 -1.68 -0.29 0.00 -0.02 0.00 0.00 57.16 55.19 2bhx n GLU 38 Cb 0.19 -1.32 -0.03 0.00 -0.02 0.00 0.00 31.44 30.25 2bhx n GLU 38 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2bhx s LEU 39 N -1.22 3.93 0.35 -4.62 1.43 -1.15 -4.94 118.68 112.46 2bhx s LEU 39 Ca 0.23 0.92 -0.27 0.00 -1.03 0.00 0.00 54.13 53.97 2bhx s LEU 39 Cb 0.14 -3.77 -0.09 0.00 0.03 0.00 0.00 46.19 42.50 2bhx s LEU 39 CO 0.20 -0.31 1.20 -0.55 0.23 0.00 0.00 176.35 177.12 2bhx s SER 40 N -3.22 6.78 0.00 2.29 0.15 -1.26 -4.91 113.70 113.53 2bhx s SER 40 Ca 0.47 2.45 0.26 0.00 0.70 0.00 0.00 55.95 59.83 2bhx s SER 40 Cb -0.10 -2.63 1.52 0.00 -1.71 0.00 0.00 66.02 63.09 2bhx s SER 40 CO 0.31 -0.50 1.90 0.00 1.20 0.00 0.00 173.24 176.15 2bhx n HIS 41 N 0.58 0.00 1.04 3.44 1.44 -1.26 -1.76 115.22 118.70 2bhx n HIS 41 Ca 0.02 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.84 2bhx n HIS 41 Cb 0.44 -0.03 0.05 0.00 0.12 0.00 0.00 29.99 30.57 2bhx n HIS 41 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2bhx n ARG 42 N -1.03 1.19 -1.98 -1.40 5.12 -1.26 -4.46 116.66 112.84 2bhx n ARG 42 Ca 0.19 -0.95 -0.34 0.00 -1.93 0.00 0.00 57.85 54.81 2bhx n ARG 42 Cb 0.10 -1.48 0.03 0.00 -1.16 0.00 0.00 32.46 29.95 2bhx n ARG 42 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2bhx s SER 43 N -2.47 5.30 0.35 0.55 1.04 -0.72 -4.88 113.70 112.87 2bhx s SER 43 Ca 0.20 2.17 0.15 0.00 0.48 0.00 0.00 55.95 58.95 2bhx s SER 43 Cb 0.18 -2.58 0.63 0.00 0.10 0.00 0.00 66.02 64.36 2bhx s SER 43 CO 0.56 -1.51 1.73 -0.61 0.98 0.00 0.00 173.24 174.39 2bhx h GLN 44 N 0.64 0.00 -0.50 4.02 4.15 -1.93 -0.39 115.11 121.11 2bhx h GLN 44 Ca -0.49 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 58.86 2bhx h GLN 44 Cb 1.27 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.94 2bhx h GLN 44 CO 0.55 0.44 0.04 0.77 -1.93 0.00 0.00 178.83 178.70 2bhx h SER 45 N 0.00 0.83 -0.28 -0.69 0.02 -1.91 -1.91 113.55 109.61 2bhx h SER 45 Ca -0.00 -0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 60.58 2bhx h SER 45 Cb 0.88 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 2bhx h SER 45 CO 0.06 0.91 -0.14 0.22 -1.14 0.00 0.00 176.83 176.74 2bhx h TYR 46 N 0.72 0.68 -0.37 3.45 3.20 -1.73 -3.11 116.97 119.82 2bhx h TYR 46 Ca 0.15 -0.17 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 2bhx h TYR 46 Cb 0.46 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 2bhx h TYR 46 CO 0.03 0.84 0.15 0.93 -1.64 0.00 0.00 178.16 178.47 2bhx h GLU 47 N 0.34 0.52 -0.60 1.82 5.08 -0.94 -0.68 114.58 120.11 2bhx h GLU 47 Ca 0.06 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2bhx h GLU 47 Cb 0.66 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 2bhx h GLU 47 CO 0.04 0.43 0.32 1.49 -1.00 0.00 0.00 179.01 180.30 2bhx h GLU 48 N 0.52 0.59 -0.24 2.33 4.81 -1.34 0.74 114.58 121.99 2bhx h GLU 48 Ca 0.13 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2bhx h GLU 48 Cb 0.11 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2bhx h GLU 48 CO -0.01 0.39 0.07 0.28 -0.73 0.00 0.00 179.01 179.00 2bhx h VAL 49 N 0.61 1.20 -0.16 0.32 2.07 -1.21 0.10 116.25 119.18 2bhx h VAL 49 Ca 0.27 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 2bhx h VAL 49 Cb 0.16 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2bhx h VAL 49 CO -0.17 0.21 0.07 -0.74 0.02 0.00 0.00 177.57 176.96 2bhx h HIS 50 N 0.22 0.23 -0.43 1.57 -0.00 -0.79 0.53 115.15 116.48 2bhx h HIS 50 Ca 0.08 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.39 2bhx h HIS 50 Cb 0.26 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.58 2bhx h HIS 50 CO 0.01 0.28 0.08 1.49 -0.00 0.00 0.00 177.93 179.79 2bhx h GLU 51 N 0.12 0.71 -0.83 5.26 4.57 -0.85 -2.63 114.58 120.93 2bhx h GLU 51 Ca 0.05 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.03 2bhx h GLU 51 Cb 0.14 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.60 2bhx h GLU 51 CO -0.01 0.73 0.43 0.37 -1.18 0.00 0.00 179.01 179.35 2bhx h GLN 52 N 0.57 1.17 -0.84 1.92 4.15 -0.45 0.24 115.11 121.86 2bhx h GLN 52 Ca 0.13 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 2bhx h GLN 52 Cb 0.35 -0.22 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 2bhx h GLN 52 CO 0.01 0.87 0.51 0.00 -1.93 0.00 0.00 178.83 178.29 2bhx h ALA 53 N 1.30 1.07 -0.27 3.38 0.00 -0.70 0.49 119.26 124.52 2bhx h ALA 53 Ca 0.29 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2bhx h ALA 53 Cb 0.06 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2bhx h ALA 53 CO -0.04 0.53 0.15 1.96 0.00 0.00 0.00 179.25 181.85 2bhx h GLN 54 N 1.15 0.37 -0.30 0.00 4.20 -1.02 -2.30 115.11 117.20 2bhx h GLN 54 Ca 0.30 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.85 2bhx h GLN 54 Cb -0.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2bhx h GLN 54 CO -0.06 0.31 -0.33 -0.91 -0.67 0.00 0.00 178.83 177.17 2bhx h ASN 55 N 0.33 0.69 -0.41 1.46 2.35 -0.36 -0.66 115.58 118.97 2bhx h ASN 55 Ca 0.09 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 2bhx h ASN 55 Cb 0.04 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 2bhx h ASN 55 CO -0.02 0.96 0.22 -0.07 -1.65 0.00 0.00 177.43 176.87 2bhx h LEU 56 N 0.56 0.52 -0.32 1.61 3.38 -0.91 -0.10 115.31 120.05 2bhx h LEU 56 Ca 0.06 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2bhx h LEU 56 Cb 0.83 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2bhx h LEU 56 CO 0.07 0.48 0.18 -0.07 0.09 0.00 0.00 178.44 179.19 2bhx h LEU 57 N 0.53 0.30 -0.28 1.67 3.38 -0.99 0.81 115.31 120.72 2bhx h LEU 57 Ca 0.14 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.17 2bhx h LEU 57 Cb 0.08 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 2bhx h LEU 57 CO -0.02 0.22 -0.08 -0.09 0.09 0.00 0.00 178.44 178.56 2bhx h ARG 58 N 0.38 -0.01 -0.32 1.13 2.43 -0.99 -0.72 114.38 116.28 2bhx h ARG 58 Ca 0.13 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2bhx h ARG 58 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2bhx h ARG 58 CO -0.06 -0.01 -0.04 1.49 -1.51 0.00 0.00 179.97 179.84 2bhx h GLU 59 N -0.01 0.60 -0.52 0.20 4.81 -0.77 0.50 114.58 119.39 2bhx h GLU 59 Ca 0.14 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 59.04 2bhx h GLU 59 Cb 0.22 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2bhx h GLU 59 CO -0.29 0.76 -0.13 -0.07 -0.73 0.00 0.00 179.01 178.54 2bhx h LEU 60 N 0.39 0.99 -1.89 1.64 3.38 -0.55 -2.91 115.31 116.35 2bhx h LEU 60 Ca 0.09 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2bhx h LEU 60 Cb 0.52 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2bhx h LEU 60 CO 0.03 1.12 0.00 0.18 0.09 0.00 0.00 178.44 179.85 2bhx n LEU 61 N -4.14 2.91 -3.68 1.67 4.77 -0.30 -4.46 117.00 113.78 2bhx n LEU 61 Ca 0.01 -1.04 -0.30 0.00 -0.03 0.00 0.00 56.01 54.65 2bhx n LEU 61 Cb 0.41 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.48 2bhx n LEU 61 CO 0.45 0.52 -0.07 0.00 -1.33 0.00 0.00 177.39 176.97 2bhx n GLN 62 N 1.24 -1.15 -2.60 3.23 6.02 -0.22 -4.64 117.38 119.26 2bhx n GLN 62 Ca 0.16 0.54 -0.42 0.00 -0.01 0.00 0.00 57.00 57.27 2bhx n GLN 62 Cb 0.57 -3.88 -0.03 0.00 1.02 0.00 0.00 30.24 27.92 2bhx n GLN 62 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bhx s ILE 63 N -3.37 4.54 0.74 5.09 1.01 -0.00 -4.76 121.20 124.45 2bhx s ILE 63 Ca 0.38 1.83 -0.15 0.00 0.00 0.00 0.00 60.65 62.71 2bhx s ILE 63 Cb -0.15 -4.17 0.04 0.00 0.01 0.00 0.00 42.46 38.19 2bhx s ILE 63 CO 0.87 0.12 1.24 -2.84 0.00 0.00 0.00 174.94 174.33 2bhx s PRO 64 N 1.19 2.04 0.20 2.79 0.02 -1.26 -4.90 135.00 135.07 2bhx s PRO 64 Ca 0.54 1.88 0.17 0.00 0.02 0.00 0.00 61.00 63.61 2bhx s PRO 64 Cb -0.24 -1.81 0.82 0.00 0.02 0.00 0.00 34.50 33.30 2bhx s PRO 64 CO 0.27 -1.94 1.53 0.09 -0.33 0.00 0.00 177.00 176.62 2bhx n ASN 65 N -2.70 0.41 -1.40 2.53 3.02 -1.26 -1.45 115.26 114.41 2bhx n ASN 65 Ca 0.14 0.65 0.09 0.00 -0.03 0.00 0.00 54.58 55.44 2bhx n ASN 65 Cb 0.50 -0.72 0.32 0.00 -0.61 0.00 0.00 39.78 39.27 2bhx n ASN 65 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2bhx n ASP 66 N -2.01 4.12 -4.61 6.41 5.75 -1.26 -4.83 116.55 120.12 2bhx n ASP 66 Ca 0.01 -2.26 -0.32 0.00 -0.01 0.00 0.00 54.79 52.21 2bhx n ASP 66 Cb 0.11 -0.52 -0.10 0.00 -1.03 0.00 0.00 41.12 39.58 2bhx n ASP 66 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2bhx s TYR 67 N -1.56 2.91 0.13 2.11 1.51 -0.53 -1.54 117.35 120.38 2bhx s TYR 67 Ca 0.46 -0.03 0.09 0.00 -1.01 0.00 0.00 57.07 56.58 2bhx s TYR 67 Cb 0.28 -1.59 -0.04 0.00 -0.11 0.00 0.00 41.96 40.49 2bhx s TYR 67 CO 0.26 0.40 -0.16 -1.14 -1.11 0.00 0.00 175.55 173.80 2bhx s GLN 68 N -1.59 1.87 -0.28 -0.62 0.74 0.11 -4.89 119.66 114.99 2bhx s GLN 68 Ca 0.19 -1.20 -0.10 0.00 0.05 0.00 0.00 55.36 54.29 2bhx s GLN 68 Cb -0.11 -2.13 -0.03 0.00 1.10 0.00 0.00 33.01 31.84 2bhx s GLN 68 CO 0.09 0.47 0.15 0.42 -0.55 0.00 0.00 175.29 175.87 2bhx s ILE 69 N -1.31 4.84 0.02 -2.34 1.01 -1.26 -0.61 121.20 121.54 2bhx s ILE 69 Ca 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 60.65 60.77 2bhx s ILE 69 Cb -0.10 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 2bhx s ILE 69 CO 0.12 0.23 0.11 -0.76 0.00 0.00 0.00 174.94 174.64 2bhx s LEU 70 N 1.68 4.03 -0.29 2.97 1.43 0.91 -4.91 118.68 124.50 2bhx s LEU 70 Ca 0.06 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2bhx s LEU 70 Cb -0.16 -2.45 0.07 0.00 0.03 0.00 0.00 46.19 43.68 2bhx s LEU 70 CO 0.08 0.24 -0.06 -0.36 0.23 0.00 0.00 176.35 176.48 2bhx s PHE 71 N -1.29 3.43 0.21 0.29 2.99 -1.26 -1.18 117.98 121.17 2bhx s PHE 71 Ca 0.26 -2.53 0.11 0.00 0.00 0.00 0.00 56.93 54.77 2bhx s PHE 71 Cb -0.12 -2.25 -0.04 0.00 0.00 0.00 0.00 43.02 40.60 2bhx s PHE 71 CO 0.18 -0.90 -0.21 -0.51 -0.00 0.00 0.00 175.22 173.77 2bhx s LEU 72 N 1.04 2.54 0.54 -0.37 1.43 -0.44 -4.85 118.68 118.57 2bhx s LEU 72 Ca -0.03 -0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 52.21 2bhx s LEU 72 Cb -0.20 -1.23 0.02 0.00 0.03 0.00 0.00 46.19 44.82 2bhx s LEU 72 CO -0.06 0.10 0.79 -1.10 0.23 0.00 0.00 176.35 176.31 2bhx s GLN 73 N -2.83 2.71 0.00 1.70 -0.21 -1.26 -0.24 119.66 119.53 2bhx s GLN 73 Ca 0.23 -0.52 0.00 0.00 0.02 0.00 0.00 55.36 55.08 2bhx s GLN 73 Cb -0.08 -2.44 0.00 0.00 1.00 0.00 0.00 33.01 31.49 2bhx s GLN 73 CO 0.11 -0.64 0.00 0.41 -2.12 0.00 0.00 175.29 173.06 2bhx n GLY 74 N -2.36 1.12 0.08 3.09 0.00 -1.26 -4.87 105.19 100.99 2bhx n GLY 74 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2bhx n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhx n GLY 75 N -0.68 -1.76 0.25 -0.02 0.00 -1.26 -2.61 105.19 99.10 2bhx n GLY 75 Ca 0.00 -1.49 0.05 0.00 0.00 0.00 0.00 46.02 44.58 2bhx n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhx h ALA 76 N -0.08 1.69 -0.89 4.61 0.00 -1.94 -2.43 119.26 120.24 2bhx h ALA 76 Ca -0.00 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2bhx h ALA 76 Cb 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2bhx h ALA 76 CO 0.00 0.23 0.58 0.77 0.00 0.00 0.00 179.25 180.84 2bhx h SER 77 N 0.16 0.98 0.31 0.00 0.02 -2.01 0.12 113.55 113.12 2bhx h SER 77 Ca 0.04 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.89 2bhx h SER 77 Cb 0.22 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2bhx h SER 77 CO 0.01 0.69 -0.34 0.25 -1.14 0.00 0.00 176.83 176.30 2bhx h LEU 78 N 1.15 0.05 -1.51 5.07 5.85 -1.18 -2.13 115.31 122.60 2bhx h LEU 78 Ca 0.34 