#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0b n PHE 447 N 0.00 0.00 0.26 0.66 0.99 -1.26 -4.82 117.46 113.29 3h0b n PHE 447 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.56 3h0b n PHE 447 Cb 0.00 -0.16 0.71 0.00 -1.00 0.00 0.00 39.48 39.03 3h0b n PHE 447 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3h0b h VAL 448 N 0.00 0.70 0.00 -4.37 2.07 -2.01 0.26 116.25 112.89 3h0b h VAL 448 Ca 0.00 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 3h0b h VAL 448 Cb 0.00 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3h0b h VAL 448 CO 0.00 0.11 -0.14 -0.33 0.02 0.00 0.00 177.57 177.23 3h0b h GLU 1 N 0.00 0.00 0.00 1.57 4.39 -1.93 -3.17 114.58 115.44 3h0b h GLU 1 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3h0b h GLU 1 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 3h0b h GLU 1 CO 0.01 0.14 -1.71 -1.33 -1.16 0.00 0.00 179.01 174.97 3h0b n MET 2 N -3.39 0.63 -1.71 2.33 2.81 -0.06 -4.53 117.12 113.20 3h0b n MET 2 Ca -0.01 -0.15 -0.43 0.00 -1.81 0.00 0.00 57.70 55.31 3h0b n MET 2 Cb 0.33 -1.43 -0.03 0.00 -0.71 0.00 0.00 33.22 31.38 3h0b n MET 2 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h0b n VAL 3 N -2.05 0.05 -1.12 2.03 0.31 -0.37 -2.01 118.33 115.17 3h0b n VAL 3 Ca -0.02 -0.01 -0.04 0.00 -0.01 0.00 0.00 64.34 64.25 3h0b n VAL 3 Cb 0.46 -1.95 -0.02 0.00 -0.91 0.00 0.00 33.84 31.42 3h0b n VAL 3 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3h0b n ASP 4 N 4.15 -3.51 0.00 4.52 4.64 -1.20 -4.91 116.55 120.25 3h0b n ASP 4 Ca 0.16 0.10 0.15 0.00 -1.38 0.00 0.00 54.79 53.82 3h0b n ASP 4 Cb 0.34 -1.37 0.79 0.00 -1.04 0.00 0.00 41.12 39.85 3h0b n ASP 4 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3h0b n ASN 5 N 1.31 0.00 -4.83 1.67 6.94 -0.85 -4.75 115.26 114.74 3h0b n ASN 5 Ca -0.04 -0.42 -0.35 0.00 -0.02 0.00 0.00 54.58 53.75 3h0b n ASN 5 Cb 0.14 -0.18 -0.07 0.00 -2.36 0.00 0.00 39.78 37.31 3h0b n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3h0b s LEU 6 N -2.37 4.12 0.36 -4.53 1.43 -0.41 -4.35 118.68 112.94 3h0b s LEU 6 Ca 0.34 0.30 0.04 0.00 -1.03 0.00 0.00 54.13 53.78 3h0b s LEU 6 Cb 0.20 -2.21 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 3h0b s LEU 6 CO 0.41 0.33 0.08 -0.13 0.23 0.00 0.00 176.35 177.28 3h0b s ARG 7 N -1.40 1.77 -0.18 1.70 1.81 -0.93 -2.09 118.95 119.63 3h0b s ARG 7 Ca 0.20 -2.03 -0.35 0.00 -1.72 0.00 0.00 55.73 51.82 3h0b s ARG 7 Cb -0.12 -0.78 0.14 0.00 -0.45 0.00 0.00 34.95 33.74 3h0b s ARG 7 CO 0.10 -0.31 1.31 0.20 -0.68 0.00 0.00 175.30 175.92 3h0b s GLY 8 N -3.54 -0.31 -0.18 -3.53 0.00 -0.59 -0.50 107.32 98.66 3h0b s GLY 8 Ca 0.30 1.46 -0.01 0.00 0.00 0.00 0.00 44.72 46.47 3h0b s GLY 8 CO 0.14 0.45 -0.12 1.25 0.00 0.00 0.00 173.10 174.83 3h0b s LYS 9 N -2.25 3.25 0.15 2.90 2.20 -1.23 -1.95 119.74 122.81 3h0b s LYS 9 Ca 0.12 -0.71 -0.22 0.00 -0.36 0.00 0.00 55.97 54.80 3h0b s LYS 9 Cb 0.01 -2.77 -0.13 0.00 -1.51 0.00 0.00 37.83 33.43 3h0b s LYS 9 CO -0.04 -0.09 0.43 0.45 -0.36 0.00 0.00 175.35 175.74 3h0b n SER 10 N 4.41 -0.92 0.00 1.43 2.88 -1.26 -0.26 113.62 119.90 3h0b n SER 10 Ca -0.19 0.88 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 3h0b n SER 10 Cb 0.51 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 3h0b n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3h0b n GLY 11 N 1.53 0.42 0.00 0.46 0.00 -1.26 -4.74 105.19 101.60 3h0b n GLY 11 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3h0b n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0b n GLN 12 N -1.72 -0.63 0.00 1.61 6.02 0.64 -4.90 117.38 118.40 3h0b n GLN 12 Ca 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 57.00 56.55 3h0b n GLN 12 Cb 0.07 -0.93 0.00 0.00 1.02 0.00 0.00 30.24 30.39 3h0b n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h0b n GLY 13 N 0.03 -0.13 3.66 1.08 0.00 -1.24 -4.85 105.19 103.75 3h0b n GLY 13 Ca 0.00 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.83 3h0b n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h0b s TYR 14 N -1.48 3.09 0.05 1.61 1.51 -1.26 -3.51 117.35 117.36 3h0b s TYR 14 Ca 0.00 0.13 0.06 0.00 -1.01 0.00 0.00 57.07 56.25 3h0b s TYR 14 Cb 0.00 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 3h0b s TYR 14 CO 0.00 0.44 -0.16 1.52 -1.11 0.00 0.00 175.55 176.23 3h0b s TYR 15 N -0.91 