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.99 2bhx h LEU 78 Cb -0.04 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2bhx h LEU 78 CO -0.09 0.38 -0.25 1.56 -0.34 0.00 0.00 178.44 179.70 2bhx h GLN 79 N 0.04 0.00 -0.65 1.25 1.08 -0.75 -0.25 115.11 115.84 2bhx h GLN 79 Ca 0.00 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.30 2bhx h GLN 79 Cb 0.62 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.01 2bhx h GLN 79 CO 0.05 0.25 0.43 0.74 -0.95 0.00 0.00 178.83 179.35 2bhx h PHE 80 N 0.00 0.53 0.02 2.96 0.05 -0.62 -1.64 116.94 118.23 2bhx h PHE 80 Ca -0.00 0.01 -0.37 0.00 3.82 0.00 0.00 57.97 61.44 2bhx h PHE 80 Cb 0.50 -0.17 -0.06 0.00 2.00 0.00 0.00 35.95 38.22 2bhx h PHE 80 CO 0.00 0.25 -2.26 -2.37 -0.18 0.00 0.00 178.31 173.75 2bhx n THR 81 N -4.48 1.53 -0.03 -1.55 5.66 -0.91 -4.27 114.28 110.23 2bhx n THR 81 Ca 0.11 -0.71 0.04 0.00 -3.05 0.00 0.00 64.05 60.43 2bhx n THR 81 Cb 0.36 -1.11 0.41 0.00 -1.55 0.00 0.00 70.33 68.43 2bhx n THR 81 CO 0.00 0.00 0.00 0.24 -3.05 0.00 0.00 175.07 172.26 2bhx h MET 82 N 0.01 0.59 0.39 1.09 2.86 -0.91 -0.55 114.93 118.42 2bhx h MET 82 Ca -0.50 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.08 2bhx h MET 82 Cb 2.05 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.58 2bhx h MET 82 CO 0.00 0.39 -0.19 1.25 1.06 0.00 0.00 176.91 179.42 2bhx h LEU 83 N 0.61 -0.45 -1.35 1.22 5.85 -1.49 -1.82 115.31 117.87 2bhx h LEU 83 Ca 0.17 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2bhx h LEU 83 Cb -0.06 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2bhx h LEU 83 CO -0.04 -0.08 -0.01 1.55 -0.34 0.00 0.00 178.44 179.52 2bhx h PRO 84 N -0.87 0.42 -0.29 5.25 0.13 -1.72 -0.77 132.00 134.14 2bhx h PRO 84 Ca -0.05 -0.08 0.07 0.00 -0.87 0.00 0.00 66.00 65.07 2bhx h PRO 84 Cb 0.55 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 2bhx h PRO 84 CO 0.09 0.45 0.21 1.98 -0.23 0.00 0.00 178.00 180.50 2bhx h MET 85 N 0.40 0.05 0.04 0.86 4.05 -0.85 -0.27 114.93 119.22 2bhx h MET 85 Ca 0.09 -0.00 -0.34 0.00 -0.28 0.00 0.00 59.70 59.16 2bhx h MET 85 Cb 0.29 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.03 2bhx h MET 85 CO 0.01 0.04 -2.03 0.09 0.23 0.00 0.00 176.91 175.25 2bhx n ASN 86 N -4.46 1.22 -0.00 1.39 3.02 -0.71 -4.66 115.26 111.06 2bhx n ASN 86 Ca 0.04 0.20 0.04 0.00 -0.03 0.00 0.00 54.58 54.83 2bhx n ASN 86 Cb 0.34 -0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.31 2bhx n ASN 86 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2bhx n LEU 87 N -3.14 0.04 -4.52 3.41 4.77 -0.37 -4.81 117.00 112.37 2bhx n LEU 87 Ca -0.28 -0.05 -0.43 0.00 -0.03 0.00 0.00 56.01 55.21 2bhx n LEU 87 Cb 1.06 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.15 2bhx n LEU 87 CO 0.41 0.01 1.57 -0.22 -1.33 0.00 0.00 177.39 177.83 2bhx s LEU 88 N -3.38 4.43 0.46 2.23 2.96 -0.13 -4.83 118.68 120.44 2bhx s LEU 88 Ca -0.02 -2.51 0.02 0.00 -0.22 0.00 0.00 54.13 51.40 2bhx s LEU 88 Cb 0.05 -2.49 0.01 0.00 0.50 0.00 0.00 46.19 44.26 2bhx s LEU 88 CO 0.30 -1.02 0.67 0.42 -1.32 0.00 0.00 176.35 175.40 2bhx s THR 89 N 3.06 3.56 0.24 3.68 -4.23 -1.26 -4.87 115.64 115.82 2bhx s THR 89 Ca 0.46 -0.64 -0.31 0.00 -1.18 0.00 0.00 61.69 60.02 2bhx s THR 89 Cb -0.00 -3.30 -0.14 0.00 1.34 0.00 0.00 72.50 70.40 2bhx s THR 89 CO 0.01 -0.19 1.38 2.29 -0.54 0.00 0.00 174.62 177.57 2bhx n LYS 90 N -2.09 1.96 -0.39 3.99 0.00 -1.26 -0.86 118.16 119.51 2bhx n LYS 90 Ca 0.04 0.70 0.00 0.00 -0.00 0.00 0.00 58.31 59.04 2bhx n LYS 90 Cb 0.58 -2.34 0.00 0.00 -0.00 0.00 0.00 35.03 33.27 2bhx n LYS 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2bhx n GLY 91 N 2.12 1.28 3.82 2.58 0.00 -1.26 -5.04 105.19 108.69 2bhx n GLY 91 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 2bhx n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bhx s THR 92 N -3.05 2.82 -0.04 2.61 -4.23 -0.04 -4.89 115.64 108.82 2bhx s THR 92 Ca 0.00 -1.48 0.04 0.00 -1.18 0.00 0.00 61.69 59.06 2bhx s THR 92 Cb 0.00 -3.03 -0.00 0.00 1.34 0.00 0.00 72.50 70.81 2bhx s THR 92 CO 0.00 -0.07 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.23 2bhx s ILE 93 N -2.46 1.31 -0.51 2.99 1.01 0.21 -4.09 121.20 119.65 2bhx s ILE 93 Ca 0.43 -0.64 -0.21 0.00 0.00 0.00 0.00 60.65 60.24 2bhx s ILE 93 Cb -0.02 -1.13 0.05 0.00 0.01 0.00 0.00 42.46 41.37 2bhx s ILE 93 CO 0.26 0.38 0.71 -0.83 0.00 0.00 0.00 174.94 175.46 2bhx s GLY 94 N 0.13 1.67 -0.20 6.18 0.00 0.20 0.11 107.32 115.41 2bhx s GLY 94 Ca -0.05 -1.58 -0.12 0.00 0.00 0.00 0.00 44.72 42.97 2bhx s GLY 94 CO 0.02 1.63 0.22 0.21 0.00 0.00 0.00 173.10 175.18 2bhx s ASN 95 N 2.69 6.28 -0.03 1.64 2.47 -1.09 -0.91 114.94 125.99 2bhx s ASN 95 Ca 0.20 0.31 0.07 0.00 0.42 0.00 0.00 52.86 53.85 2bhx s ASN 95 Cb -0.17 -2.14 -0.01 0.00 -1.45 0.00 0.00 41.25 37.47 2bhx s ASN 95 CO 0.14 0.09 -0.24 -0.31 -3.72 0.00 0.00 177.10 173.06 2bhx s TYR 96 N 0.74 2.21 -0.29 0.43 1.51 -0.43 0.11 117.35 121.63 2bhx s TYR 96 Ca 0.12 -0.51 -0.12 0.00 -1.01 0.00 0.00 57.07 55.55 2bhx s TYR 96 Cb -0.13 -1.43 -0.04 0.00 -0.11 0.00 0.00 41.96 40.24 2bhx s TYR 96 CO 0.03 -0.10 0.21 0.08 -1.11 0.00 0.00 175.55 174.66 2bhx s VAL 97 N -0.39 5.29 -0.36 0.71 1.01 -0.07 -0.80 120.40 125.79 2bhx s VAL 97 Ca 0.04 0.14 -0.20 0.00 0.00 0.00 0.00 61.98 61.96 2bhx s VAL 97 Cb -0.11 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2bhx s VAL 97 CO 0.01 0.20 0.61 -0.76 0.00 0.00 0.00 175.10 175.15 2bhx s LEU 98 N 1.78 4.31 -0.01 3.92 1.43 -0.63 -4.44 118.68 125.04 2bhx s LEU 98 Ca 0.08 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.24 2bhx s LEU 98 Cb -0.16 -2.73 0.02 0.00 0.03 0.00 0.00 46.19 43.35 2bhx s LEU 98 CO 0.11 -0.59 0.82 0.35 0.23 0.00 0.00 176.35 177.27 2bhx n THR 99 N 5.58 0.63 -3.15 5.49 -2.24 -1.26 -2.42 114.28 116.91 2bhx n THR 99 Ca -0.02 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2bhx n THR 99 Cb 0.49 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 2bhx n THR 99 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bhx n GLY 100 N -0.36 -1.20 0.26 3.38 0.00 -1.26 -4.84 105.19 101.18 2bhx n GLY 100 Ca 0.01 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.10 2bhx n GLY 100 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bhx h SER 101 N 0.00 0.85 -0.40 1.61 0.87 -1.99 -2.44 113.55 112.05 2bhx h SER 101 Ca 0.00 -0.26 -0.04 0.00 -1.23 0.00 0.00 61.79 60.26 2bhx h SER 101 Cb 0.00 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.71 2bhx h SER 101 CO 0.00 0.89 0.12 -0.50 -0.53 0.00 0.00 176.83 176.81 2bhx h TRP 102 N 0.77 0.71 -0.76 2.24 4.06 -1.97 -0.30 115.95 120.71 2bhx h TRP 102 Ca 0.16 -0.05 -0.02 0.00 2.06 0.00 0.00 58.89 61.04 2bhx h TRP 102 Cb 0.41 -0.21 -0.04 0.00 -1.00 0.00 0.00 29.16 28.32 2bhx h TRP 102 CO 0.03 0.61 0.39 0.77 -3.56 0.00 0.00 178.44 176.68 2bhx h SER 103 N 0.68 0.97 -0.73 -3.49 0.02 -1.82 -2.12 113.55 107.06 2bhx h SER 103 Ca 0.16 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2bhx h SER 103 Cb 0.25 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 2bhx h SER 103 CO -0.00 0.81 0.32 -0.33 -1.14 0.00 0.00 176.83 176.49 2bhx h GLU 104 N 1.06 1.08 -0.55 3.45 5.08 -0.87 -1.88 114.58 121.94 2bhx h GLU 104 Ca 0.26 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2bhx h GLU 104 Cb 0.08 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2bhx h GLU 104 CO -0.04 0.86 0.11 0.87 -1.00 0.00 0.00 179.01 179.81 2bhx h LYS 105 N 1.07 0.86 -0.18 2.33 1.79 -0.75 -0.98 116.57 120.71 2bhx h LYS 105 Ca 0.25 -0.19 -0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2bhx h LYS 105 Cb 0.16 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 2bhx h LYS 105 CO -0.03 0.79 0.10 0.00 -1.08 0.00 0.00 179.45 179.23 2bhx h ALA 106 N 1.29 0.23 -0.48 3.86 0.00 -1.09 -3.02 119.26 120.06 2bhx h ALA 106 Ca 0.18 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2bhx h ALA 106 Cb 0.34 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2bhx h ALA 106 CO 0.00 -0.23 0.27 1.25 0.00 0.00 0.00 179.25 180.54 2bhx h LEU 107 N 0.19 0.41 -0.83 0.00 5.85 -1.00 -2.31 115.31 117.62 2bhx h LEU 107 Ca 0.06 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.90 2bhx h LEU 107 Cb 0.07 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 40.95 2bhx h LEU 107 CO -0.01 0.29 0.47 0.50 -0.34 0.00 0.00 178.44 179.35 2bhx h LYS 108 N 0.53 0.75 -0.29 1.25 3.64 -1.11 -0.89 116.57 120.45 2bhx h LYS 108 Ca 0.20 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 2bhx h LYS 108 Cb 0.07 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2bhx h LYS 108 CO -0.12 0.49 -0.29 0.93 -2.27 0.00 0.00 179.45 178.20 2bhx h GLU 109 N 0.77 0.60 -0.21 1.90 4.39 -1.30 -2.32 114.58 118.42 2bhx h GLU 109 Ca 0.41 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.78 2bhx h GLU 109 Cb 0.41 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2bhx h GLU 109 CO -0.26 0.82 -0.22 0.00 -1.16 0.00 0.00 179.01 178.19 2bhx h ALA 110 N 1.17 1.24 0.00 3.43 0.00 -0.99 -2.45 119.26 121.67 2bhx h ALA 110 Ca 0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2bhx h ALA 110 Cb 0.76 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2bhx h ALA 110 CO 0.06 0.50 -0.00 0.87 0.00 0.00 0.00 179.25 180.68 2bhx h LYS 111 N 0.34 0.00 0.00 0.00 1.57 -0.64 0.25 116.57 118.09 2bhx h LYS 111 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2bhx h LYS 111 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2bhx h LYS 111 CO 0.04 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.85 2bhx h LEU 112 N 0.00 0.00 0.00 2.94 3.38 -1.28 -3.34 115.31 117.01 2bhx h LEU 112 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bhx h LEU 112 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2bhx h LEU 112 CO 0.00 0.00 -0.47 0.18 0.09 0.00 0.00 178.44 178.24 2bhx n LEU 113 N -3.05 0.00 0.00 1.67 4.77 0.70 -5.11 117.00 115.98 2bhx n LEU 113 Ca 0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2bhx n LEU 113 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2bhx n LEU 113 CO 0.27 0.00 0.03 0.61 -1.33 0.00 0.00 177.39 176.96 2bhx n GLY 114 N 1.66 0.87 3.72 -0.72 0.00 -0.11 -4.99 105.19 105.62 2bhx n GLY 114 Ca 0.00 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2bhx n GLY 114 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bhx s GLU 115 N -2.00 4.32 0.30 1.61 0.41 -1.26 -4.45 118.70 117.64 2bhx s GLU 115 Ca 0.01 2.07 0.10 0.00 -0.41 0.00 0.00 54.97 56.73 2bhx s GLU 115 Cb -0.00 -3.25 -0.06 0.00 -1.78 0.00 0.00 34.13 29.04 2bhx s GLU 115 CO 0.00 -0.43 -0.12 0.95 -0.49 0.00 0.00 175.26 175.17 2bhx s THR 116 N 1.07 2.17 0.05 3.63 -4.23 -1.26 0.60 115.64 117.67 2bhx s THR 116 Ca 0.64 -2.25 -0.04 0.00 -1.18 0.00 0.00 61.69 58.86 2bhx s THR 116 Cb -0.37 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 70.99 2bhx s THR 116 CO 0.30 -0.30 0.07 -2.28 -0.54 0.00 0.00 174.62 171.87 2bhx s HIS 117 N -2.68 0.30 -0.33 3.99 2.46 -0.09 -4.80 115.29 114.14 2bhx s HIS 117 Ca 0.30 -0.71 -0.04 0.00 0.47 0.00 0.00 55.06 55.08 2bhx s HIS 117 Cb 0.00 -0.21 0.05 0.00 -0.13 0.00 0.00 32.58 32.29 2bhx s HIS 117 CO 0.15 -0.40 0.07 0.42 -2.47 0.00 0.00 174.74 172.50 2bhx s ILE 118 N -3.28 3.43 0.20 0.89 1.01 -1.26 -1.31 121.20 120.88 2bhx s ILE 118 Ca 0.01 -1.31 -0.05 0.00 0.00 0.00 0.00 60.65 59.30 2bhx s ILE 118 Cb 0.03 -2.98 0.02 0.00 0.01 0.00 0.00 42.46 39.54 2bhx s ILE 118 CO -0.08 -0.19 