1.43 0.18 2.71 -0.85 0.34 0.26 117.35 120.50 3h0b s TYR 15 Ca 0.14 -0.39 0.08 0.00 -0.52 0.00 0.00 57.07 56.39 3h0b s TYR 15 Cb -0.11 -0.83 -0.04 0.00 0.38 0.00 0.00 41.96 41.36 3h0b s TYR 15 CO 0.04 0.08 -0.02 0.54 -1.52 0.00 0.00 175.55 174.67 3h0b s VAL 16 N -0.96 3.62 -0.07 -3.49 0.11 0.63 -2.20 120.40 118.04 3h0b s VAL 16 Ca 0.03 -1.48 -0.24 0.00 -2.93 0.00 0.00 61.98 57.35 3h0b s VAL 16 Cb -0.09 -2.82 -0.03 0.00 -1.53 0.00 0.00 36.38 31.91 3h0b s VAL 16 CO 0.02 -0.12 0.73 -0.70 -3.33 0.00 0.00 175.10 171.70 3h0b s GLU 17 N -2.96 4.43 0.10 1.54 2.12 -1.26 -0.42 118.70 122.26 3h0b s GLU 17 Ca 0.27 0.93 0.04 0.00 0.36 0.00 0.00 54.97 56.56 3h0b s GLU 17 Cb -0.09 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.80 3h0b s GLU 17 CO 0.18 0.01 -0.10 -1.64 -0.54 0.00 0.00 175.26 173.17 3h0b s MET 18 N 0.97 0.87 -0.00 4.30 -1.94 -0.36 -3.91 119.30 119.23 3h0b s MET 18 Ca 0.38 -1.21 0.07 0.00 -1.71 0.00 0.00 55.69 53.23 3h0b s MET 18 Cb -0.18 -0.51 -0.02 0.00 2.01 0.00 0.00 34.83 36.13 3h0b s MET 18 CO 0.18 0.07 -0.23 0.95 -0.01 0.00 0.00 175.02 175.98 3h0b s THR 19 N -2.66 1.84 -0.03 2.05 -4.23 0.05 -0.87 115.64 111.80 3h0b s THR 19 Ca 0.07 -1.07 0.03 0.00 -1.18 0.00 0.00 61.69 59.54 3h0b s THR 19 Cb -0.01 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 72.28 3h0b s THR 19 CO -0.00 0.45 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.71 3h0b s VAL 20 N -0.61 1.05 0.00 2.29 1.01 -0.24 -1.14 120.40 122.76 3h0b s VAL 20 Ca 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.56 3h0b s VAL 20 Cb -0.09 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.38 3h0b s VAL 20 CO -0.00 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.02 3h0b n GLY 21 N 3.21 0.06 2.70 4.51 0.00 -0.03 -0.97 105.19 114.66 3h0b n GLY 21 Ca -0.18 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 43.71 3h0b n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h0b s SER 22 N -0.94 1.47 0.91 1.61 0.01 -1.26 -2.53 113.70 112.96 3h0b s SER 22 Ca 0.00 -0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.08 3h0b s SER 22 Cb 0.00 -0.26 0.14 0.00 0.21 0.00 0.00 66.02 66.11 3h0b s SER 22 CO 0.00 -0.25 1.12 -2.16 0.41 0.00 0.00 173.24 172.36 3h0b s PRO 23 N 2.10 1.10 0.31 12.44 0.04 -1.26 -1.20 135.00 148.53 3h0b s PRO 23 Ca 0.04 1.34 -0.29 0.00 0.04 0.00 0.00 61.00 62.13 3h0b s PRO 23 Cb -0.13 -1.75 -0.11 0.00 0.04 0.00 0.00 34.50 32.55 3h0b s PRO 23 CO -0.04 -2.50 1.45 -1.25 0.04 0.00 0.00 177.00 174.69 3h0b s PRO 24 N -4.71 4.22 -0.16 0.56 0.04 -1.05 -4.88 135.00 129.02 3h0b s PRO 24 Ca 0.65 2.41 -0.01 0.00 0.04 0.00 0.00 61.00 64.10 3h0b s PRO 24 Cb -0.21 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.27 3h0b s PRO 24 CO 0.58 -0.44 -0.12 -0.65 0.04 0.00 0.00 177.00 176.42 3h0b s GLN 25 N -1.21 3.33 0.06 4.56 -0.21 -0.15 -4.89 119.66 121.16 3h0b s GLN 25 Ca 0.56 -0.69 -0.22 0.00 0.02 0.00 0.00 55.36 55.03 3h0b s GLN 25 Cb -0.44 -2.71 -0.06 0.00 1.00 0.00 0.00 33.01 30.80 3h0b s GLN 25 CO 0.52 0.06 0.65 0.99 -2.12 0.00 0.00 175.29 175.39 3h0b s THR 26 N 0.73 4.73 0.05 -0.19 2.01 -1.26 -1.08 115.64 120.64 3h0b s THR 26 Ca -0.05 1.39 -0.09 0.00 0.31 0.00 0.00 61.69 63.25 3h0b s THR 26 Cb -0.15 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.37 3h0b s THR 26 CO 0.02 0.47 0.19 -0.76 -0.69 0.00 0.00 174.62 173.84 3h0b s LEU 27 N -0.61 1.41 -0.34 4.42 1.43 -0.05 -4.95 118.68 120.00 3h0b s LEU 27 Ca 0.33 -0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 52.83 3h0b s LEU 27 Cb -0.20 0.96 -0.02 0.00 0.03 0.00 0.00 46.19 46.96 3h0b s LEU 27 CO 0.20 -0.60 0.29 0.20 0.23 0.00 0.00 176.35 176.67 3h0b s ASN 28 N -2.31 6.11 -0.21 2.29 0.02 -1.26 -1.22 114.94 118.36 3h0b s ASN 28 Ca -0.02 -0.32 -0.06 0.00 -1.02 0.00 0.00 52.86 51.43 3h0b s ASN 28 Cb 0.01 -2.16 -0.03 0.00 0.02 0.00 0.00 41.25 39.08 3h0b s ASN 28 CO -0.06 -0.27 0.04 -0.63 0.02 0.00 0.00 177.10 176.20 3h0b s ILE 29 N 1.85 4.25 0.33 0.60 -1.09 0.45 0.06 121.20 127.65 3h0b s ILE 29 Ca 0.09 -0.21 -0.29 0.00 -2.23 0.00 0.00 60.65 58.01 3h0b s ILE 29 Cb -0.17 -2.95 -0.11 0.00 -1.58 0.00 0.00 42.46 37.65 3h0b s ILE 29 CO 0.11 0.40 1.52 -0.22 -1.23 0.00 0.00 174.94 175.52 3h0b s LEU 30 N 1.07 4.34 -0.57 2.97 2.96 0.07 -0.27 118.68 129.25 3h0b s LEU 30 Ca 0.03 2.98 -0.20 0.00 -0.22 0.00 0.00 54.13 56.72 3h0b s LEU 30 Cb -0.14 -3.65 0.08 0.00 0.50 0.00 0.00 46.19 42.98 3h0b s LEU 30 CO 0.02 -0.87 0.74 -0.69 -1.32 0.00 0.00 176.35 174.24 3h0b s VAL 31 N -0.62 4.73 -0.36 1.68 1.01 0.14 0.22 120.40 127.20 3h0b s VAL 31 Ca 0.57 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.91 3h0b s VAL 31 Cb -0.47 -4.47 0.10 0.00 0.00 0.00 0.00 36.38 31.54 3h0b s VAL 31 CO 0.56 -1.08 0.09 -0.62 0.00 0.00 0.00 175.10 174.04 3h0b s ASP 32 N 3.30 4.94 -0.01 3.32 3.68 -0.61 -4.24 116.67 127.06 3h0b s ASP 32 Ca 0.16 -1.96 0.04 0.00 2.13 0.00 0.00 52.55 52.92 3h0b s ASP 32 Cb -0.21 -1.71 0.12 0.00 -1.45 0.00 0.00 42.92 39.68 3h0b s ASP 32 CO 0.09 -0.42 1.05 0.35 0.13 0.00 0.00 175.17 176.38 3h0b n THR 33 N 4.43 0.22 0.07 1.71 -2.24 -1.26 -0.51 114.28 116.70 3h0b n THR 33 Ca -0.02 -0.19 0.06 0.00 -2.27 0.00 0.00 64.05 61.64 3h0b n THR 33 Cb 0.42 0.02 0.12 0.00 -2.10 0.00 0.00 70.33 68.79 3h0b n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h0b n GLY 34 N 0.64 1.61 3.46 3.38 0.00 -1.26 -4.28 105.19 108.74 3h0b n GLY 34 Ca 0.05 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 3h0b n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0b s SER 35 N -1.00 0.54 -0.02 1.61 1.04 -1.21 -4.98 113.70 109.69 3h0b s SER 35 Ca 0.21 -1.33 0.02 0.00 0.48 0.00 0.00 55.95 55.33 3h0b s SER 35 Cb 0.12 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.86 3h0b s SER 35 CO 0.16 -1.17 0.82 -1.20 0.98 0.00 0.00 173.24 172.84 3h0b n SER 36 N -0.94 0.56 -4.75 7.02 7.64 -1.26 -0.36 113.62 121.53 3h0b n SER 36 Ca 0.01 -1.75 -0.34 0.00 1.01 0.00 0.00 58.87 57.80 3h0b n SER 36 Cb 0.62 -0.12 -0.08 0.00 -1.01 0.00 0.00 64.21 63.62 3h0b n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3h0b s ASN 37 N -0.84 5.58 -0.56 6.43 -0.87 -1.26 -4.40 114.94 119.01 3h0b s ASN 37 Ca 0.04 0.17 -0.18 0.00 -1.57 0.00 0.00 52.86 51.32 3h0b s ASN 37 Cb 0.03 -1.61 0.10 0.00 -0.02 0.00 0.00 41.25 39.75 3h0b s ASN 37 CO 0.00 0.32 0.64 0.12 -2.57 0.00 0.00 177.10 175.62 3h0b s PHE 38 N -1.07 3.06 -0.04 2.20 5.99 -1.26 -0.16 117.98 126.71 3h0b s PHE 38 Ca 0.19 -0.95 0.06 0.00 0.00 0.00 0.00 56.93 56.23 3h0b s PHE 38 Cb -0.12 -3.85 -0.01 0.00 0.00 0.00 0.00 43.02 39.04 3h0b s PHE 38 CO 0.09 -1.18 -0.22 0.00 -0.00 0.00 0.00 175.22 173.91 3h0b s ALA 39 N 2.43 1.88 0.01 11.12 0.00 -0.67 -0.32 121.76 136.21 3h0b s ALA 39 Ca 0.10 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.14 3h0b s ALA 39 Cb -0.24 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 3h0b s ALA 39 CO 0.07 0.40 -0.01 0.14 0.00 0.00 0.00 175.76 176.35 3h0b s VAL 40 N -0.27 0.08 0.13 0.00 -7.23 -0.60 0.66 120.40 113.18 3h0b s VAL 40 Ca 0.02 -0.26 -0.34 0.00 -1.81 0.00 0.00 61.98 59.58 3h0b s VAL 40 Cb -0.11 -0.12 -0.14 0.00 0.56 0.00 0.00 36.38 36.57 3h0b s VAL 40 CO 0.01 -0.11 1.61 0.61 -0.31 0.00 0.00 175.10 176.91 3h0b n GLY 41 N 2.68 1.15 0.22 2.32 0.00 -0.13 -0.54 105.19 110.90 3h0b n GLY 41 Ca -0.15 0.68 0.03 0.00 0.00 0.00 0.00 46.02 46.57 3h0b n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0b n ALA 42 N 3.75 1.90 -3.10 4.61 0.00 0.14 0.12 120.51 127.94 3h0b n ALA 42 Ca 0.18 -1.40 -0.12 0.00 0.00 0.00 0.00 53.44 52.10 3h0b n ALA 42 Cb 0.29 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.38 3h0b n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0b s ALA 43 N -1.00 -1.03 0.33 0.00 0.00 -1.19 -4.76 121.76 114.11 3h0b s ALA 43 Ca 0.10 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 51.93 3h0b s ALA 43 Cb 0.08 0.58 -0.13 0.00 0.00 0.00 0.00 23.12 23.65 3h0b s ALA 43 CO 0.01 -0.58 1.06 -2.30 0.00 0.00 0.00 175.76 173.95 3h0b n PRO 44 N 0.03 1.51 -3.65 0.00 -0.02 -1.26 -4.93 135.00 126.68 3h0b n PRO 44 Ca -0.17 0.53 -0.15 0.00 -2.02 0.00 0.00 63.50 61.69 3h0b n PRO 44 Cb 0.62 -1.98 -0.08 0.00 -0.02 0.00 0.00 33.50 32.04 3h0b n PRO 44 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3h0b s HIS 45 N -1.12 -0.46 0.53 6.00 2.46 -1.26 -5.03 115.29 116.41 3h0b s HIS 45 Ca 0.59 0.87 0.22 0.00 0.47 0.00 0.00 55.06 57.21 3h0b s HIS 45 Cb -0.64 0.24 1.47 0.00 -0.13 0.00 0.00 32.58 33.52 3h0b s HIS 45 CO 0.60 -0.45 2.17 -1.35 -2.47 0.00 0.00 174.74 173.24 3h0b h PRO 46 N 3.89 0.00 0.00 2.88 0.11 -2.01 -2.30 132.00 134.57 3h0b h PRO 46 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3h0b h PRO 46 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3h0b h PRO 46 CO 0.34 0.03 -1.02 1.19 -0.21 0.00 0.00 178.00 178.33 3h0b n PHE 47 N -4.16 0.08 -3.46 0.65 0.99 -1.26 -4.83 117.46 105.48 3h0b n PHE 47 Ca -0.03 0.02 -0.40 0.00 -0.00 0.00 0.00 57.45 57.05 3h0b n PHE 47 Cb 0.12 -0.22 -0.10 0.00 -1.00 0.00 0.00 39.48 38.28 3h0b n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3h0b s LEU 48 N -3.42 4.23 0.00 4.37 1.43 -0.87 -4.62 118.68 119.80 3h0b s LEU 48 Ca 0.06 -0.05 0.25 0.00 -1.03 0.00 0.00 54.13 53.36 3h0b s LEU 48 Cb 0.16 -2.29 0.49 0.00 0.03 0.00 0.00 46.19 44.57 3h0b s LEU 48 CO 0.83 -0.21 1.43 1.41 0.23 0.00 0.00 176.35 180.03 3h0b n HIS 49 N 5.26 0.03 -3.81 0.29 8.25 -1.26 -4.41 115.22 119.57 3h0b n HIS 49 Ca -0.10 -0.01 -0.10 0.00 -0.26 0.00 0.00 57.72 57.24 3h0b n HIS 49 Cb 0.50 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.54 3h0b n HIS 49 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3h0b s ARG 50 N -1.97 0.76 0.07 -0.41 0.52 -1.26 -5.17 118.95 111.49 3h0b s ARG 50 Ca 0.32 -0.65 -0.24 0.00 -0.52 0.00 0.00 55.73 54.63 3h0b s ARG 50 Cb 0.20 0.32 0.06 0.00 0.52 0.00 0.00 34.95 36.06 3h0b s ARG 50 CO 0.31 -0.24 0.58 1.52 0.02 0.00 0.00 175.30 177.50 3h0b s TYR 51 N -2.81 -0.51 -0.07 -0.53 -0.85 -1.26 -4.93 117.35 106.38 3h0b s TYR 51 Ca -0.03 0.55 -0.30 0.00 -0.52 0.00 0.00 57.07 56.77 3h0b s TYR 51 Cb 0.00 0.43 -0.05 0.00 0.38 0.00 0.00 41.96 42.72 3h0b s TYR 51 CO -0.05 -0.71 1.69 -0.47 -1.52 0.00 0.00 175.55 174.49 3h0b s TYR 52 N -2.67 1.91 -0.71 -3.49 5.04 0.12 -4.92 117.35 112.61 3h0b s TYR 52 Ca -0.04 0.19 -0.08 0.00 -2.44 0.00 0.00 57.07 54.70 3h0b s TYR 52 Cb -0.01 -3.95 0.19 0.00 0.35 0.00 0.00 41.96 38.54 3h0b s TYR 52 CO -0.03 -3.89 0.58 -0.65 -1.34 0.00 0.00 175.55 170.22 3h0b s GLN 53 N 4.23 3.03 0.27 4.97 -0.21 -1.26 -4.31 119.66 126.37 3h0b s GLN 53 Ca 0.75 -2.50 -0.01 0.00 0.02 0.00 0.00 55.36 53.62 3h0b s GLN 53 Cb -0.33 -4.04 0.51 0.00 1.00 0.00 0.00 33.01 30.15 3h0b s GLN 53 CO 0.31 -1.23 1.80 0.00 -2.12 0.00 0.00 175.29 174.05 3h0b h ARG 54 N 7.36 0.79 0.00 2.91 3.08 -1.93 -0.48 114.38 126.12 3h0b h ARG 54 Ca 0.04 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3h0b h ARG 54 Cb 0.99 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.86 3h0b h ARG 54 CO 0.73 0.52 0.00 0.00 -1.07 0.00 0.00 179.97 180.15 3h0b n GLN 55 N -4.74 0.05 -0.09 0.04 0.00 -1.26 -0.93 117.38 110.45 3h0b n GLN 55 Ca 0.17 0.55 0.10 0.00 0.00 0.00 0.00 57.00 57.81 3h0b n GLN 55 Cb 0.37 -1.65 0.13 0.00 0.00 0.00 0.00 30.24 29.09 3h0b n GLN 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3h0b n LEU 56 N -1.75 2.88 -4.32 2.61 4.77 -0.19 -4.89 117.00 116.12 3h0b n LEU 56 Ca -0.00 -1.30 -0.37 0.00 -0.03 0.00 0.00 56.01 54.31 3h0b n LEU 56 Cb 0.01 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 40.86 3h0b n LEU 56 CO 0.03 0.58 -0.30 -0.55 -1.33 0.00 0.00 177.39 175.82 3h0b s SER 57 N -1.41 4.99 0.56 -1.43 0.15 -0.10 -4.26 113.70 112.19 3h0b s SER 57 Ca 0.27 -0.75 0.37 0.00 0.70 0.00 0.00 55.95 56.54 3h0b s SER 57 Cb 0.17 -1.84 1.86 0.00 -1.71 0.00 0.00 66.02 64.50 3h0b s SER 57 CO 0.25 -0.18 2.12 0.77 1.20 0.00 0.00 173.24 177.40 3h0b h SER 58 N 8.19 0.00 -0.48 5.45 4.64 -1.45 -2.58 113.55 127.32 3h0b h SER 58 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 3h0b h SER 58 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3h0b h SER 58 CO 0.60 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.91 3h0b n THR 59 N -2.92 0.66 -2.44 2.95 -2.24 -1.26 -4.97 114.28 104.06 3h0b n THR 59 Ca -0.01 -0.83 -0.37 0.00 -2.27 0.00 0.00 64.05 60.57 3h0b n THR 59 Cb 0.15 0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 3h0b n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3h0b s TYR 60 N -1.31 3.15 -0.02 4.78 5.04 -0.97 -4.44 117.35 123.57 3h0b s TYR 60 Ca 0.41 1.61 0.00 0.00 -2.44 0.00 0.00 57.07 56.64 3h0b s TYR 60 Cb 0.23 -3.23 0.03 0.00 0.35 0.00 0.00 41.96 39.34 3h0b s TYR 60 CO 0.31 -0.94 0.02 1.03 -1.34 0.00 0.00 175.55 174.63 3h0b s ARG 61 N -2.49 0.10 -0.22 4.97 0.52 -0.76 -5.01 118.95 116.07 3h0b s ARG 61 Ca 0.59 0.13 -0.23 0.00 -0.52 0.00 0.00 55.73 55.70 3h0b s ARG 61 Cb -0.25 -0.33 -0.02 0.00 0.52 0.00 0.00 34.95 34.88 3h0b s ARG 61 CO 0.31 -0.14 