1.60 0.00 0.00 0.00 0.00 174.94 176.27 2bhx h ALA 119 N 8.12 0.83 -2.00 9.38 0.00 -1.17 -3.44 119.26 130.97 2bhx h ALA 119 Ca -0.22 -0.39 0.10 0.00 0.00 0.00 0.00 54.91 54.40 2bhx h ALA 119 Cb 1.07 -0.15 -0.18 0.00 0.00 0.00 0.00 17.79 18.53 2bhx h ALA 119 CO 0.58 0.64 0.51 0.00 0.00 0.00 0.00 179.25 180.98 2bhx s ALA 120 N -4.57 -1.87 -0.19 0.00 0.00 -1.26 -0.15 121.76 113.74 2bhx s ALA 120 Ca -0.09 1.24 -0.22 0.00 0.00 0.00 0.00 51.96 52.88 2bhx s ALA 120 Cb 0.13 0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.31 2bhx s ALA 120 CO 0.84 -0.54 0.60 0.45 0.00 0.00 0.00 175.76 177.11 2bhx s SER 121 N -1.96 -0.61 -0.19 0.00 0.15 -1.26 -1.60 113.70 108.24 2bhx s SER 121 Ca 0.02 1.07 0.16 0.00 0.70 0.00 0.00 55.95 57.90 2bhx s SER 121 Cb -0.01 1.07 0.52 0.00 -1.71 0.00 0.00 66.02 65.89 2bhx s SER 121 CO -0.04 -0.29 1.42 0.35 1.20 0.00 0.00 173.24 175.88 2bhx n THR 122 N 2.37 2.32 0.24 6.45 -2.24 -1.02 -4.72 114.28 117.67 2bhx n THR 122 Ca -0.15 -1.99 0.07 0.00 -2.27 0.00 0.00 64.05 59.70 2bhx n THR 122 Cb 0.56 -0.27 0.57 0.00 -2.10 0.00 0.00 70.33 69.09 2bhx n THR 122 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2bhx h LYS 123 N 1.64 0.00 -0.37 -0.78 3.64 -1.95 -0.39 116.57 118.36 2bhx h LYS 123 Ca 0.03 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 2bhx h LYS 123 Cb 1.47 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.27 2bhx h LYS 123 CO 0.24 0.12 -0.04 0.00 -2.27 0.00 0.00 179.45 177.51 2bhx h ALA 124 N 1.88 1.25 -0.85 5.00 0.00 -1.99 -1.92 119.26 122.63 2bhx h ALA 124 Ca -0.00 -0.24 -0.36 0.00 0.00 0.00 0.00 54.91 54.31 2bhx h ALA 124 Cb 0.23 -0.16 -0.21 0.00 0.00 0.00 0.00 17.79 17.65 2bhx h ALA 124 CO 0.02 0.50 0.44 0.09 0.00 0.00 0.00 179.25 180.29 2bhx n ASN 125 N -4.24 4.30 -2.26 0.00 4.13 -1.06 -4.91 115.26 111.22 2bhx n ASN 125 Ca 0.02 -3.42 -0.17 0.00 1.68 0.00 0.00 54.58 52.69 2bhx n ASN 125 Cb 0.28 -0.79 0.02 0.00 -1.54 0.00 0.00 39.78 37.75 2bhx n ASN 125 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2bhx n SER 126 N -0.63 -5.09 -3.55 6.41 7.64 -0.72 -3.61 113.62 114.06 2bhx n SER 126 Ca 0.50 -0.17 -0.20 0.00 1.01 0.00 0.00 58.87 60.01 2bhx n SER 126 Cb 1.52 -4.01 0.05 0.00 -1.01 0.00 0.00 64.21 60.76 2bhx n SER 126 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2bhx n TYR 127 N -4.18 -2.07 1.11 1.43 0.53 -0.18 -4.89 117.16 108.90 2bhx n TYR 127 Ca -0.12 0.82 0.12 0.00 -1.02 0.00 0.00 57.90 57.70 2bhx n TYR 127 Cb 0.61 -4.39 0.21 0.00 -1.03 0.00 0.00 39.34 34.74 2bhx n TYR 127 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 2bhx n GLN 128 N -4.04 0.63 -3.85 -0.72 6.02 -1.24 -4.84 117.38 109.34 2bhx n GLN 128 Ca -0.23 -0.43 -0.10 0.00 -0.01 0.00 0.00 57.00 56.24 2bhx n GLN 128 Cb 0.66 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.37 2bhx n GLN 128 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2bhx s SER 129 N -2.67 -0.09 -0.10 1.08 1.04 -1.26 -0.16 113.70 111.55 2bhx s SER 129 Ca 0.18 -0.68 -0.24 0.00 0.48 0.00 0.00 55.95 55.69 2bhx s SER 129 Cb 0.18 0.49 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 2bhx s SER 129 CO 0.61 -0.95 0.72 -0.63 0.98 0.00 0.00 173.24 173.98 2bhx s ILE 130 N -3.92 5.01 0.71 -1.02 -1.09 -1.26 -4.74 121.20 114.88 2bhx s ILE 130 Ca 0.13 1.46 -0.14 0.00 -2.23 0.00 0.00 60.65 59.87 2bhx s ILE 130 Cb 0.02 -4.05 0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2bhx s ILE 130 CO -0.02 0.19 1.14 -2.16 -1.23 0.00 0.00 174.94 172.85 2bhx s PRO 131 N 1.23 2.42 0.31 2.79 0.04 -1.26 -4.96 135.00 135.56 2bhx s PRO 131 Ca 0.37 1.47 -0.29 0.00 0.04 0.00 0.00 61.00 62.58 2bhx s PRO 131 Cb -0.17 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.36 2bhx s PRO 131 CO 0.16 -1.56 1.51 -0.51 0.04 0.00 0.00 177.00 176.64 2bhx s ASP 132 N -2.56 6.45 0.49 6.66 -0.00 -1.26 -4.90 116.67 121.56 2bhx s ASP 132 Ca 0.68 2.90 0.23 0.00 -0.00 0.00 0.00 52.55 56.36 2bhx s ASP 132 Cb -0.22 -2.64 1.29 0.00 -0.00 0.00 0.00 42.92 41.34 2bhx s ASP 132 CO 0.46 -0.83 2.03 -0.26 -0.00 0.00 0.00 175.17 176.57 2bhx h PHE 133 N 4.27 0.00 0.00 4.23 0.05 -2.00 0.20 116.94 123.69 2bhx h PHE 133 Ca -0.48 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.31 2bhx h PHE 133 Cb 1.23 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.18 2bhx h PHE 133 CO 0.57 0.15 0.00 0.66 -0.18 0.00 0.00 178.31 179.52 2bhx h SER 134 N 0.00 0.00 0.02 2.17 4.64 -2.03 -1.64 113.55 116.72 2bhx h SER 134 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bhx h SER 134 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2bhx h SER 134 CO 0.02 0.00 -0.02 -0.62 -0.87 0.00 0.00 176.83 175.34 2bhx n GLU 135 N -2.56 1.43 -2.14 4.77 1.02 0.71 -4.87 120.64 119.01 2bhx n GLU 135 Ca -0.01 -0.71 -0.43 0.00 -0.02 0.00 0.00 57.16 55.99 2bhx n GLU 135 Cb 0.12 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.03 2bhx n GLU 135 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2bhx s PHE 136 N -2.06 2.23 -0.59 -0.32 0.40 -0.62 -4.65 117.98 112.37 2bhx s PHE 136 Ca 0.39 0.47 -0.26 0.00 -0.60 0.00 0.00 56.93 56.93 2bhx s PHE 136 Cb 0.21 -3.82 0.04 0.00 0.51 0.00 0.00 43.02 39.96 2bhx s PHE 136 CO 0.36 -3.11 1.05 -0.65 0.70 0.00 0.00 175.22 173.57 2bhx s GLN 137 N 4.02 3.35 0.04 0.44 -0.21 0.78 -5.01 119.66 123.08 2bhx s GLN 137 Ca 0.68 -0.16 -0.00 0.00 0.02 0.00 0.00 55.36 55.90 2bhx s GLN 137 Cb -0.29 -4.07 -0.04 0.00 1.00 0.00 0.00 33.01 29.61 2bhx s GLN 137 CO 0.25 -1.64 0.18 -0.51 -2.12 0.00 0.00 175.29 171.45 2bhx s LEU 138 N 4.44 4.27 -0.03 2.90 1.43 -1.26 -4.36 118.68 126.08 2bhx s LEU 138 Ca 0.34 0.25 0.06 0.00 -1.03 0.00 0.00 54.13 53.76 2bhx s LEU 138 Cb -0.11 -2.77 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 2bhx s LEU 138 CO 0.20 0.20 -0.22 0.20 0.23 0.00 0.00 176.35 176.97 2bhx s ASN 139 N -2.29 3.43 0.48 2.29 0.01 -1.26 -5.04 114.94 112.56 2bhx s ASN 139 Ca 0.31 -0.38 0.15 0.00 -0.71 0.00 0.00 52.86 52.24 2bhx s ASN 139 Cb -0.13 -0.53 1.12 0.00 0.41 0.00 0.00 41.25 42.12 2bhx s ASN 139 CO 0.24 0.32 2.07 1.05 -1.51 0.00 0.00 177.10 179.27 2bhx h GLU 140 N 5.37 0.02 -0.78 -0.60 4.11 -2.00 -2.18 114.58 118.51 2bhx h GLU 140 Ca -0.45 -0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.79 2bhx h GLU 140 Cb 1.13 -0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.26 2bhx h GLU 140 CO 0.48 0.10 0.25 0.27 0.07 0.00 0.00 179.01 180.18 2bhx n ASN 141 N -4.43 4.59 -4.72 3.06 6.94 -1.26 -4.96 115.26 114.48 2bhx n ASN 141 Ca -0.03 -3.09 -0.42 0.00 -0.02 0.00 0.00 54.58 51.03 2bhx n ASN 141 Cb 0.17 -0.73 -0.03 0.00 -2.36 0.00 0.00 39.78 36.83 2bhx n ASN 141 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2bhx s ASP 142 N -0.84 6.53 0.23 0.53 1.01 -0.82 -0.62 116.67 122.68 2bhx s ASP 142 Ca 0.50 2.70 0.10 0.00 0.71 0.00 0.00 52.55 56.56 2bhx s ASP 142 Cb 0.40 -2.60 0.18 0.00 1.01 0.00 0.00 42.92 41.90 2bhx s ASP 142 CO 0.12 -0.85 1.50 0.00 0.21 0.00 0.00 175.17 176.15 2bhx h ALA 143 N 6.48 0.76 -2.19 5.23 0.00 0.40 -3.44 119.26 126.49 2bhx h ALA 143 Ca -0.43 -0.66 0.19 0.00 0.00 0.00 0.00 54.91 54.01 2bhx h ALA 143 Cb 1.21 -0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.78 2bhx h ALA 143 CO 0.90 0.91 0.54 1.52 0.00 0.00 0.00 179.25 183.12 2bhx s TYR 144 N -3.28 -0.15 -0.14 0.00 1.13 -1.25 -4.19 117.35 109.48 2bhx s TYR 144 Ca -0.00 -0.10 0.01 0.00 -1.41 0.00 0.00 57.07 55.57 2bhx s TYR 144 Cb 0.11 0.61 -0.00 0.00 -1.10 0.00 0.00 41.96 41.58 2bhx s TYR 144 CO 0.78 -0.70 -0.16 -1.17 -2.51 0.00 0.00 175.55 171.79 2bhx s LEU 145 N -2.86 2.46 -0.16 -3.49 2.96 0.99 -2.66 118.68 115.92 2bhx s LEU 145 Ca 0.11 -0.46 -0.04 0.00 -0.22 0.00 0.00 54.13 53.53 2bhx s LEU 145 Cb -0.00 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.11 2bhx s LEU 145 CO -0.00 0.11 -0.04 -2.28 -1.32 0.00 0.00 176.35 172.82 2bhx s HIS 146 N 0.66 3.02 0.28 5.38 5.65 0.12 -0.25 115.29 130.15 2bhx s HIS 146 Ca -0.08 -0.33 0.06 0.00 0.25 0.00 0.00 55.06 54.95 2bhx s HIS 146 Cb -0.16 -1.97 -0.06 0.00 -1.18 0.00 0.00 32.58 29.22 2bhx s HIS 146 CO 0.02 -0.06 -0.03 0.96 -0.65 0.00 0.00 174.74 174.98 2bhx s ILE 147 N 0.43 1.50 -0.32 0.89 -4.36 0.06 -0.89 121.20 118.51 2bhx s ILE 147 Ca -0.04 -2.09 0.01 0.00 -0.26 0.00 0.00 60.65 58.27 2bhx s ILE 147 Cb -0.14 -2.51 0.08 0.00 1.25 0.00 0.00 42.46 41.14 2bhx s ILE 147 CO 0.03 -0.25 0.03 -0.89 0.24 0.00 0.00 174.94 174.10 2bhx s THR 148 N -3.10 2.65 0.20 8.37 2.01 -1.26 -1.08 115.64 123.43 2bhx s THR 148 Ca 0.31 -1.84 -0.11 0.00 0.31 0.00 0.00 61.69 60.36 2bhx s THR 148 Cb 0.05 -2.71 0.13 0.00 0.01 0.00 0.00 72.50 69.99 2bhx s THR 148 CO 0.12 -0.34 1.83 0.77 -0.69 0.00 0.00 174.62 176.31 2bhx h SER 149 N 7.84 0.87 -3.17 3.53 4.64 -1.80 -3.40 113.55 122.06 2bhx h SER 149 Ca -0.14 -0.08 -0.55 0.00 -0.47 0.00 0.00 61.79 60.55 2bhx h SER 149 Cb 1.04 -0.22 -0.36 0.00 -0.31 0.00 0.00 62.40 62.55 2bhx h SER 149 CO 0.54 0.70 -0.81 0.21 -0.87 0.00 0.00 176.83 176.60 2bhx s ASN 150 N -5.98 2.32 -0.91 4.97 3.84 -1.26 -1.17 114.94 116.74 2bhx s ASN 150 Ca -0.13 -0.36 -0.18 0.00 0.21 0.00 0.00 52.86 52.40 2bhx s ASN 150 Cb 0.14 -0.95 0.15 0.00 -0.55 0.00 0.00 41.25 40.04 2bhx s ASN 150 CO 0.79 -0.09 1.05 0.20 -2.79 0.00 0.00 177.10 176.26 2bhx s ASN 151 N 1.57 6.67 0.41 -4.21 0.01 0.45 -4.64 114.94 115.19 2bhx s ASN 151 Ca 0.04 -2.20 0.14 0.00 -0.71 0.00 0.00 52.86 50.13 2bhx s ASN 151 Cb -0.13 -2.36 1.00 0.00 0.41 0.00 0.00 41.25 40.17 2bhx s ASN 151 CO -0.08 -0.95 1.91 0.74 -1.51 0.00 0.00 177.10 177.21 2bhx h THR 152 N 5.59 0.82 0.00 1.60 2.02 -1.96 0.15 112.91 121.13 2bhx h THR 152 Ca 0.15 -0.16 -0.24 0.00 0.77 0.00 0.00 66.41 66.93 2bhx h THR 152 Cb 1.03 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 2bhx h THR 152 CO 1.03 0.09 -1.39 0.40 0.37 0.00 0.00 175.52 176.02 2bhx h ILE 153 N 0.48 1.02 0.00 3.11 2.04 -1.96 -3.36 117.51 118.84 2bhx h ILE 153 Ca 0.38 -2.75 0.00 0.00 1.00 0.00 0.00 64.86 63.49 2bhx h ILE 153 Cb 0.79 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 2bhx h ILE 153 CO -0.13 0.58 -1.44 -1.22 0.00 0.00 0.00 178.15 175.94 2bhx n TYR 154 N -3.11 0.06 -1.36 1.37 4.02 -0.71 -4.78 117.16 112.64 2bhx n TYR 154 Ca -0.10 0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 2bhx n TYR 154 Cb 0.97 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.98 2bhx n TYR 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bhx n GLY 155 N 1.37 0.54 3.54 2.72 0.00 0.44 -4.46 105.19 109.34 2bhx n GLY 155 Ca 0.00 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 2bhx n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bhx s THR 156 N -2.00 2.89 -0.19 2.61 -4.23 -1.23 -0.97 115.64 112.52 2bhx s THR 156 Ca 0.00 -2.09 -0.15 0.00 -1.18 0.00 0.00 61.69 58.27 2bhx s THR 156 Cb 0.00 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.39 2bhx s THR 156 CO 0.00 -0.32 0.49 -1.58 -0.54 0.00 0.00 174.62 172.68 2bhx s GLN 157 N -3.37 0.54 0.16 3.99 0.74 0.03 -0.41 119.66 121.33 2bhx s GLN 157 Ca 0.29 0.77 -0.34 0.00 0.05 0.00 0.00 55.36 56.13 2bhx s GLN 157 Cb -0.06 0.19 -0.14 0.00 1.10 0.00 0.00 33.01 34.09 2bhx s GLN 157 CO 0.16 -0.10 1.58 0.66 -0.55 0.00 0.00 175.29 177.04 2bhx n TYR 158 N 3.35 2.29 0.10 1.67 4.02 -0.32 -4.69 117.16 123.59 2bhx n TYR 158 Ca -0.17 0.26 0.01 0.00 -0.01 0.00 0.00 57.90 57.99 2bhx n TYR 158 Cb 0.56 -2.55 -0.02 0.00 -0.02 0.00 0.00 39.34 37.32 2bhx n TYR 158 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2bhx h GLN 159 N 5.98 0.00 -3.04 -0.72 1.08 -1.91 -3.48 115.11 113.01 2bhx h GLN 159 Ca -0.45 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 56.80 2bhx h GLN 159 Cb 1.25 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.64 2bhx h GLN 159 CO 0.89 0.47 0.21 0.54 -0.95 0.00 0.00 178.83 180.00 2bhx s ASN 160 N -6.28 -0.21 0.06 1.46 4.22 -1.26 -5.19 114.94 107.74 2bhx s ASN 160 Ca 0.02 -0.71 0.09 0.00 -2.14 0.00 0.00 52.86 50.12 2bhx s ASN 160 Cb 0.08 0.74 -0.03 0.00 1.28 0.00 0.00 41.25 43.32 2bhx s ASN 160 CO 0.77 -1.39 -0.26 -0.36 -2.04 0.00 0.00 177.10 173.83 2bhx s PHE 161 N -3.69 2.24 0.47 1.54 0.40 -1.26 -5.11 117.98 112.57 2bhx s PHE 161 Ca 0.12 -0.40 -0.22 0.00 -0.60 0.00 0.00 56.93 55.83 2bhx s PHE 161 Cb -0.06 -1.33 -0.07 0.00 0.51 0.00 0.00 43.02 42.07 2bhx s PHE 161 CO 0.08 0.15 1.15 -1.25 0.70 0.00 0.00 175.22 176.04 2bhx s PRO 162 N -1.33 3.73 -0.23 0.24 0.04 -1.26 -5.00 135.00 131.19 2bhx s PRO 162 Ca 0.11 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.61 2bhx s PRO 162 Cb -0.10 -2.34 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 2bhx s PRO 162 CO 0.02 -0.56 0.88 -1.21 0.04 0.00 0.00 177.00 176.17 2bhx s GLU 163 N -2.79 4.21 -0.07 4.56 2.02 -1.26 -5.03 118.70 120.34 2bhx s GLU 163 Ca 0.65 1.05 0.01 0.00 0.02 0.00 0.00 54.97 56.70 2bhx s GLU 163 Cb -0.27 -3.64 0.02 0.00 0.10 0.00 0.00 34.13 30.34 2bhx s GLU 163 CO 0.32 -0.52 -0.09 0.42 0.02 0.00 0.00 175.26 175.41 2bhx s ILE 164 N 2.85 0.96 0.00 -1.63 -1.09 -1.26 -5.02 121.20 116.00 2bhx s ILE 164 Ca 0.37 -0.35 0.00 0.00 -2.23 0.00 0.00 60.65 58.45 2bhx s ILE 164 Cb -0.15 -0.92 0.00 0.00 -1.58 0.00 0.00 42.46 39.81 2bhx s ILE 164 CO 0.08 0.32 0.00 0.59 -1.23 0.00 0.00 174.94 174.70 2bhx n ASN 165 N 4.09 0.95 0.12 3.58 3.02 -1.26 -4.73 115.26 121.02 2bhx n ASN 165 Ca -0.21 -0.26 0.12 0.00 -0.03 0.00 0.00 54.58 54.20 2bhx n ASN 165 Cb 0.51 0.70 0.17 0.00 -0.61 0.00 0.00 39.78 40.55 2bhx n ASN 165 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 2bhx h HIS 166 N 0.00 0.00 -3.08 3.10 2.07 -1.98 -3.47 115.15 111.79 2bhx h HIS 166 Ca 0.00 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.49 2bhx h HIS 166 Cb 0.00 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 29.85 2bhx h HIS 166 CO 0.00 0.00 0.13 0.00 -3.07 0.00 0.00 177.93 174.99 2bhx s ALA 167 N -3.22 -1.42 0.30 6.11 0.00 -1.26 -4.89 121.76 117.39 2bhx s ALA 167 Ca 0.05 0.36 -0.29 0.00 0.00 0.00 0.00 51.96 52.09 2bhx s ALA 167 Cb 0.10 0.80 -0.09 0.00 0.00 0.00 0.00 23.12 23.93 2bhx s ALA 167 CO 0.71 -0.72 1.12 -1.25 0.00 0.00 0.00 175.76 175.61 2bhx s PRO 168 N -3.67 4.53 -0.16 0.00 0.04 -1.26 -4.74 135.00 129.73 2bhx s PRO 168 Ca 0.01 1.82 -0.24 0.00 0.04 0.00 0.00 61.00 62.63 2bhx s PRO 168 Cb -0.00 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 2bhx s PRO 168 CO -0.12 0.10 0.79 -1.17 0.04 0.00 0.00 177.00 176.64 2bhx s LEU 169 N -1.67 4.19 -0.08 -3.56 2.96 -1.26 -0.01 118.68 119.25 2bhx s LEU 169 Ca 0.47 1.12 0.03 0.00 -0.22 0.00 0.00 54.13 55.53 2bhx s LEU 169 Cb -0.32 -3.17 -0.02 0.00 0.50 0.00 0.00 46.19 43.19 2bhx s LEU 169 CO 0.41 -0.35 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.31 2bhx s ILE 170 N 1.95 2.91 -0.04 6.68 -1.09 0.65 -1.28 121.20 130.98 2bhx s ILE 170 Ca 0.37 -0.75 0.02 0.00 -2.23 0.00 0.00 60.65 58.05 2bhx s ILE 170 Cb -0.17 -2.16 0.01 0.00 -1.58 0.00 0.00 42.46 38.57 2bhx s ILE 170 CO 0.13 0.56 -0.07 0.00 -1.23 0.00 0.00 174.94 174.33 2bhx s ALA 171 N -0.22 0.78 -0.71 9.38 0.00 -0.53 -0.76 121.76 129.69 2bhx s ALA 171 Ca 0.00 -0.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.50 2bhx s ALA 171 Cb -0.13 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.64 2bhx s ALA 171 CO 0.03 0.07 1.26 0.34 0.00 0.00 0.00 175.76 177.46 2bhx s ASP 172 N 0.57 6.20 -0.31 0.00 -1.08 -0.24 -1.56 116.67 120.24 2bhx s ASP 172 Ca -0.08 -0.38 0.10 0.00 -0.52 0.00 0.00 52.55 51.66 2bhx s ASP 172 Cb -0.12 -2.56 0.62 0.00 -1.46 0.00 0.00 42.92 39.40 2bhx s ASP 172 CO 0.01 -1.78 1.66 0.23 0.52 0.00 0.00 175.17 175.80 2bhx n MET 173 N 9.21 2.71 -0.29 4.34 2.81 0.54 -2.17 117.12 134.27 2bhx n MET 173 Ca 0.04 -3.06 0.09 0.00 -1.81 0.00 0.00 57.70 52.96 2bhx n MET 173 Cb 0.49 -2.02 0.22 0.00 -0.71 0.00 0.00 33.22 31.20 2bhx n MET 173 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2bhx h SER 174 N 1.66 -0.29 -0.56 7.83 0.02 -1.87 -0.40 113.55 119.95 2bhx h SER 174 Ca 0.28 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 2bhx h SER 174 Cb 2.08 0.36 0.00 0.00 0.14 0.00 0.00 62.40 64.97 2bhx h SER 174 CO 0.61 -0.21 0.00 -1.54 -1.14 0.00 0.00 176.83 174.55 2bhx n SER 175 N -5.34 3.63 0.00 3.07 3.41 -1.26 -4.21 113.62 112.92 2bhx n SER 175 Ca 0.18 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.80 2bhx n SER 175 Cb 0.59 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2bhx n SER 175 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2bhx n ASP 176 N 1.45 0.00 -4.73 4.04 5.75 -0.94 -4.84 116.55 117.27 2bhx n ASP 176 Ca 0.21 -1.00 -0.42 0.00 -0.01 0.00 0.00 54.79 53.57 2bhx n ASP 176 Cb 0.59 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.66 2bhx n ASP 176 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bhx n ILE 177 N 0.00 1.28 -3.05 2.12 0.13 -0.20 -2.01 119.36 117.62 2bhx n ILE 177 Ca 0.00 -0.32 -0.22 0.00 -1.10 0.00 0.00 62.75 61.11 2bhx n ILE 177 Cb 0.48 -1.84 0.02 0.00 -0.84 0.00 0.00 39.64 37.46 2bhx n ILE 177 CO 0.00 0.00 0.00 -0.11 2.80 0.00 0.00 176.55 179.24 2bhx n LEU 178 N 1.72 -2.12 -0.44 9.51 7.94 -1.26 -4.84 117.00 127.51 2bhx n LEU 178 Ca 0.07 -0.26 0.12 0.00 -1.11 0.00 0.00 56.01 54.83 2bhx n LEU 178 Cb 0.36 -2.62 0.09 0.00 0.53 0.00 0.00 43.42 41.78 2bhx n LEU 178 CO 0.63 0.15 0.39 -1.54 -1.11 0.00 0.00 177.39 175.91 2bhx n SER 179 N -2.35 1.80 -3.64 1.96 3.41 -0.85 -4.91 113.62 109.04 2bhx n SER 179 Ca -0.09 -1.38 -0.04 0.00 -0.26 0.00 0.00 58.87 57.10 2bhx n SER 179 Cb 0.60 0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 64.93 2bhx n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bhx s ARG 180 N -2.48 0.85 0.66 4.33 1.70 -1.26 -3.27 118.95 119.49 2bhx s ARG 180 Ca 0.20 -0.42 -0.17 0.00 -0.47 0.00 0.00 55.73 54.88 2bhx s ARG 180 Cb 0.18 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.89 2bhx s ARG 180 CO 0.56 -0.38 1.21 -2.14 -1.08 0.00 0.00 175.30 173.47 2bhx s PRO 181 N -3.00 2.55 -0.01 3.89 0.02 -1.26 -4.91 135.00 132.28 2bhx s PRO 181 Ca 0.10 1.79 0.00 0.00 0.02 0.00 0.00 61.00 62.92 2bhx s PRO 181 Cb -0.00 -1.88 0.01 0.00 0.02 0.00 0.00 34.50 32.65 2bhx s PRO 181 CO -0.03 -1.53 -0.00 -1.17 -0.33 0.00 0.00 177.00 173.94 2bhx s LEU 182 N -4.63 1.62 -0.73 -5.54 2.96 -1.26 -5.06 118.68 106.03 2bhx s LEU 182 Ca 0.76 -0.01 -0.18 0.00 -0.22 0.00 0.00 54.13 54.48 2bhx s LEU 182 Cb -0.30 -0.10 0.14 0.00 0.50 0.00 0.00 46.19 46.43 2bhx s LEU 182 CO 0.40 -0.04 0.83 -0.75 -1.32 0.00 0.00 176.35 175.47 2bhx s LYS 183 N 0.44 3.31 0.53 1.98 2.20 -1.26 -4.85 119.74 122.08 2bhx s LYS 183 Ca -0.04 -1.68 0.23 0.00 -0.36 0.00 0.00 55.97 54.12 2bhx s LYS 183 Cb -0.06 -4.47 1.43 0.00 -1.51 0.00 0.00 37.83 33.22 2bhx s LYS 183 CO -0.01 -1.55 2.13 0.28 -0.36 0.00 0.00 175.35 175.84 2bhx h VAL 184 N 5.65 0.78 0.00 4.02 2.07 -1.86 -1.63 116.25 125.28 2bhx h VAL 184 Ca -0.09 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2bhx h VAL 184 Cb 1.06 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2bhx h VAL 184 CO 1.03 0.07 0.00 -0.46 0.02 0.00 0.00 177.57 178.23 2bhx n ASN 185 N -4.06 0.00 0.14 0.57 0.23 -1.26 -1.37 115.26 109.51 2bhx n ASN 185 Ca -0.03 -1.07 0.13 0.00 -0.53 0.00 0.00 54.58 53.08 2bhx n ASN 185 Cb 0.16 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.34 2bhx n ASN 185 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2bhx h GLN 186 N 0.00 0.00 -6.73 -3.83 4.20 -1.70 -3.46 115.11 103.59 2bhx h GLN 186 Ca 0.00 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 58.04 2bhx h GLN 186 Cb 0.00 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 27.58 2bhx h GLN 186 CO 0.00 0.00 -0.83 -0.06 -0.67 0.00 0.00 178.83 177.27 2bhx s PHE 187 N -3.31 2.36 0.01 2.96 0.40 -0.47 -4.51 117.98 115.42 2bhx s PHE 187 Ca 0.05 -0.34 0.04 0.00 -0.60 0.00 0.00 56.93 56.08 2bhx s PHE 187 Cb 0.10 -1.22 -0.25 0.00 0.51 0.00 0.00 43.02 42.16 2bhx s PHE 187 CO 0.46 0.43 0.87 0.78 0.70 0.00 0.00 175.22 178.45 2bhx h GLY 188 N 3.51 0.14 -4.90 4.36 0.00 -1.48 -3.44 103.07 101.25 2bhx h GLY 188 Ca -0.49 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 46.43 2bhx h GLY 188 CO 0.45 0.31 0.07 -0.29 0.00 0.00 0.00 176.54 177.08 2bhx s MET 189 N -2.63 0.81 -0.05 4.80 -2.45 -1.21 -0.57 119.30 117.99 2bhx s MET 189 Ca -0.06 0.82 0.04 0.00 -1.25 0.00 0.00 55.69 55.24 2bhx s MET 189 Cb 0.08 0.39 -0.00 0.00 1.25 0.00 0.00 34.83 36.55 2bhx s MET 189 CO 0.83 -0.12 -0.19 0.42 1.05 0.00 0.00 175.02 177.01 2bhx s ILE 190 N 0.13 1.56 0.09 10.11 1.01 -0.19 -1.46 121.20 132.45 2bhx s ILE 190 Ca -0.02 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.88 2bhx s ILE 190 Cb -0.04 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 2bhx s ILE 190 CO 0.02 0.45 -0.09 -0.72 0.00 0.00 0.00 174.94 174.60 2bhx s TYR 191 N 0.07 0.96 -0.24 3.97 -0.85 -0.60 -0.01 117.35 120.65 2bhx s TYR 191 Ca -0.06 -0.67 -0.10 0.00 -0.52 0.00 0.00 57.07 55.72 2bhx s TYR 191 Cb -0.13 -0.54 0.10 0.00 0.38 0.00 0.00 41.96 41.77 2bhx s TYR 191 CO 0.03 -0.04 0.54 0.00 -1.52 0.00 0.00 175.55 174.56 2bhx s ALA 192 N -2.46 -1.56 0.35 9.51 0.00 -0.10 -0.34 121.76 127.16 2bhx s ALA 192 Ca 0.04 1.94 -0.29 0.00 0.00 0.00 0.00 51.96 53.65 2bhx s ALA 192 Cb -0.03 -1.45 -0.11 0.00 0.00 0.00 0.00 23.12 21.53 2bhx s ALA 192 CO -0.01 -0.70 1.50 0.20 0.00 0.00 0.00 175.76 176.75 2bhx s GLY 193 N 2.42 2.72 0.53 0.00 0.00 -1.26 -0.91 107.32 110.81 2bhx s GLY 193 Ca -0.05 1.55 0.31 0.00 0.00 0.00 0.00 44.72 46.53 2bhx s GLY 193 CO -0.16 2.31 1.99 0.00 0.00 0.00 0.00 173.10 177.25 2bhx h ALA 194 N 3.56 1.05 0.00 3.20 0.00 -1.44 -3.30 119.26 122.33 2bhx h ALA 194 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2bhx h ALA 194 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2bhx h ALA 194 CO 0.68 0.09 0.00 0.00 0.00 0.00 0.00 179.25 180.03 2bhx n GLN 195 N -3.25 0.61 -0.13 0.00 0.00 -1.12 -0.58 117.38 112.92 2bhx n GLN 195 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 57.00 56.74 2bhx n GLN 195 Cb 0.30 -1.44 -0.10 0.00 0.00 0.00 0.00 30.24 29.00 2bhx n GLN 195 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2bhx n LYS 196 N -0.94 0.58 0.00 2.61 4.76 -1.24 -3.06 118.16 120.86 2bhx n LYS 196 Ca 0.13 0.34 0.00 0.00 -2.87 0.00 0.00 58.31 55.91 2bhx n LYS 196 Cb 0.06 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 2bhx n LYS 196 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2bhx n ASN 197 N -4.31 0.90 0.00 4.39 5.15 -1.18 -4.73 115.26 115.47 2bhx n ASN 197 Ca -0.46 -1.40 0.00 0.00 -0.60 0.00 0.00 54.58 52.12 2bhx n ASN 197 Cb 0.80 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.05 2bhx n ASN 197 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2bhx n LEU 198 N -0.20 0.55 0.00 1.20 4.77 0.25 -4.80 117.00 118.77 2bhx n LEU 198 Ca 0.00 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2bhx n LEU 198 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2bhx n LEU 198 CO 0.00 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 2bhx n GLY 199 N -0.01 0.55 3.95 -0.72 0.00 -0.47 -4.48 105.19 103.99 2bhx n GLY 199 Ca 0.00 -1.