0.73 0.34 0.02 0.00 0.00 175.30 176.56 3h0b s ASP 62 N 0.98 6.76 0.00 0.23 -1.08 -1.26 -1.26 116.67 121.04 3h0b s ASP 62 Ca -0.09 0.94 0.26 0.00 -0.52 0.00 0.00 52.55 53.13 3h0b s ASP 62 Cb -0.12 -2.39 1.52 0.00 -1.46 0.00 0.00 42.92 40.47 3h0b s ASP 62 CO -0.02 -0.39 1.98 0.18 0.52 0.00 0.00 175.17 177.43 3h0b n LEU 63 N 5.53 0.02 -4.18 -1.34 4.77 -0.66 -4.90 117.00 116.22 3h0b n LEU 63 Ca 0.02 -0.01 -0.33 0.00 -0.03 0.00 0.00 56.01 55.66 3h0b n LEU 63 Cb 0.49 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 3h0b n LEU 63 CO 0.46 0.00 -0.15 0.54 -1.33 0.00 0.00 177.39 176.91 3h0b n ARG 64 N -0.89 -2.76 -3.81 3.23 1.74 -1.26 -4.95 116.66 107.96 3h0b n ARG 64 Ca 0.19 0.33 -0.12 0.00 -0.77 0.00 0.00 57.85 57.48 3h0b n ARG 64 Cb 0.09 -4.74 -0.11 0.00 -1.02 0.00 0.00 32.46 26.69 3h0b n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3h0b s LYS 65 N -6.90 0.41 0.29 5.56 2.20 -1.26 -5.05 119.74 114.99 3h0b s LYS 65 Ca 0.46 -0.01 0.06 0.00 -0.36 0.00 0.00 55.97 56.12 3h0b s LYS 65 Cb -0.25 0.18 -0.02 0.00 -1.51 0.00 0.00 37.83 36.23 3h0b s LYS 65 CO 0.93 -0.09 0.35 0.20 -0.36 0.00 0.00 175.35 176.39 3h0b s GLY 66 N -0.64 1.48 -0.02 5.54 0.00 -1.26 -0.20 107.32 112.22 3h0b s GLY 66 Ca -0.07 -1.42 -0.01 0.00 0.00 0.00 0.00 44.72 43.22 3h0b s GLY 66 CO 0.01 -1.39 0.04 0.54 0.00 0.00 0.00 173.10 172.30 3h0b s VAL 67 N -2.13 -0.04 -0.20 1.40 0.11 -0.21 -4.85 120.40 114.48 3h0b s VAL 67 Ca 0.38 0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.59 3h0b s VAL 67 Cb -0.08 -0.09 0.03 0.00 -1.53 0.00 0.00 36.38 34.71 3h0b s VAL 67 CO 0.28 0.06 -0.16 -0.47 -3.33 0.00 0.00 175.10 171.48 3h0b s TYR 68 N 0.73 2.79 -0.27 1.54 5.04 -1.26 -1.35 117.35 124.57 3h0b s TYR 68 Ca -0.06 -1.76 0.03 0.00 -2.44 0.00 0.00 57.07 52.84 3h0b s TYR 68 Cb -0.09 -1.86 0.07 0.00 0.35 0.00 0.00 41.96 40.43 3h0b s TYR 68 CO -0.02 -0.81 -0.09 0.08 -1.34 0.00 0.00 175.55 173.37 3h0b s VAL 69 N 1.28 2.20 -0.05 3.14 1.01 0.27 -5.01 120.40 123.25 3h0b s VAL 69 Ca 0.01 -1.73 -0.30 0.00 0.00 0.00 0.00 61.98 59.96 3h0b s VAL 69 Cb -0.15 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 3h0b s VAL 69 CO -0.10 -0.11 1.25 -2.84 0.00 0.00 0.00 175.10 173.30 3h0b s PRO 70 N 1.08 4.33 -0.25 2.72 0.02 -1.26 -0.48 135.00 141.15 3h0b s PRO 70 Ca -0.06 1.75 0.03 0.00 0.02 0.00 0.00 61.00 62.73 3h0b s PRO 70 Cb -0.20 -3.57 0.06 0.00 0.02 0.00 0.00 34.50 30.81 3h0b s PRO 70 CO -0.05 -0.49 -0.12 -0.47 -0.33 0.00 0.00 177.00 175.54 3h0b s TYR 71 N 2.32 3.23 0.00 6.54 5.04 0.80 -4.91 117.35 130.36 3h0b s TYR 71 Ca 0.58 -2.27 0.00 0.00 -2.44 0.00 0.00 57.07 52.94 3h0b s TYR 71 Cb -0.26 -1.93 0.00 0.00 0.35 0.00 0.00 41.96 40.12 3h0b s TYR 71 CO 0.23 -0.87 0.00 0.25 -1.34 0.00 0.00 175.55 173.81 3h0b n THR 72 N 4.45 0.00 -3.27 4.34 -2.24 -1.26 -1.73 114.28 114.57 3h0b n THR 72 Ca -0.15 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.20 3h0b n THR 72 Cb 0.43 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.65 3h0b n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h0b n GLN 73 N 11.98 3.74 -2.80 -0.78 10.64 -1.26 -4.90 117.38 134.01 3h0b n GLN 73 Ca 0.00 -4.49 0.00 0.00 -1.83 0.00 0.00 57.00 50.68 3h0b n GLN 73 Cb 0.00 -2.52 0.00 0.00 -0.86 0.00 0.00 30.24 26.86 3h0b n GLN 73 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3h0b n GLY 74 N 2.21 -0.94 3.84 2.61 0.00 -0.70 -4.69 105.19 107.50 3h0b n GLY 74 Ca 0.25 -1.45 -0.01 0.00 0.00 0.00 0.00 46.02 44.80 3h0b n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h0b s LYS 75 N -1.92 0.95 0.02 1.61 -2.85 0.11 -0.14 119.74 117.50 3h0b s LYS 75 Ca 0.00 -0.59 -0.08 0.00 -1.00 0.00 0.00 55.97 54.31 3h0b s LYS 75 Cb 0.00 0.28 0.00 0.00 -2.06 0.00 0.00 37.83 36.05 3h0b s LYS 75 CO 0.00 -0.44 0.15 1.67 0.10 0.00 0.00 175.35 176.83 3h0b s TRP 76 N -2.38 0.06 0.07 1.78 1.48 0.36 -0.89 118.94 119.43 3h0b s TRP 76 Ca 0.20 -0.22 0.03 0.00 -1.06 0.00 0.00 56.10 55.06 3h0b s TRP 76 Cb -0.01 -0.05 -0.03 0.00 -1.16 0.00 0.00 33.47 32.22 3h0b s TRP 76 CO 0.02 -0.34 -0.10 -1.21 -4.06 0.00 0.00 176.95 171.26 3h0b s GLU 77 N -1.91 0.73 0.29 3.25 2.02 0.21 -0.56 118.70 122.72 3h0b s GLU 77 Ca -0.10 -0.99 -0.20 0.00 0.02 0.00 0.00 54.97 53.69 3h0b s GLU 77 Cb -0.05 -0.49 0.04 0.00 0.10 0.00 0.00 34.13 33.73 3h0b s GLU 77 CO -0.01 