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 2bhx n GLY 199 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bhx s PRO 200 N 0.00 2.77 0.75 1.61 0.04 -1.26 -4.06 135.00 134.85 2bhx s PRO 200 Ca 0.00 -0.42 -0.11 0.00 0.04 0.00 0.00 61.00 60.50 2bhx s PRO 200 Cb 0.00 -2.42 0.04 0.00 0.04 0.00 0.00 34.50 32.16 2bhx s PRO 200 CO 0.00 -0.63 1.09 -1.54 0.04 0.00 0.00 177.00 175.96 2bhx s SER 201 N -4.34 4.98 0.00 6.66 1.04 -1.26 -2.80 113.70 117.97 2bhx s SER 201 Ca 0.54 1.32 0.00 0.00 0.48 0.00 0.00 55.95 58.29 2bhx s SER 201 Cb -0.10 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 63.90 2bhx s SER 201 CO 0.41 -1.66 0.00 0.61 0.98 0.00 0.00 173.24 173.57 2bhx n GLY 202 N -2.34 1.43 3.11 7.32 0.00 -1.26 -4.85 105.19 108.61 2bhx n GLY 202 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 2bhx n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bhx s VAL 203 N -2.33 0.85 -0.13 1.61 0.11 -1.26 -4.61 120.40 114.64 2bhx s VAL 203 Ca 0.00 -1.10 0.02 0.00 -2.93 0.00 0.00 61.98 57.97 2bhx s VAL 203 Cb 0.00 -0.84 0.01 0.00 -1.53 0.00 0.00 36.38 34.02 2bhx s VAL 203 CO 0.00 -0.23 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.45 2bhx s THR 204 N -1.17 1.92 -0.11 5.04 2.01 0.67 -1.43 115.64 122.56 2bhx s THR 204 Ca -0.04 -0.90 -0.22 0.00 0.31 0.00 0.00 61.69 60.84 2bhx s THR 204 Cb -0.09 -1.71 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 2bhx s THR 204 CO 0.01 0.52 0.64 -0.69 -0.69 0.00 0.00 174.62 174.41 2bhx s VAL 205 N 0.86 5.07 -0.20 3.82 1.01 -0.09 -1.32 120.40 129.54 2bhx s VAL 205 Ca -0.07 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.19 2bhx s VAL 205 Cb -0.15 -3.97 0.05 0.00 0.00 0.00 0.00 36.38 32.30 2bhx s VAL 205 CO -0.02 0.23 -0.07 -0.69 0.00 0.00 0.00 175.10 174.55 2bhx s VAL 206 N 1.07 1.42 -0.28 2.92 1.01 -0.33 -0.92 120.40 125.29 2bhx s VAL 206 Ca 0.33 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.23 2bhx s VAL 206 Cb -0.17 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2bhx s VAL 206 CO 0.14 0.04 0.18 -0.63 0.00 0.00 0.00 175.10 174.84 2bhx s ILE 207 N 1.48 5.23 0.00 2.22 1.01 0.99 -0.07 121.20 132.06 2bhx s ILE 207 Ca -0.02 0.13 0.04 0.00 0.00 0.00 0.00 60.65 60.80 2bhx s ILE 207 Cb -0.17 -3.49 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 2bhx s ILE 207 CO -0.07 0.25 -0.13 0.68 0.00 0.00 0.00 174.94 175.67 2bhx s VAL 208 N 1.75 1.06 -0.18 2.92 -7.23 0.22 -1.02 120.40 117.91 2bhx s VAL 208 Ca 0.07 -0.69 -0.29 0.00 -1.81 0.00 0.00 61.98 59.25 2bhx s VAL 208 Cb -0.16 -0.91 -0.03 0.00 0.56 0.00 0.00 36.38 35.85 2bhx s VAL 208 CO 0.10 0.20 1.49 -0.75 -0.31 0.00 0.00 175.10 175.83 2bhx s LYS 209 N -0.56 4.01 0.28 4.82 2.20 0.26 -0.71 119.74 130.04 2bhx s LYS 209 Ca 0.04 1.72 -0.02 0.00 -0.36 0.00 0.00 55.97 57.35 2bhx s LYS 209 Cb -0.06 -3.93 0.43 0.00 -1.51 0.00 0.00 37.83 32.76 2bhx s LYS 209 CO 0.00 -1.02 1.91 0.87 -0.36 0.00 0.00 175.35 176.75 2bhx h LYS 210 N 9.59 1.12 0.00 4.03 1.57 -1.62 -1.48 116.57 129.78 2bhx h LYS 210 Ca -0.32 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2bhx h LYS 210 Cb 1.14 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.19 2bhx h LYS 210 CO 0.99 0.74 -0.05 -0.40 -0.57 0.00 0.00 179.45 180.16 2bhx n ASP 211 N -4.46 0.79 0.21 0.86 5.68 -1.26 -0.82 116.55 117.55 2bhx n ASP 211 Ca 0.14 0.54 0.08 0.00 -0.50 0.00 0.00 54.79 55.04 2bhx n ASP 211 Cb 0.14 -0.71 0.47 0.00 -1.14 0.00 0.00 41.12 39.88 2bhx n ASP 211 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 2bhx h LEU 212 N 0.00 0.00 -1.90 -2.12 5.85 -1.65 -3.39 115.31 112.10 2bhx h LEU 212 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2bhx h LEU 212 Cb 0.73 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 2bhx h LEU 212 CO 0.00 0.28 -0.44 0.18 -0.34 0.00 0.00 178.44 178.11 2bhx n LEU 213 N -3.63 0.08 -1.50 2.25 4.77 -1.00 -4.83 117.00 113.14 2bhx n LEU 213 Ca -0.01 -1.22 0.05 0.00 -0.03 0.00 0.00 56.01 54.80 2bhx n LEU 213 Cb 0.40 0.00 0.30 0.00 -2.33 0.00 0.00 43.42 41.79 2bhx n LEU 213 CO 0.35 0.56 0.71 -0.46 -1.33 0.00 0.00 177.39 177.22 2bhx n ASN 214 N 0.08 4.41 -4.36 -1.43 6.94 0.00 -3.26 115.26 117.63 2bhx n ASN 214 Ca -0.01 -2.65 -0.32 0.00 -0.02 0.00 0.00 54.58 51.58 2bhx n ASN 214 Cb 0.72 -0.62 -0.15 0.00 -2.36 0.00 0.00 39.78 37.37 2bhx n ASN 214 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2bhx s THR 215 N -2.24 2.53 0.17 5.53 2.01 -1.26 -4.84 115.64 117.55 2bhx s THR 215 Ca 0.40 -0.90 -0.33 0.00 0.31 0.00 0.00 61.69 61.16 2bhx s THR 215 Cb 0.30 -1.96 -0.14 0.00 0.01 0.00 0.00 72.50 70.70 2bhx s THR 215 CO 0.12 0.57 1.45 0.29 -0.69 0.00 0.00 174.62 176.37 2bhx n LYS 216 N 2.74 1.87 -3.80 4.92 4.01 -1.26 -4.68 118.16 121.97 2bhx n LYS 216 Ca -0.17 0.67 -0.37 0.00 -0.51 0.00 0.00 58.31 57.93 2bhx n LYS 216 Cb 0.52 -2.36 -0.13 0.00 -0.51 0.00 0.00 35.03 32.55 2bhx n LYS 216 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2bhx s VAL 217 N 0.45 3.78 0.25 -0.18 1.01 -1.26 -5.06 120.40 119.39 2bhx s VAL 217 Ca 0.76 -0.71 -0.31 0.00 0.00 0.00 0.00 61.98 61.72 2bhx s VAL 217 Cb -0.73 -2.93 -0.12 0.00 0.00 0.00 0.00 36.38 32.60 2bhx s VAL 217 CO 0.44 0.13 1.61 -1.84 0.00 0.00 0.00 175.10 175.44 2bhx n GLU 218 N 4.83 2.60 -0.77 2.72 0.00 -1.26 -2.07 120.64 126.69 2bhx n GLU 218 Ca -0.15 0.93 0.00 0.00 0.00 0.00 0.00 57.16 57.94 2bhx n GLU 218 Cb 0.48 -2.72 0.00 0.00 0.00 0.00 0.00 31.44 29.20 2bhx n GLU 218 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2bhx n GLN 219 N 2.81 0.00 -4.31 3.44 7.27 -1.26 -5.04 117.38 120.29 2bhx n GLN 219 Ca 0.12 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.85 2bhx n GLN 219 Cb 0.35 -2.31 -0.11 0.00 2.41 0.00 0.00 30.24 30.58 2bhx n GLN 219 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2bhx s VAL 220 N -2.04 4.13 0.33 1.69 1.01 -0.88 -5.05 120.40 119.59 2bhx s VAL 220 Ca 0.00 -0.27 -0.27 0.00 0.00 0.00 0.00 61.98 61.43 2bhx s VAL 220 Cb 0.00 -2.82 -0.13 0.00 0.00 0.00 0.00 36.38 33.43 2bhx s VAL 220 CO 0.00 0.49 1.06 -2.65 0.00 0.00 0.00 175.10 174.00 2bhx n PRO 221 N 3.45 1.51 -0.26 2.72 -0.02 -1.26 -4.73 135.00 136.41 2bhx n PRO 221 Ca -0.17 0.53 0.07 0.00 -2.02 0.00 0.00 63.50 61.91 2bhx n PRO 221 Cb 0.52 -1.98 0.20 0.00 -0.02 0.00 0.00 33.50 32.23 2bhx n PRO 221 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2bhx h THR 222 N 2.01 0.47 0.00 3.45 2.02 -1.96 0.20 112.91 119.09 2bhx h THR 222 Ca -0.42 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 2bhx h THR 222 Cb 1.33 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 2bhx h THR 222 CO 0.60 0.05 -0.02 0.24 0.37 0.00 0.00 175.52 176.76 2bhx h MET 223 N 0.26 0.00 -0.31 6.66 2.86 -2.02 -2.98 114.93 119.40 2bhx h MET 223 Ca 0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.08 2bhx h MET 223 Cb 0.79 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 2bhx h MET 223 CO -0.55 0.02 0.00 1.28 1.06 0.00 0.00 176.91 178.72 2bhx n LEU 224 N -3.12 3.35 -4.72 1.22 4.77 0.66 -4.89 117.00 114.28 2bhx n LEU 224 Ca 0.00 -1.40 -0.38 0.00 -0.03 0.00 0.00 56.01 54.20 2bhx n LEU 224 Cb 0.28 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 2bhx n LEU 224 CO 0.27 0.69 0.21 -1.10 -1.33 0.00 0.00 177.39 176.13 2bhx s GLN 225 N -1.57 4.34 0.41 3.23 -0.21 -0.99 -4.81 119.66 120.05 2bhx s GLN 225 Ca 0.36 0.50 0.07 0.00 0.02 0.00 0.00 55.36 56.31 2bhx s GLN 225 Cb 0.22 -3.45 0.86 0.00 1.00 0.00 0.00 33.01 31.64 2bhx s GLN 225 CO 0.31 0.12 2.06 1.88 -2.12 0.00 0.00 175.29 177.53 2bhx h TYR 226 N 6.79 0.52 -0.88 0.91 -1.99 -1.90 -2.28 116.97 118.15 2bhx h TYR 226 Ca -0.40 0.01 0.10 0.00 2.00 0.00 0.00 58.73 60.44 2bhx h TYR 226 Cb 1.18 -0.18 -0.06 0.00 2.00 0.00 0.00 36.73 39.67 2bhx h TYR 226 CO 0.63 0.33 0.57 0.00 -0.00 0.00 0.00 178.16 179.68 2bhx h ALA 227 N 1.74 1.67 -0.26 3.88 0.00 -1.82 0.13 119.26 124.59 2bhx h ALA 227 Ca 0.16 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.10 2bhx h ALA 227 Cb -0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2bhx h ALA 227 CO -0.03 0.15 0.01 1.15 0.00 0.00 0.00 179.25 180.53 2bhx h THR 228 N 0.85 0.83 0.02 0.00 2.02 -1.67 -0.03 112.91 114.93 2bhx h THR 228 Ca 0.41 -0.03 -0.21 0.00 0.77 0.00 0.00 66.41 67.35 2bhx h THR 228 Cb 0.43 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2bhx h THR 228 CO -0.17 0.02 -0.93 0.45 0.37 0.00 0.00 175.52 175.25 2bhx h HIS 229 N 0.10 0.31 -0.01 3.16 3.86 -1.34 -2.21 115.15 119.02 2bhx h HIS 229 Ca 0.12 -0.18 -0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2bhx h HIS 229 Cb 0.15 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.59 2bhx h HIS 229 CO -0.19 1.02 0.00 0.82 0.86 0.00 0.00 177.93 180.44 2bhx h ILE 230 N 0.10 1.17 -0.49 2.45 2.04 -0.56 -0.43 117.51 121.78 2bhx h ILE 230 Ca -0.05 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2bhx h ILE 230 Cb 1.58 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 39.12 2bhx h ILE 230 CO 0.14 0.13 0.32 0.11 0.00 0.00 0.00 178.15 178.85 2bhx h LYS 231 N -0.20 0.65 -0.67 2.37 1.57 -0.96 -2.47 116.57 116.86 2bhx h LYS 231 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2bhx h LYS 231 Cb 0.21 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2bhx h LYS 231 CO -0.00 0.43 0.00 -1.13 -0.57 0.00 0.00 179.45 178.18 2bhx n SER 232 N -4.46 3.74 -3.97 0.86 3.41 -0.84 -4.96 113.62 107.40 2bhx n SER 232 Ca 0.04 -2.00 -0.28 0.00 -0.26 0.00 0.00 58.87 56.37 2bhx n SER 232 Cb 0.05 -0.44 -0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2bhx n SER 232 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2bhx n ASP 233 N 1.56 -2.11 -2.22 4.04 2.03 -0.68 -1.33 116.55 117.84 2bhx n ASP 233 Ca 0.23 -0.93 -0.21 0.00 0.52 0.00 0.00 54.79 54.40 2bhx n ASP 233 Cb 0.60 -3.31 -0.02 0.00 -0.72 0.00 0.00 41.12 37.67 2bhx n ASP 233 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2bhx n SER 234 N -2.89 -5.80 -0.47 1.67 7.64 -0.26 -4.86 113.62 108.64 2bhx n SER 234 Ca -0.14 0.07 0.07 0.00 1.01 0.00 0.00 58.87 59.88 2bhx n SER 234 Cb 0.60 -4.86 0.15 0.00 -1.01 0.00 0.00 64.21 59.09 2bhx n SER 234 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2bhx n LEU 235 N -2.86 2.24 0.09 -3.43 4.77 -0.44 -4.64 117.00 112.73 2bhx n LEU 235 Ca -0.24 -3.24 -0.13 0.00 -0.03 0.00 0.00 56.01 52.37 2bhx n LEU 235 Cb 0.68 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 41.29 2bhx n LEU 235 CO 0.29 0.99 0.79 0.22 -1.33 0.00 0.00 177.39 178.35 2bhx h TYR 236 N 0.56 -0.16 -3.49 -1.77 3.20 -1.88 -3.45 116.97 109.99 2bhx h TYR 236 Ca -0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2bhx h TYR 236 Cb 1.11 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.43 2bhx h TYR 236 CO 0.38 -0.03 0.00 0.27 -1.64 0.00 0.00 178.16 177.14 2bhx n ASN 237 N -5.13 1.76 -4.67 -2.11 6.94 -1.26 -5.07 115.26 105.71 2bhx n ASN 237 Ca -0.08 -0.74 -0.43 0.00 -0.02 0.00 0.00 54.58 53.32 2bhx n ASN 237 Cb 0.12 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.52 2bhx n ASN 237 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2bhx s THR 238 N -0.62 4.17 0.79 5.53 2.01 -1.26 -4.99 115.64 121.26 2bhx s THR 238 Ca 0.00 1.47 -0.12 0.00 0.31 0.00 0.00 61.69 63.35 2bhx