0.09 0.80 0.20 0.02 0.00 0.00 175.26 176.35 3h0b s GLY 78 N -2.04 0.04 -0.22 -1.39 0.00 -0.46 -0.71 107.32 102.54 3h0b s GLY 78 Ca -0.01 -0.38 -0.07 0.00 0.00 0.00 0.00 44.72 44.27 3h0b s GLY 78 CO 0.00 0.02 0.04 1.85 0.00 0.00 0.00 173.10 175.02 3h0b s GLU 79 N -3.24 3.70 0.34 2.90 2.56 -0.17 -1.05 118.70 123.74 3h0b s GLU 79 Ca 0.13 -0.47 -0.27 0.00 0.00 0.00 0.00 54.97 54.36 3h0b s GLU 79 Cb -0.05 -3.22 -0.09 0.00 2.00 0.00 0.00 34.13 32.77 3h0b s GLU 79 CO 0.08 -0.04 1.13 -0.51 -0.56 0.00 0.00 175.26 175.36 3h0b s LEU 80 N 1.18 4.36 0.26 2.70 1.43 0.73 -1.49 118.68 127.85 3h0b s LEU 80 Ca 0.04 2.28 -0.20 0.00 -1.03 0.00 0.00 54.13 55.22 3h0b s LEU 80 Cb -0.14 -3.84 0.07 0.00 0.03 0.00 0.00 46.19 42.30 3h0b s LEU 80 CO 0.03 -0.39 0.96 -0.83 0.23 0.00 0.00 176.35 176.34 3h0b s GLY 81 N -1.05 0.22 0.27 -3.19 0.00 -0.36 -1.66 107.32 101.55 3h0b s GLY 81 Ca 0.51 -0.50 0.06 0.00 0.00 0.00 0.00 44.72 44.79 3h0b s GLY 81 CO 0.39 1.58 -0.04 -0.51 0.00 0.00 0.00 173.10 174.51 3h0b s THR 82 N -2.17 1.50 -0.04 0.90 -4.23 -0.39 0.11 115.64 111.32 3h0b s THR 82 Ca 0.20 -2.10 -0.31 0.00 -1.18 0.00 0.00 61.69 58.30 3h0b s THR 82 Cb -0.04 -2.45 0.12 0.00 1.34 0.00 0.00 72.50 71.48 3h0b s THR 82 CO 0.08 -0.29 1.27 -0.62 -0.54 0.00 0.00 174.62 174.52 3h0b s ASP 83 N -3.42 -0.07 0.04 3.99 -1.08 -1.04 -1.82 116.67 113.27 3h0b s ASP 83 Ca 0.30 -0.12 -0.30 0.00 -0.52 0.00 0.00 52.55 51.91 3h0b s ASP 83 Cb 0.04 0.16 -0.04 0.00 -1.46 0.00 0.00 42.92 41.62 3h0b s ASP 83 CO 0.11 -0.29 1.09 -0.76 0.52 0.00 0.00 175.17 175.84 3h0b s LEU 84 N -2.84 4.38 0.04 -1.34 1.43 -1.26 -1.78 118.68 117.30 3h0b s LEU 84 Ca 0.13 1.85 0.07 0.00 -1.03 0.00 0.00 54.13 55.15 3h0b s LEU 84 Cb 0.04 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 3h0b s LEU 84 CO -0.04 -0.35 -0.19 -0.69 0.23 0.00 0.00 176.35 175.31 3h0b s VAL 85 N 0.96 1.54 0.13 -1.59 1.01 0.18 -0.85 120.40 121.79 3h0b s VAL 85 Ca 0.55 -1.15 -0.12 0.00 0.00 0.00 0.00 61.98 61.26 3h0b s VAL 85 Cb -0.25 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.79 3h0b s VAL 85 CO 0.29 0.17 0.32 -0.94 0.00 0.00 0.00 175.10 174.93 3h0b s SER 86 N -1.15 -0.06 -0.31 3.32 1.04 -0.29 -0.74 113.70 115.51 3h0b s SER 86 Ca 0.06 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 55.97 3h0b s SER 86 Cb -0.09 0.43 0.08 0.00 0.10 0.00 0.00 66.02 66.55 3h0b s SER 86 CO 0.02 -0.84 -0.01 -0.63 0.98 0.00 0.00 173.24 172.76 3h0b s ILE 87 N -3.86 2.32 0.24 -1.02 1.01 -1.26 -0.77 121.20 117.86 3h0b s ILE 87 Ca 0.07 -2.02 -0.08 0.00 0.00 0.00 0.00 60.65 58.62 3h0b s ILE 87 Cb 0.03 -2.56 0.24 0.00 0.01 0.00 0.00 42.46 40.18 3h0b s ILE 87 CO -0.08 -0.37 1.65 -0.65 0.00 0.00 0.00 174.94 175.49 3h0b h PRO 88 N 7.71 0.14 -1.43 2.79 0.11 -1.90 -0.51 132.00 138.91 3h0b h PRO 88 Ca -0.11 -0.01 -0.69 0.00 0.11 0.00 0.00 66.00 65.30 3h0b h PRO 88 Cb 1.03 -0.03 -0.31 0.00 0.11 0.00 0.00 31.00 31.80 3h0b h PRO 88 CO 0.51 0.09 0.58 0.72 -0.21 0.00 0.00 178.00 179.69 3h0b n HIS 89 N -5.29 3.10 -2.66 0.65 8.25 -1.26 -4.94 115.22 113.08 3h0b n HIS 89 Ca 0.12 -2.67 0.00 0.00 -0.26 0.00 0.00 57.72 54.91 3h0b n HIS 89 Cb 0.44 -1.07 0.00 0.00 1.12 0.00 0.00 29.99 30.47 3h0b n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h0b n GLY 90 N -0.70 5.55 3.69 -1.41 0.00 -0.20 -4.13 105.19 108.00 3h0b n GLY 90 Ca 0.55 -1.44 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 3h0b n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h0b n PRO 91 N 0.00 0.62 -1.42 1.61 -0.05 -1.26 -4.81 135.00 129.68 3h0b n PRO 91 Ca 0.00 0.28 -0.31 0.00 -0.05 0.00 0.00 63.50 63.42 3h0b n PRO 91 Cb 0.00 -2.44 -0.06 0.00 -0.05 0.00 0.00 33.50 30.95 3h0b n PRO 91 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 175.50 173.74 3h0b n ASN 92 N -2.43 7.39 -4.35 3.54 5.15 -1.26 -4.61 115.26 118.68 3h0b n ASN 92 Ca 0.14 -2.78 -0.22 0.00 -0.60 0.00 0.00 54.58 51.13 3h0b n ASN 92 Cb 0.49 -1.43 -0.11 0.00 -0.53 0.00 0.00 39.78 38.20 3h0b n ASN 92 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3h0b s VAL 93 N 0.41 1.87 -0.10 3.44 -7.23 -1.26 -5.13 120.40 112.40 3h0b s VAL 93 Ca 0.64 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.83 3h0b s VAL 93 Cb 0.25 -1.91 0.02 0.00 0.56 0.00 0.00 36.38 35.29 3h0b s VAL 93 CO -0.08 -0.35 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.34 