s THR 238 Cb 0.00 -3.94 0.06 0.00 0.01 0.00 0.00 72.50 68.63 2bhx s THR 238 CO 0.00 -0.07 1.10 -2.16 -0.69 0.00 0.00 174.62 172.81 2bhx s PRO 239 N 2.92 2.18 -1.12 4.92 0.04 -1.26 -4.93 135.00 137.74 2bhx s PRO 239 Ca 0.57 0.56 -0.22 0.00 0.04 0.00 0.00 61.00 61.95 2bhx s PRO 239 Cb -0.24 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.37 2bhx s PRO 239 CO 0.19 -1.53 1.73 -1.25 0.04 0.00 0.00 177.00 176.18 2bhx s PRO 240 N -5.22 3.31 0.17 0.56 0.04 -1.26 -4.81 135.00 127.78 2bhx s PRO 240 Ca 0.60 -1.27 -0.11 0.00 0.04 0.00 0.00 61.00 60.27 2bhx s PRO 240 Cb -0.14 -5.34 0.05 0.00 0.04 0.00 0.00 34.50 29.12 2bhx s PRO 240 CO 0.53 -2.80 1.65 1.79 0.04 0.00 0.00 177.00 178.21 2bhx h THR 241 N 6.35 1.26 -0.31 1.26 1.35 -1.94 -0.71 112.91 120.17 2bhx h THR 241 Ca 0.27 -1.01 -0.11 0.00 -0.55 0.00 0.00 66.41 65.00 2bhx h THR 241 Cb 0.95 0.80 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 2bhx h THR 241 CO 1.36 0.37 -0.27 0.15 -0.25 0.00 0.00 175.52 176.88 2bhx h PHE 242 N 0.85 0.71 -0.66 4.73 3.57 -1.87 -0.82 116.94 123.44 2bhx h PHE 242 Ca 0.17 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2bhx h PHE 242 Cb 0.45 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 2bhx h PHE 242 CO 0.03 0.83 0.26 0.77 -2.23 0.00 0.00 178.31 177.97 2bhx h SER 243 N 0.54 0.92 -0.39 0.41 0.02 -1.79 0.16 113.55 113.41 2bhx h SER 243 Ca 0.07 -0.17 -0.12 0.00 -0.84 0.00 0.00 61.79 60.73 2bhx h SER 243 Cb 0.74 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2bhx h SER 243 CO 0.06 0.84 -0.19 0.40 -1.14 0.00 0.00 176.83 176.79 2bhx h ILE 244 N 0.94 1.27 -0.02 3.27 2.04 -0.88 -0.31 117.51 123.82 2bhx h ILE 244 Ca 0.22 -1.32 0.02 0.00 1.00 0.00 0.00 64.86 64.77 2bhx h ILE 244 Cb 0.21 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2bhx h ILE 244 CO -0.02 0.45 -0.08 0.22 0.00 0.00 0.00 178.15 178.73 2bhx h TYR 245 N 0.77 -0.19 -0.55 1.37 3.20 -0.94 0.66 116.97 121.28 2bhx h TYR 245 Ca 0.11 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 2bhx h TYR 245 Cb 0.73 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.06 2bhx h TYR 245 CO 0.04 -0.12 0.20 0.52 -1.64 0.00 0.00 178.16 177.17 2bhx h MET 246 N -0.12 0.81 -0.59 1.82 2.86 -0.74 -0.94 114.93 118.02 2bhx h MET 246 Ca 0.04 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.58 2bhx h MET 246 Cb 0.17 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 2bhx h MET 246 CO -0.09 0.68 0.35 1.25 1.06 0.00 0.00 176.91 180.15 2bhx h LEU 247 N 0.79 0.56 -0.32 1.22 5.85 -0.65 -0.21 115.31 122.55 2bhx h LEU 247 Ca 0.19 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.97 2bhx h LEU 247 Cb 0.18 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 2bhx h LEU 247 CO -0.01 0.39 -0.00 -0.09 -0.34 0.00 0.00 178.44 178.39 2bhx h ARG 248 N 0.69 0.09 -0.62 1.25 1.12 -0.02 0.57 114.38 117.45 2bhx h ARG 248 Ca 0.24 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 59.08 2bhx h ARG 248 Cb 0.04 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 29.95 2bhx h ARG 248 CO -0.11 0.06 0.28 -0.91 -3.11 0.00 0.00 179.97 176.18 2bhx h ASN 249 N 0.09 0.80 -0.19 -3.80 4.21 -0.59 -0.08 115.58 116.03 2bhx h ASN 249 Ca 0.16 -0.09 -0.09 0.00 1.21 0.00 0.00 56.30 57.49 2bhx h ASN 249 Cb 0.21 -0.21 -0.00 0.00 -1.12 0.00 0.00 38.32 37.20 2bhx h ASN 249 CO -0.26 0.70 -0.23 0.58 -1.29 0.00 0.00 177.43 176.92 2bhx h VAL 250 N 0.88 1.34 -1.00 2.81 2.07 -0.50 -2.58 116.25 119.26 2bhx h VAL 250 Ca 0.21 -1.42 0.10 0.00 0.82 0.00 0.00 66.70 66.41 2bhx h VAL 250 Cb 0.12 1.82 -0.08 0.00 -1.52 0.00 0.00 31.29 31.63 2bhx h VAL 250 CO -0.03 0.43 0.64 -0.07 0.02 0.00 0.00 177.57 178.57 2bhx h LEU 251 N 0.15 0.97 -1.11 2.57 3.38 -0.46 -0.99 115.31 119.83 2bhx h LEU 251 Ca 0.02 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2bhx h LEU 251 Cb 0.79 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2bhx h LEU 251 CO 0.06 0.55 0.57 0.44 0.09 0.00 0.00 178.44 180.15 2bhx h ASP 252 N 1.06 1.03 -0.53 -0.43 3.32 -0.84 -0.61 116.42 119.42 2bhx h ASP 252 Ca 0.47 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.38 2bhx h ASP 252 Cb 0.37 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2bhx h ASP 252 CO -0.23 0.75 -0.07 -0.25 -1.72 0.00 0.00 179.24 177.72 2bhx h TRP 253 N 1.20 1.09 -0.55 4.55 7.01 -0.83 0.15 115.95 128.56 2bhx h TRP 253 Ca 0.32 -0.22 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 2bhx h TRP 253 Cb -0.12 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 26.65 2bhx h TRP 253 CO 0.00 1.01 0.17 0.82 -2.79 0.00 0.00 178.44 177.65 2bhx h ILE 254 N 0.85 1.24 -0.58 2.65 2.04 -0.66 -1.80 117.51 121.25 2bhx h ILE 254 Ca 0.14 -0.81 -0.04 0.00 1.00 0.00 0.00 64.86 65.15 2bhx h ILE 254 Cb 0.63 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2bhx h ILE 254 CO 0.04 0.30 0.20 0.50 0.00 0.00 0.00 178.15 179.19 2bhx h LYS 255 N 0.77 0.89 -0.20 2.37 3.64 -0.89 0.12 116.57 123.27 2bhx h LYS 255 Ca 0.18 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2bhx h LYS 255 Cb 0.29 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2bhx h LYS 255 CO -0.00 0.79 0.05 -0.44 -2.27 0.00 0.00 179.45 177.57 2bhx h ASP 256 N 0.82 0.25 -0.03 4.20 3.32 -0.16 -2.17 116.42 122.64 2bhx h ASP 256 Ca 0.19 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2bhx h ASP 256 Cb 0.25 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2bhx h ASP 256 CO -0.01 0.27 0.00 0.18 -1.72 0.00 0.00 179.24 177.96 2bhx n LEU 257 N -4.42 0.91 0.00 1.55 4.32 -0.73 -4.87 117.00 113.76 2bhx n LEU 257 Ca -0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 56.01 55.66 2bhx n LEU 257 Cb 0.15 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 2bhx n LEU 257 CO 0.36 0.16 0.00 0.61 -1.22 0.00 0.00 177.39 177.30 2bhx n GLY 258 N 1.07 1.36 7.00 -0.72 0.00 -0.82 -4.76 105.19 108.33 2bhx n GLY 258 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2bhx n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhx n GLY 259 N -0.48 -1.75 0.26 -0.02 0.00 0.40 -3.58 105.19 100.02 2bhx n GLY 259 Ca 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 46.02 44.68 2bhx n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhx h ALA 260 N -0.03 1.51 -0.10 4.61 0.00 -1.85 -0.06 119.26 123.33 2bhx h ALA 260 Ca 0.00 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.52 2bhx h ALA 260 Cb 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2bhx h ALA 260 CO 0.00 0.35 -0.78 0.93 0.00 0.00 0.00 179.25 179.76 2bhx h GLU 261 N 0.33 0.71 -0.11 0.00 3.07 -1.92 -0.71 114.58 115.96 2bhx h GLU 261 Ca 0.07 -0.63 -0.15 0.00 -0.50 0.00 0.00 59.36 58.16 2bhx h GLU 261 Cb 0.30 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2bhx h GLU 261 CO 0.01 1.23 -0.57 0.00 -1.40 0.00 0.00 179.01 178.29 2bhx h ALA 262 N 0.49 0.83 -0.04 3.43 0.00 -1.54 -2.85 119.26 119.58 2bhx h ALA 262 Ca -0.07 -0.52 -0.17 0.00 0.00 0.00 0.00 54.91 54.16 2bhx h ALA 262 Cb 1.42 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2bhx h ALA 262 CO 0.16 0.70 -0.72 0.97 0.00 0.00 0.00 179.25 180.36 2bhx h ILE 263 N 0.26 1.44 -0.91 0.00 6.09 -0.83 -2.47 117.51 121.09 2bhx h ILE 263 Ca 0.00 -2.27 0.07 0.00 -1.37 0.00 0.00 64.86 61.30 2bhx h ILE 263 Cb 1.07 2.21 -0.07 0.00 0.47 0.00 0.00 36.82 40.50 2bhx h ILE 263 CO 0.09 0.66 0.57 0.00 -3.07 0.00 0.00 178.15 176.41 2bhx h ALA 264 N 1.11 1.27 -0.45 0.18 0.00 -1.06 0.16 119.26 120.48 2bhx h ALA 264 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2bhx h ALA 264 Cb 1.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2bhx h ALA 264 CO 0.11 0.30 0.19 -0.22 0.00 0.00 0.00 179.25 179.63 2bhx h LYS 265 N 1.01 0.66 -0.43 0.00 3.64 -1.22 0.79 116.57 121.03 2bhx h LYS 265 Ca 0.40 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2bhx h LYS 265 Cb 0.22 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2bhx h LYS 265 CO -0.19 0.59 0.28 0.37 -2.27 0.00 0.00 179.45 178.23 2bhx h GLN 266 N 0.58 0.55 -0.53 1.90 5.75 -1.06 -1.86 115.11 120.44 2bhx h GLN 266 Ca 0.15 -0.03 -0.12 0.00 -0.15 0.00 0.00 58.65 58.50 2bhx h GLN 266 Cb 0.17 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 2bhx h GLN 266 CO -0.01 0.36 -0.14 -0.91 -2.65 0.00 0.00 178.83 175.48 2bhx h ASN 267 N 0.57 1.04 -0.78 -0.69 2.35 -0.35 -0.96 115.58 116.75 2bhx h ASN 267 Ca 0.16 -0.36 -0.01 0.00 -0.55 0.00 0.00 56.30 55.54 2bhx h ASN 267 Cb -0.05 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.00 2bhx h ASN 267 CO -0.04 1.17 0.46 -0.33 -1.65 0.00 0.00 177.43 177.03 2bhx h GLU 268 N 0.91 1.07 -0.17 0.81 5.08 -0.76 -1.47 114.58 120.04 2bhx h GLU 268 Ca 0.13 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2bhx h GLU 268 Cb 0.71 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2bhx h GLU 268 CO 0.05 0.77 0.05 0.93 -1.00 0.00 0.00 179.01 179.81 2bhx h GLU 269 N 1.08 0.28 -0.31 2.33 5.08 -0.94 -0.55 114.58 121.54 2bhx h GLU 269 Ca 0.28 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2bhx h GLU 269 Cb -0.02 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2bhx h GLU 269 CO -0.05 0.41 0.18 0.87 -1.00 0.00 0.00 179.01 179.42 2bhx h LYS 270 N 0.09 0.43 -0.76 2.33 1.57 -1.11 -2.42 116.57 116.70 2bhx h LYS 270 Ca 0.06 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2bhx h LYS 270 Cb 0.25 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.42 2bhx h LYS 270 CO -0.00 0.34 0.45 0.00 -0.57 0.00 0.00 179.45 179.68 2bhx h ALA 271 N 1.06 1.04 -0.70 3.86 0.00 -1.21 -2.40 119.26 120.91 2bhx h ALA 271 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2bhx h ALA 271 Cb 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2bhx h ALA 271 CO -0.02 0.16 0.47 -0.22 0.00 0.00 0.00 179.25 179.64 2bhx h LYS 272 N 0.83 0.92 -0.75 0.00 3.64 -0.63 0.63 116.57 121.22 2bhx h LYS 272 Ca 0.34 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 2bhx h LYS 272 Cb 0.18 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 2bhx h LYS 272 CO -0.18 0.61 0.49 0.82 -2.27 0.00 0.00 179.45 178.93 2bhx h ILE 273 N 0.95 1.19 0.02 2.00 2.04 -1.02 0.24 117.51 122.93 2bhx h ILE 273 Ca 0.26 -0.35 -0.14 0.00 1.00 0.00 0.00 64.86 65.64 2bhx h ILE 273 Cb -0.10 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.08 2bhx h ILE 273 CO -0.06 0.18 -0.54 0.40 0.00 0.00 0.00 178.15 178.13 2bhx h ILE 274 N 1.01 1.47 -0.57 -0.67 2.04 -1.20 -2.84 117.51 116.75 2bhx h ILE 274 Ca 0.27 -2.12 -0.07 0.00 1.00 0.00 0.00 64.86 63.95 2bhx h ILE 274 Cb -0.11 2.