3h0b s THR 94 N -2.18 1.34 0.07 5.32 2.01 -1.26 -4.30 115.64 116.64 3h0b s THR 94 Ca 0.18 -0.54 0.06 0.00 0.31 0.00 0.00 61.69 61.69 3h0b s THR 94 Cb -0.05 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 3h0b s THR 94 CO 0.07 0.41 -0.16 0.68 -0.69 0.00 0.00 174.62 174.93 3h0b s VAL 95 N 1.10 1.27 -0.29 3.82 -7.23 0.08 -4.90 120.40 114.25 3h0b s VAL 95 Ca -0.05 -1.29 -0.26 0.00 -1.81 0.00 0.00 61.98 58.57 3h0b s VAL 95 Cb -0.14 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.62 3h0b s VAL 95 CO -0.03 -0.12 0.90 -0.60 -0.31 0.00 0.00 175.10 174.94 3h0b s ARG 96 N -1.63 4.06 0.15 4.82 3.52 -1.26 0.52 118.95 129.14 3h0b s ARG 96 Ca 0.01 0.87 0.06 0.00 -0.13 0.00 0.00 55.73 56.54 3h0b s ARG 96 Cb -0.10 -3.71 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 3h0b s ARG 96 CO 0.02 -0.70 -0.12 0.00 -0.81 0.00 0.00 175.30 173.69 3h0b s ALA 97 N 3.15 1.59 0.26 6.12 0.00 -0.74 -4.91 121.76 127.24 3h0b s ALA 97 Ca 0.38 -1.48 -0.30 0.00 0.00 0.00 0.00 51.96 50.56 3h0b s ALA 97 Cb -0.14 -0.02 -0.10 0.00 0.00 0.00 0.00 23.12 22.87 3h0b s ALA 97 CO 0.12 -0.01 1.34 -0.80 0.00 0.00 0.00 175.76 176.41 3h0b s ASN 98 N -3.01 6.80 -0.05 0.00 0.01 -1.26 -2.49 114.94 114.94 3h0b s ASN 98 Ca 0.16 2.57 0.02 0.00 -0.71 0.00 0.00 52.86 54.90 3h0b s ASN 98 Cb -0.00 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.05 3h0b s ASN 98 CO 0.03 -0.57 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.35 3h0b s ILE 99 N -0.40 0.74 -0.58 0.60 1.01 0.30 -4.54 121.20 118.33 3h0b s ILE 99 Ca 0.54 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.74 3h0b s ILE 99 Cb -0.39 -0.72 0.08 0.00 0.01 0.00 0.00 42.46 41.44 3h0b s ILE 99 CO 0.45 0.27 0.75 0.00 0.00 0.00 0.00 174.94 176.41 3h0b s ALA 100 N 0.77 3.32 -0.57 9.38 0.00 0.56 -1.22 121.76 134.00 3h0b s ALA 100 Ca -0.12 -1.91 -0.27 0.00 0.00 0.00 0.00 51.96 49.66 3h0b s ALA 100 Cb -0.15 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.41 3h0b s ALA 100 CO 0.01 -2.33 1.68 0.00 0.00 0.00 0.00 175.76 175.12 3h0b s ALA 101 N 3.06 2.49 -0.23 0.00 0.00 -0.55 -1.56 121.76 124.97 3h0b s ALA 101 Ca 0.16 -0.60 -0.29 0.00 0.00 0.00 0.00 51.96 51.24 3h0b s ALA 101 Cb -0.20 -4.20 -0.01 0.00 0.00 0.00 0.00 23.12 18.70 3h0b s ALA 101 CO 0.10 -3.40 1.40 0.42 0.00 0.00 0.00 175.76 174.28 3h0b s ILE 102 N 7.65 4.02 -0.15 0.00 1.01 0.30 -1.00 121.20 133.03 3h0b s ILE 102 Ca 0.62 1.17 0.09 0.00 0.00 0.00 0.00 60.65 62.54 3h0b s ILE 102 Cb -0.13 -3.95 -0.13 0.00 0.01 0.00 0.00 42.46 38.26 3h0b s ILE 102 CO 0.23 -0.32 0.26 0.35 0.00 0.00 0.00 174.94 175.47 3h0b n THR 103 N 6.01 0.00 -3.71 2.92 -2.24 0.12 0.28 114.28 117.66 3h0b n THR 103 Ca 0.16 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.58 3h0b n THR 103 Cb 0.46 0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 69.11 3h0b n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h0b s GLU 104 N -2.38 0.46 -0.01 -0.78 0.41 -1.06 -4.76 118.70 110.59 3h0b s GLU 104 Ca -0.01 0.70 -0.14 0.00 -0.41 0.00 0.00 54.97 55.10 3h0b s GLU 104 Cb 0.06 0.13 0.02 0.00 -1.78 0.00 0.00 34.13 32.56 3h0b s GLU 104 CO 0.38 -0.10 0.30 -1.54 -0.49 0.00 0.00 175.26 173.81 3h0b s SER 105 N 0.76 -0.17 -0.14 -0.19 1.04 -1.26 0.64 113.70 114.38 3h0b s SER 105 Ca -0.04 0.04 -0.00 0.00 0.48 0.00 0.00 55.95 56.43 3h0b s SER 105 Cb -0.05 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.40 3h0b s SER 105 CO -0.06 -0.46 -0.09 -0.62 0.98 0.00 0.00 173.24 172.99 3h0b s ASP 106 N -1.40 2.51 -1.48 7.02 2.15 -0.07 -4.81 116.67 120.59 3h0b s ASP 106 Ca -0.13 -0.45 -0.09 0.00 0.43 0.00 0.00 52.55 52.31 3h0b s ASP 106 Cb -0.05 -0.98 0.06 0.00 -0.30 0.00 0.00 42.92 41.65 3h0b s ASP 106 CO 0.03 -0.11 0.80 0.29 -0.17 0.00 0.00 175.17 176.01 3h0b n LYS 107 N 4.87 -4.72 -0.00 4.34 5.02 -1.26 0.03 118.16 126.44 3h0b n LYS 107 Ca -0.14 0.54 -0.00 0.00 -2.02 0.00 0.00 58.31 56.69 3h0b n LYS 107 Cb 0.49 -5.21 -0.00 0.00 -0.02 0.00 0.00 35.03 30.30 3h0b n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h0b n PHE 108 N -4.50 0.00 -1.91 2.13 7.35 -1.26 -4.61 117.46 114.66 3h0b n PHE 108 Ca -0.10 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.18 3h0b n PHE 108 Cb 0.59 -0.02 -0.02 0.00 0.35 0.00 0.00 39.48 40.37 3h0b n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3h0b