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.67 2bhx h ILE 274 CO -0.06 0.60 0.08 1.88 0.00 0.00 0.00 178.15 180.65 2bhx h TYR 275 N -0.24 0.97 -0.67 1.37 -1.99 -0.82 -1.38 116.97 114.20 2bhx h TYR 275 Ca -0.07 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.53 2bhx h TYR 275 Cb 1.29 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 39.71 2bhx h TYR 275 CO 0.16 0.83 0.39 -0.44 -0.00 0.00 0.00 178.16 179.11 2bhx h ASP 276 N 0.87 0.80 -0.63 3.88 3.32 -1.03 0.21 116.42 123.84 2bhx h ASP 276 Ca 0.18 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2bhx h ASP 276 Cb 0.40 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2bhx h ASP 276 CO 0.01 0.63 0.37 0.74 -1.72 0.00 0.00 179.24 179.26 2bhx h THR 277 N 0.92 1.19 -0.49 0.35 2.02 -1.10 0.30 112.91 116.10 2bhx h THR 277 Ca 0.24 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2bhx h THR 277 Cb -0.02 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 2bhx h THR 277 CO -0.04 0.20 0.24 0.40 0.37 0.00 0.00 175.52 176.69 2bhx h ILE 278 N 0.85 1.19 0.00 3.11 2.04 -0.43 -2.87 117.51 121.40 2bhx h ILE 278 Ca 0.22 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2bhx h ILE 278 Cb 0.00 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2bhx h ILE 278 CO -0.04 0.21 -0.09 0.44 0.00 0.00 0.00 178.15 178.67 2bhx h ASP 279 N 0.65 0.00 -0.33 1.72 3.32 -0.01 -1.71 116.42 120.07 2bhx h ASP 279 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2bhx h ASP 279 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2bhx h ASP 279 CO -0.02 0.09 0.00 -0.62 -1.72 0.00 0.00 179.24 176.96 2bhx n GLU 280 N -3.14 2.13 -0.06 3.56 -0.58 0.98 -4.34 120.64 119.19 2bhx n GLU 280 Ca 0.02 -1.71 0.07 0.00 -0.42 0.00 0.00 57.16 55.12 2bhx n GLU 280 Cb 0.49 -1.44 0.29 0.00 -0.57 0.00 0.00 31.44 30.21 2bhx n GLU 280 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2bhx n SER 281 N 0.92 0.86 -4.11 1.62 3.41 -0.64 -4.92 113.62 110.75 2bhx n SER 281 Ca 0.18 -1.76 -0.33 0.00 -0.26 0.00 0.00 58.87 56.70 2bhx n SER 281 Cb 0.46 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.31 2bhx n SER 281 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2bhx n ASN 282 N -0.14 -3.09 0.00 4.04 5.15 -1.26 -1.29 115.26 118.68 2bhx n ASN 282 Ca 0.11 -0.96 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 2bhx n ASN 282 Cb 0.17 -3.04 0.00 0.00 -0.53 0.00 0.00 39.78 36.38 2bhx n ASN 282 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bhx n GLY 283 N -1.56 0.86 0.30 8.20 0.00 -1.26 -4.90 105.19 106.82 2bhx n GLY 283 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2bhx n GLY 283 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bhx h PHE 284 N 0.00 0.96 -3.79 1.61 3.57 -1.52 -3.41 116.94 114.37 2bhx h PHE 284 Ca 0.00 -0.14 -0.68 0.00 3.53 0.00 0.00 57.97 60.68 2bhx h PHE 284 Cb 0.00 -0.26 -0.24 0.00 2.79 0.00 0.00 35.95 38.24 2bhx h PHE 284 CO 0.00 0.86 -0.76 0.71 -2.23 0.00 0.00 178.31 176.89 2bhx s TYR 285 N -5.04 2.77 -0.15 0.41 1.51 -1.26 -3.72 117.35 111.86 2bhx s TYR 285 Ca -0.10 -0.26 -0.00 0.00 -1.01 0.00 0.00 57.07 55.70 2bhx s TYR 285 Cb 0.14 -1.70 0.03 0.00 -0.11 0.00 0.00 41.96 40.33 2bhx s TYR 285 CO 0.83 0.10 -0.09 0.08 -1.11 0.00 0.00 175.55 175.36 2bhx s VAL 286 N -0.44 1.30 0.28 0.71 1.01 0.04 -4.84 120.40 118.45 2bhx s VAL 286 Ca 0.06 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 2bhx s VAL 286 Cb -0.12 -1.35 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 2bhx s VAL 286 CO 0.02 0.28 1.07 -0.83 0.00 0.00 0.00 175.10 175.64 2bhx s GLY 287 N 1.57 3.07 0.10 4.51 0.00 -1.26 -1.00 107.32 114.32 2bhx s GLY 287 Ca 0.02 0.85 -0.17 0.00 0.00 0.00 0.00 44.72 45.43 2bhx s GLY 287 CO -0.09 1.44 1.54 0.84 0.00 0.00 0.00 173.10 176.84 2bhx h HIS 288 N 3.83 0.62 -4.03 1.90 2.76 -1.64 -3.46 115.15 115.14 2bhx h HIS 288 Ca -0.46 -0.11 -0.47 0.00 -2.20 0.00 0.00 60.37 57.12 2bhx h HIS 288 Cb 1.21 -0.16 0.02 0.00 1.55 0.00 0.00 27.41 30.03 2bhx h HIS 288 CO 0.59 0.69 0.39 0.00 -1.30 0.00 0.00 177.93 178.31 2bhx s ALA 289 N -4.99 2.96 0.51 5.26 0.00 -1.26 -4.74 121.76 119.50 2bhx s ALA 289 Ca -0.13 0.63 -0.22 0.00 0.00 0.00 0.00 51.96 52.24 2bhx s ALA 289 Cb 0.09 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.89 2bhx s ALA 289 CO 0.77 -0.25 1.21 -1.21 0.00 0.00 0.00 175.76 176.28 2bhx s GLU 290 N -2.95 3.44 0.25 0.00 2.02 0.78 -4.86 118.70 117.38 2bhx s GLU 290 Ca 0.63 1.87 -0.04 0.00 0.02 0.00 0.00 54.97 57.45 2bhx s GLU 290 Cb -0.18 -2.25 0.35 0.00 0.10 0.00 0.00 34.13 32.15 2bhx s GLU 290 CO 0.22 -0.84 1.88 0.87 0.02 0.00 0.00 175.26 177.41 2bhx h LYS 291 N 1.62 1.12 0.00 1.61 1.57 -1.95 0.12 116.57 120.66 2bhx h LYS 291 Ca -0.50 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2bhx h LYS 291 Cb 1.27 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2bhx h LYS 291 CO 0.58 0.74 0.00 0.41 -0.57 0.00 0.00 179.45 180.61 2bhx n GLY 292 N -1.35 -0.79 0.00 3.86 0.00 -1.26 -2.70 105.19 102.94 2bhx n GLY 292 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2bhx n GLY 292 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bhx n SER 293 N -1.43 1.80 -4.69 1.61 7.64 0.40 -4.86 113.62 114.09 2bhx n SER 293 Ca 0.03 -1.82 -0.44 0.00 1.01 0.00 0.00 58.87 57.65 2bhx n SER 293 Cb 0.11 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.28 2bhx n SER 293 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2bhx n ARG 294 N -0.41 2.52 -2.34 1.43 1.74 -1.04 -0.79 116.66 117.77 2bhx n ARG 294 Ca 0.00 0.91 -0.37 0.00 -0.77 0.00 0.00 57.85 57.62 2bhx n ARG 294 Cb 0.22 -2.74 -0.02 0.00 -1.02 0.00 0.00 32.46 28.89 2bhx n ARG 294 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bhx s SER 295 N 1.65 6.39 0.00 0.55 0.15 -0.14 -4.57 113.70 117.72 2bhx s SER 295 Ca 0.79 2.25 0.26 0.00 0.70 0.00 0.00 55.95 59.95 2bhx s SER 295 Cb -0.57 -2.60 0.67 0.00 -1.71 0.00 0.00 66.02 61.81 2bhx s SER 295 CO 0.37 -0.76 1.52 0.18 1.20 0.00 0.00 173.24 175.74 2bhx n LEU 296 N -0.27 0.81 -0.07 3.45 4.77 -1.26 -4.37 117.00 120.06 2bhx n LEU 296 Ca 0.06 -0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 55.80 2bhx n LEU 296 Cb 0.48 -0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 2bhx n LEU 296 CO 0.48 0.16 -0.99 0.23 -1.33 0.00 0.00 177.39 175.94 2bhx n MET 297 N -0.98 1.34 -3.67 3.23 2.81 -1.26 -4.73 117.12 113.86 2bhx n MET 297 Ca 0.10 0.03 -0.26 0.00 -1.81 0.00 0.00 57.70 55.76 2bhx n MET 297 Cb 0.34 -1.35 -0.17 0.00 -0.71 0.00 0.00 33.22 31.33 2bhx n MET 297 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2bhx s ASN 298 N -5.01 2.35 -0.42 7.83 -0.87 -1.26 -0.24 114.94 117.31 2bhx s ASN 298 Ca -0.12 -0.57 -0.17 0.00 -1.57 0.00 0.00 52.86 50.42 2bhx s ASN 298 Cb 0.05 -0.36 0.02 0.00 -0.02 0.00 0.00 41.25 40.94 2bhx s ASN 298 CO 0.51 -0.32 0.44 -0.69 -2.57 0.00 0.00 177.10 174.47 2bhx s VAL 299 N 2.04 5.09 -0.14 1.60 1.01 -0.05 -4.28 120.40 125.67 2bhx s VAL 299 Ca 0.02 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 2bhx s VAL 299 Cb -0.16 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2bhx s VAL 299 CO -0.08 -0.43 0.09 0.42 0.00 0.00 0.00 175.10 175.09 2bhx s THR 300 N 2.14 5.03 0.19 3.92 -4.23 -1.26 -0.64 115.64 120.79 2bhx s THR 300 Ca 0.12 0.04 -0.18 0.00 -1.18 0.00 0.00 61.69 60.48 2bhx s THR 300 Cb -0.17 -3.21 0.03 0.00 1.34 0.00 0.00 72.50 70.49 2bhx s THR 300 CO 0.13 0.55 0.54 0.72 -0.54 0.00 0.00 174.62 176.02 2bhx s PHE 301 N -0.41 -0.17 0.12 3.99 -0.12 -0.79 -1.64 117.98 118.96 2bhx s PHE 301 Ca 0.10 -0.17 0.06 0.00 -0.05 0.00 0.00 56.93 56.88 2bhx s PHE 301 Cb -0.12 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 2bhx s PHE 301 CO 0.02 -0.92 -0.15 -0.80 -0.05 0.00 0.00 175.22 173.32 2bhx s ASN 302 N -2.86 2.10 0.78 1.98 0.01 -0.17 -0.29 114.94 116.50 2bhx s ASN 302 Ca 0.08 -0.80 -0.05 0.00 -0.71 0.00 0.00 52.86 51.38 2bhx s ASN 302 Cb -0.01 -0.08 0.11 0.00 0.41 0.00 0.00 41.25 41.68 2bhx s ASN 302 CO -0.04 -0.12 0.72 0.18 -1.51 0.00 0.00 177.10 176.34 2bhx n LEU 303 N 0.56 0.00 0.26 0.60 4.32 -1.26 -0.78 117.00 120.70 2bhx n LEU 303 Ca -0.16 -1.15 0.15 0.00 -0.02 0.00 0.00 56.01 54.83 2bhx n LEU 303 Cb 0.57 -0.51 0.56 0.00 -1.62 0.00 0.00 43.42 42.42 2bhx n LEU 303 CO 0.27 -0.93 0.92 0.03 -1.22 0.00 0.00 177.39 176.46 2bhx h ARG 304 N 0.00 0.00 -3.57 3.23 3.08 -1.84 -3.46 114.38 111.81 2bhx h ARG 304 Ca -0.23 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.74 2bhx h ARG 304 Cb 0.76 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.74 2bhx h ARG 304 CO 0.21 0.06 -0.04 0.54 -1.07 0.00 0.00 179.97 179.67 2bhx s ASN 305 N -5.89 0.09 0.30 7.04 2.20 -1.26 -5.05 114.94 112.37 2bhx s ASN 305 Ca 0.02 -1.02 0.09 0.00 -0.94 0.00 0.00 52.86 51.01 2bhx s ASN 305 Cb 0.09 0.65 0.47 0.00 -2.00 0.00 0.00 41.25 40.46 2bhx s ASN 305 CO 0.58 -1.27 1.69 -0.08 -2.94 0.00 0.00 177.10 175.09 2bhx h GLU 306 N 2.16 0.09 -0.15 3.55 4.57 -1.99 -1.43 114.58 121.38 2bhx h GLU 306 Ca -0.26 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 57.86 2bhx h GLU 306 Cb 1.25 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 2bhx h GLU 306 CO 0.35 0.56 0.09 1.49 -1.18 0.00 0.00 179.01 180.33 2bhx h GLU 307 N 0.08 0.20 -0.76 1.92 4.57 -1.99 0.26 114.58 118.85 2bhx h GLU 307 Ca 0.00 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.14 2bhx h GLU 307 Cb 0.89 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.41 2bhx h GLU 307 CO 0.07 0.17 0.37 -0.07 -1.18 0.00 0.00 179.01 178.36 2bhx h LEU 308 N 0.17 0.99 -0.48 1.64 3.38 -1.86 -0.83 115.31 118.33 2bhx h LEU 308 Ca 0.05 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.00 2bhx h LEU 308 Cb 0.02 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.44 2bhx h LEU 308 CO -0.01 0.83 0.00 0.78 0.09 0.00 0.00 178.44 180.14 2bhx h ASN 309 N 1.08 -0.20 -0.30 -0.43 2.35 -0.94 0.71 115.58 117.86 2bhx h ASN 309 Ca 0.26 0.11 -0.18 0.00 -0.55 0.00 0.00 56.30 55.95 2bhx h ASN 309 Cb 0.11 0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 2bhx h ASN 309 CO -0.03 -0.06 -0.49 1.56 -1.65 0.00 0.00 177.43 176.75 2bhx h GLN 310 N 0.12 0.89 -0.59 0.81 4.20 -0.16 -0.85 115.11 119.52 2bhx h GLN 310 Ca 0.24 -0.53 -0.08 0.00 0.06 0.00 0.00 58.65 58.34 2bhx h GLN 310 Cb 0.36 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 2bhx h GLN 310 CO -0.40 1.17 0.04 1.96 -0.67 0.00 0.00 178.83 180.93 2bhx h GLN 311 N 0.70 1.00 0.23 1.46 4.20 -0.90 0.45 115.11 122.25 2bhx h GLN 311 Ca 0.03 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 2bhx h GLN 311 Cb 1.09 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.76 2bhx h GLN 311 CO 0.11 0.96 -0.11 0.35 -0.67 0.00 0.00 178.83 179.47 2bhx h PHE 312 N 0.93 -0.29 -0.25 2.96 3.57 -0.65 -0.66 116.94 122.55 2bhx h PHE 312 Ca 0.18 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 2bhx h PHE 312 Cb 0.49 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 2bhx h PHE 312 CO 0.03 -0.13 0.00 -0.07 -2.23 0.00 0.00 178.31 175.91 2bhx h LEU 313 N -0.38 0.33 -0.42 0.59 3.38 -0.96 -0.06 115.31 117.80 2bhx h LEU 313 Ca -0.03 -0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.72 2bhx h LEU 313 Cb 0.29 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2bhx h LEU 313 CO 0.05 0.39 -0.52 0.00 0.09 0.00 0.00 178.44 178.46 2bhx h ALA 314 N 1.65 0.60 -0.55 1.53 0.00 -0.68 -1.68 119.26 120.13 2bhx h ALA 314 Ca 0.08 -0.50 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 2bhx h ALA 314 Cb 0.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2bhx h ALA 314 CO 0.01 0.68 -0.09 -0.22 0.00 0.00 0.00 179.25 179.63 2bhx h LYS 315 N 0.58 1.03 -0.27 0.00 1.63 -0.54 -1.02 116.57 117.97 2bhx h LYS 315 Ca 0.02 -0.37 0.01 0.00 -0.85 0.00 0.00 60.65 59.46 2bhx h LYS 315 Cb 1.09 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.63 2bhx h LYS 315 CO 0.11 1.06 0.16 0.00 -3.45 0.00 0.00 179.45 177.33 2bhx h ALA 316 N 0.94 0.34 -0.83 5.00 0.00 -0.89 -1.10 119.26 122.71 2bhx h ALA 316 Ca 0.15 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2bhx h ALA 316 Cb 0.65 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2bhx h ALA 316 CO 0.05 -0.22 0.43 -0.22 0.00 0.00 0.00 179.25 179.29 2bhx h LYS 317 N 0.33 1.17 0.00 0.00 3.64 -1.10 0.13 116.57 120.74 2bhx h LYS 317 Ca 0.11 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 2bhx h LYS 317 Cb -0.00 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.59 2bhx h LYS 317 CO -0.05 0.88 -0.11 1.05 -2.27 0.00 0.00 179.45 178.96 2bhx h GLU 318 N 1.16 0.00 -0.30 1.90 4.11 -0.68 -2.21 114.58 118.56 2bhx h GLU 318 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.72 2bhx h GLU 318 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2bhx h GLU 318 CO -0.04 0.11 0.00 1.04 0.07 0.00 0.00 179.01 180.19 2bhx n GLN 319 N -4.31 1.89 0.00 1.06 1.13 -0.46 -4.91 117.38 111.78 2bhx n GLN 319 Ca -0.03 -1.37 0.00 0.00 -1.94 0.00 0.00 57.00 53.67 2bhx n GLN 319 Cb 0.18 -1.36 0.00 0.00 0.11 0.00 0.00 30.24 29.17 2bhx n GLN 319 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2bhx n GLY 320 N 1.17 0.62 3.72 1.08 0.00 -0.75 -4.81 105.19 106.21 2bhx n GLY 320 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2bhx n GLY 320 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bhx s PHE 321 N -2.00 3.70 -0.09 1.61 0.40 -0.09 -0.09 117.98 121.42 2bhx s PHE 321 Ca 0.00 1.66 0.03 0.00 -0.60 0.00 0.00 56.93 58.03 2bhx s PHE 321 Cb 0.00 -3.05 -0.01 0.00 0.51 0.00 0.00 43.02 40.47 2bhx s PHE 321 CO 0.00 0.08 -0.19 0.08 0.70 0.00 0.00 175.22 175.90 2bhx s VAL 322 N 0.62 2.59 0.00 -0.44 1.01 0.38 -4.03 120.40 120.53 2bhx s VAL 322 Ca 0.48 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.61 2bhx s VAL 322 Cb -0.21 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.15 2bhx s VAL 322 CO 0.27 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.54 2bhx n GLY 323 N 3.12 0.65 0.14 4.51 0.00 -1.26 0.06 105.19 112.41 2bhx n GLY 323 Ca -0.18 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.72 2bhx n GLY 323 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bhx h LEU 324 N 0.00 0.00 -9.72 0.99 3.38 -1.80 -3.42 115.31 104.74 2bhx h LEU 324 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 2bhx h LEU 324 Cb 0.00 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.82 2bhx h LEU 324 CO 0.00 0.00 0.96 0.20 0.09 0.00 0.00 178.44 179.69 2bhx s ASN 325 N -4.87 6.37 1.06 -0.43 -0.87 -1.26 -0.51 114.94 114.43 2bhx s ASN 325 Ca 0.08 2.91 -0.12 0.00 -1.57 0.00 0.00 52.86 54.16 2bhx s ASN 325 Cb 0.10 -2.62 0.21 0.00 -0.02 0.00 0.00 41.25 38.92 2bhx s ASN 325 CO 0.57 -0.95 0.95 0.61 -2.57 0.00 0.00 177.10 175.71 2bhx n GLY 326 N 3.15 -1.41 3.64 0.66 0.00 0.49 -4.45 105.19 107.27 2bhx n GLY 326 Ca 0.12 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 2bhx n GLY 326 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2bhx n HIS 327 N -4.58 1.39 0.08 1.61 -0.00 -1.26 -4.57 115.22 107.89 2bhx n HIS 327 Ca 0.07 0.52 0.11 0.00 0.46 0.00 0.00 57.72 58.87 2bhx n HIS 327 Cb 0.54 -2.25 0.58 0.00 -0.12 0.00 0.00 29.99 28.74 2bhx n HIS 327 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 2bhx h ARG 328 N 1.48 0.18 0.00 1.57 -0.00 -1.92 0.69 114.38 116.38 2bhx h ARG 328 Ca -0.46 -0.01 0.00 0.00 -0.00 0.00 0.00 59.98 59.51 2bhx h ARG 328 Cb 1.33 -0.04 0.00 0.00 -0.00 0.00 0.00 29.97 31.26 2bhx h ARG 328 CO 0.56 0.12 0.00 -1.13 -0.00 0.00 0.00 179.97 179.53 2bhx n SER 329 N -4.48 0.62 0.00 0.08 3.41 -1.26 -4.04 113.62 107.95 2bhx n SER 329 Ca 0.04 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 2bhx n SER 329 Cb 0.26 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 2bhx n SER 329 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2bhx n VAL 330 N -2.18 0.00 -4.23 -3.33 0.24 0.04 -5.13 118.33 103.73 2bhx n VAL 330 Ca 0.02 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.22 2bhx n VAL 330 Cb 0.24 0.64 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 2bhx n VAL 330 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bhx n GLY 331 N 0.60 -0.87 7.00 7.63 0.00 -0.08 -4.98 105.19 114.48 2bhx n GLY 331 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2bhx n GLY 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhx n GLY 332 N 0.00 0.96 3.38 -0.02 0.00 -1.26 -3.98 105.19 104.26 2bhx n GLY 332 Ca 0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 2bhx n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhx s ARG 334 N -3.09 0.30 -0.51 0.00 3.52 0.33 -1.89 118.95 117.60 2bhx s ARG 334 Ca 0.21 0.61 -0.20 0.00 -0.13 0.00 0.00 55.73 56.22 2bhx s ARG 334 Cb -0.05 -0.38 0.06 0.00 -1.56 0.00 0.00 34.95 33.02 2bhx s ARG 334 CO 0.09 -0.53 0.65 0.00 -0.81 0.00 0.00 175.30 174.70 2bhx s ALA 335 N 2.51 3.37 -0.12 6.12 0.00 0.19 -4.27 121.76 129.56 2bhx s ALA 335 Ca 0.08 -1.69 -0.23 0.00 0.00 0.00 0.00 51.96 50.12 2bhx s ALA 335 Cb -0.14 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2bhx s ALA 335 CO -0.14 -2.03 0.72 -1.12 0.00 0.00 0.00 175.76 173.19 2bhx s SER 336 N 2.68 6.92 -0.35 0.00 0.01 -1.22 -0.87 113.70 120.88 2bhx s SER 336 Ca 0.17 1.12 0.13 0.00 1.31 0.00 0.00 55.95 58.67 2bhx s SER 336 Cb -0.19 -2.41 0.45 0.00 0.21 0.00 0.00 66.02 64.09 2bhx s SER 336 CO 0.13 -0.22 1.06 2.30 0.41 0.00 0.00 173.24 176.92 2bhx n ILE 337 N 4.20 1.71 -0.58 1.44 -5.35 0.66 -4.60 119.36 116.85 2bhx n ILE 337 Ca 0.00 -3.85 -0.30 0.00 -0.27 0.00 0.00 62.75 58.34 2bhx n ILE 337 Cb 0.50 -0.15 0.20 0.00 -1.74 0.00 0.00 39.64 38.45 2bhx n ILE 337 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2bhx n TYR 338 N -0.37 -1.63 -0.34 4.28 4.02 -1.25 -4.71 117.16 117.16 2bhx n TYR 338 Ca 0.24 -0.01 0.07 0.00 -0.01 0.00 0.00 57.90 58.19 2bhx n TYR 338 Cb 0.78 -1.56 0.16 0.00 -0.02 0.00 0.00 39.34 38.70 2bhx n TYR 338 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2bhx n ASN 339 N -2.71 -0.30 -0.08 7.72 3.02 -1.26 -1.39 115.26 120.26 2bhx n ASN 339 Ca 0.02 1.64 0.14 0.00 -0.03 0.00 0.00 54.58 56.35 2bhx n ASN 339 Cb 0.58 -0.52 0.56 0.00 -0.61 0.00 0.00 39.78 39.80 2bhx n ASN 339 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bhx n ALA 340 N -3.56 2.80 -2.12 5.41 0.00 -1.26 -4.77 120.51 117.01 2bhx n ALA 340 Ca 0.17 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 2bhx n ALA 340 Cb 0.53 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 2bhx n ALA 340 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bhx s VAL 341 N -2.64 3.50 0.51 0.00 1.01 -0.49 -4.70 120.40 117.59 2bhx s VAL 341 Ca 0.24 0.88 -0.19 0.00 0.00 0.00 0.00 61.98 62.91 2bhx s VAL 341 Cb 0.19 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.93 2bhx s VAL 341 CO 0.52 -0.01 1.03 -2.16 0.00 0.00 0.00 175.10 174.48 2bhx s PRO 342 N 2.60 3.74 0.45 2.72 0.04 -1.26 -4.92 135.00 138.37 2bhx s PRO 342 Ca 0.67 1.25 0.16 0.00 0.04 0.00 0.00 61.00 63.13 2bhx s PRO 342 Cb -0.34 -2.09 1.05 0.00 0.04 0.00 0.00 34.50 33.16 2bhx s PRO 342 CO 0.28 -0.47 1.99 0.97 0.04 0.00 0.00 177.00 179.82 2bhx h ILE 343 N 1.24 1.05 0.00 0.56 2.10 -1.95 -1.59 117.51 118.92 2bhx h ILE 343 Ca -0.48 -0.66 0.00 0.00 1.08 0.00 0.00 64.86 64.79 2bhx h ILE 343 Cb 1.21 1.37 0.00 0.00 -1.09 0.00 0.00 36.82 38.31 2bhx h ILE 343 CO 0.59 0.19 0.00 -2.24 -1.08 0.00 0.00 178.15 175.61 2bhx h ASP 344 N 0.00 0.00 -0.58 2.19 3.04 -1.99 -0.45 116.42 118.63 2bhx h ASP 344 Ca -0.00 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.70 2bhx h ASP 344 Cb 0.35 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.62 2bhx h ASP 344 CO 0.02 0.00 0.01 0.00 -2.04 0.00 0.00 179.24 177.24 2bhx h ALA 345 N 2.02 0.89 -0.38 4.15 0.00 -1.66 0.16 119.26 124.43 2bhx h ALA 345 Ca 0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 2bhx h ALA 345 Cb 0.53 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2bhx h ALA 345 CO 0.00 0.66 -0.11 0.00 0.00 0.00 0.00 179.25 179.80 2bhx h ILE 347 N 0.55 1.15 -0.73 0.00 2.04 -1.03 -0.60 117.51 118.89 2bhx h ILE 347 Ca 0.10 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.72 2bhx h ILE 347 Cb 0.63 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 2bhx h ILE 347 CO 0.04 0.15 0.43 0.00 0.00 0.00 0.00 178.15 178.78 2bhx h ALA 348 N 1.23 0.98 -0.52 1.87 0.00 -0.66 -0.37 119.26 121.80 2bhx h ALA 348 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2bhx h ALA 348 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2bhx h ALA 348 CO -0.06 0.15 0.15 1.25 0.00 0.00 0.00 179.25 180.74 2bhx h LEU 349 N 0.80 0.76 -0.54 0.00 5.85 -0.66 -0.29 115.31 121.24 2bhx h LEU 349 Ca 0.32 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.87 2bhx h LEU 349 Cb 0.15 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 2bhx h LEU 349 CO -0.16 0.78 0.28 -0.09 -0.34 0.00 0.00 178.44 178.90 2bhx h ARG 350 N 0.71 0.53 -0.74 1.25 2.43 -0.51 0.22 114.38 118.26 2bhx h ARG 350 Ca 0.17 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2bhx h ARG 350 Cb 0.30 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 2bhx h ARG 350 CO -0.00 0.35 0.45 0.93 -1.51 0.00 0.00 179.97 180.19 2bhx h GLU 351 N 0.54 0.84 -0.43 0.20 5.08 -0.51 0.82 114.58 121.13 2bhx h GLU 351 Ca 0.23 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2bhx h GLU 351 Cb 0.13 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2bhx h GLU 351 CO -0.16 0.56 0.28 1.25 -1.00 0.00 0.00 179.01 179.94 2bhx h LEU 352 N 0.87 0.48 -0.75 1.33 5.85 -0.24 -1.27 115.31 121.59 2bhx h LEU 352 Ca 0.31 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.91 2bhx h LEU 352 Cb 0.08 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 2bhx h LEU 352 CO -0.14 0.35 -0.17 0.24 -0.34 0.00 0.00 178.44 178.38 2bhx h MET 353 N 0.57 0.77 -0.19 1.25 2.86 0.30 -0.25 114.93 120.23 2bhx h MET 353 Ca 0.16 -0.29 -0.21 0.00 -2.06 0.00 0.00 59.70 57.30 2bhx h MET 353 Cb -0.06 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 31.56 2bhx h MET 353 CO -0.04 0.89 -0.71 0.82 1.06 0.00 0.00 176.91 178.93 2bhx h ILE 354 N 0.68 1.28 -0.11 -1.22 2.04 -0.67 -1.76 117.51 117.75 2bhx h ILE 354 Ca 0.10 -1.90 -0.17 0.00 1.00 0.00 0.00 64.86 63.89 2bhx h ILE 354 Cb 0.67 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 2bhx h ILE 354 CO 0.05 0.61 -0.67 1.56 0.00 0.00 0.00 178.15 179.70 2bhx h GLN 355 N 0.58 0.43 -0.50 2.37 1.08 -1.00 -0.07 115.11 118.00 2bhx h GLN 355 Ca -0.03 -0.32 0.03 0.00 -1.45 0.00 0.00 58.65 56.87 2bhx h GLN 355 Cb 1.34 0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.79 2bhx h GLN 355 CO 0.15 0.95 0.29 0.35 -0.95 0.00 0.00 178.83 179.62 2bhx h PHE 356 N 0.31 0.54 -0.20 2.96 3.57 -1.02 -0.44 116.94 122.66 2bhx h PHE 356 Ca -0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2bhx h PHE 356 Cb 1.23 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.79 2bhx h PHE 356 CO 0.04 0.30 0.08 -0.22 -2.23 0.00 0.00 178.31 176.29 2bhx h LYS 357 N 0.58 0.30 -0.01 1.11 3.64 -1.11 -1.52 116.57 119.56 2bhx h LYS 357 Ca 0.20 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 2bhx h LYS 357 Cb 0.04 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2bhx h LYS 357 CO -0.10 0.36 -0.27 0.93 -2.27 0.00 0.00 179.45 178.10 2bhx h GLU 358 N 0.18 0.02 -0.19 1.90 5.08 -0.68 -1.60 114.58 119.29 2bhx h GLU 358 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2bhx h GLU 358 Cb 0.17 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2bhx h GLU 358 CO -0.01 0.29 0.00 0.09 -1.00 0.00 0.00 179.01 178.38 2bhx n ASN 359 N -4.21 2.23 -0.51 1.42 3.02 -0.20 -5.10 115.26 111.91 2bhx n ASN 359 Ca -0.02 -1.78 0.14 0.00 -0.03 0.00 0.00 54.58 52.89 2bhx n ASN 359 Cb 0.32 -0.12 0.50 0.00 -0.61 0.00 0.00 39.78 39.87 2bhx n ASN 359 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64