s PHE 109 N -1.13 2.89 0.20 -5.13 0.40 -1.26 -4.97 117.98 108.97 3h0b s PHE 109 Ca -0.01 0.95 -0.27 0.00 -0.60 0.00 0.00 56.93 57.00 3h0b s PHE 109 Cb 0.00 -3.92 -0.08 0.00 0.51 0.00 0.00 43.02 39.52 3h0b s PHE 109 CO 0.02 -3.02 0.84 0.42 0.70 0.00 0.00 175.22 174.18 3h0b s ILE 110 N -0.11 4.25 0.02 0.64 1.01 -1.26 -4.98 121.20 120.77 3h0b s ILE 110 Ca 0.60 1.86 -0.30 0.00 0.00 0.00 0.00 60.65 62.81 3h0b s ILE 110 Cb -0.44 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 37.73 3h0b s ILE 110 CO 0.46 0.51 1.99 0.21 0.00 0.00 0.00 174.94 178.11 3h0b s ASN 111 N -1.17 6.38 -0.87 3.58 3.84 -1.26 -2.82 114.94 122.61 3h0b s ASN 111 Ca 0.38 2.63 -0.03 0.00 0.21 0.00 0.00 52.86 56.05 3h0b s ASN 111 Cb -0.24 -2.53 -0.03 0.00 -0.55 0.00 0.00 41.25 37.90 3h0b s ASN 111 CO 0.28 -1.12 0.78 0.61 -2.79 0.00 0.00 177.10 174.87 3h0b n GLY 112 N 4.63 -1.21 3.31 1.21 0.00 -1.26 -5.04 105.19 106.83 3h0b n GLY 112 Ca 0.21 0.52 -0.30 0.00 0.00 0.00 0.00 46.02 46.44 3h0b n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h0b s SER 113 N -3.16 3.02 0.00 1.61 0.15 -1.13 -5.03 113.70 109.16 3h0b s SER 113 Ca 0.19 -0.49 0.16 0.00 0.70 0.00 0.00 55.95 56.50 3h0b s SER 113 Cb -0.03 -0.32 0.69 0.00 -1.71 0.00 0.00 66.02 64.65 3h0b s SER 113 CO 0.76 0.30 1.50 0.59 1.20 0.00 0.00 173.24 177.58 3h0b n ASN 114 N 2.28 0.00 -4.68 5.45 4.13 -1.26 -4.76 115.26 116.42 3h0b n ASN 114 Ca -0.16 0.44 -0.32 0.00 1.68 0.00 0.00 54.58 56.22 3h0b n ASN 114 Cb 0.51 -0.47 -0.09 0.00 -1.54 0.00 0.00 39.78 38.20 3h0b n ASN 114 CO 0.00 0.00 0.00 -1.66 0.28 0.00 0.00 177.26 175.88 3h0b s TRP 115 N -2.94 3.07 -0.77 3.10 1.48 -1.26 -4.55 118.94 117.07 3h0b s TRP 115 Ca 0.09 0.07 0.10 0.00 -1.06 0.00 0.00 56.10 55.30 3h0b s TRP 115 Cb 0.10 -1.66 -0.05 0.00 -1.16 0.00 0.00 33.47 30.71 3h0b s TRP 115 CO 0.28 0.46 0.56 0.39 -4.06 0.00 0.00 176.95 174.58 3h0b n GLU 116 N 1.31 2.72 -3.79 3.25 4.71 0.11 -4.97 120.64 123.97 3h0b n GLU 116 Ca -0.14 -0.37 -0.12 0.00 -0.01 0.00 0.00 57.16 56.52 3h0b n GLU 116 Cb 0.53 -1.05 -0.00 0.00 -1.01 0.00 0.00 31.44 29.91 3h0b n GLU 116 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3h0b n GLY 117 N 1.04 1.62 3.04 0.62 0.00 -1.14 -0.95 105.19 109.42 3h0b n GLY 117 Ca 0.03 -1.44 -0.20 0.00 0.00 0.00 0.00 46.02 44.41 3h0b n GLY 117 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h0b s ILE 118 N -2.50 0.84 -0.54 -0.61 1.01 0.21 -0.75 121.20 118.86 3h0b s ILE 118 Ca 0.22 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 3h0b s ILE 118 Cb -0.03 -0.72 0.14 0.00 0.01 0.00 0.00 42.46 41.87 3h0b s ILE 118 CO 0.16 0.25 0.37 -0.22 0.00 0.00 0.00 174.94 175.49 3h0b s LEU 119 N -0.09 5.41 -0.32 2.97 2.96 0.13 -1.68 118.68 128.07 3h0b s LEU 119 Ca 0.01 -2.42 -0.29 0.00 -0.22 0.00 0.00 54.13 51.21 3h0b s LEU 119 Cb -0.06 -1.89 -0.00 0.00 0.50 0.00 0.00 46.19 44.74 3h0b s LEU 119 CO -0.00 -0.49 1.38 -0.83 -1.32 0.00 0.00 176.35 175.09 3h0b s GLY 120 N 1.47 1.28 0.00 7.98 0.00 0.78 -1.57 107.32 117.26 3h0b s GLY 120 Ca 0.12 0.10 0.22 0.00 0.00 0.00 0.00 44.72 45.16 3h0b s GLY 120 CO -0.04 2.71 1.16 1.04 0.00 0.00 0.00 173.10 177.97 3h0b n LEU 121 N 8.09 2.63 0.00 0.66 4.77 0.33 -4.19 117.00 129.30 3h0b n LEU 121 Ca 0.16 -0.95 -0.10 0.00 -0.03 0.00 0.00 56.01 55.10 3h0b n LEU 121 Cb 0.47 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.64 3h0b n LEU 121 CO 0.65 0.45 0.20 0.00 -1.33 0.00 0.00 177.39 177.37 3h0b n ALA 122 N 0.95 -1.04 -2.11 -1.18 0.00 0.52 -4.95 120.51 112.70 3h0b n ALA 122 Ca 0.12 -0.53 -0.25 0.00 0.00 0.00 0.00 53.44 52.78 3h0b n ALA 122 Cb 0.52 -0.04 0.03 0.00 0.00 0.00 0.00 19.45 19.97 3h0b n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3h0b s TYR 123 N -1.67 3.20 0.42 0.00 1.51 0.10 -4.66 117.35 116.25 3h0b s TYR 123 Ca 0.23 0.51 0.12 0.00 -1.01 0.00 0.00 57.07 56.92 3h0b s TYR 123 Cb -0.02 -2.68 0.97 0.00 -0.11 0.00 0.00 41.96 40.12 3h0b s TYR 123 CO 0.17 -0.77 1.97 0.00 -1.11 0.00 0.00 175.55 175.81 3h0b h ALA 124 N -0.07 1.95 -0.83 3.71 0.00 -1.85 -2.73 119.26 119.44 3h0b h ALA 124 Ca -0.45 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 54.69 3h0b h ALA 124 Cb 1.26 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3h0b h ALA 124 CO 0.59 -0.09 0.60 1.49 0.00 0.00 0.00 179.25 181.84 3h0b h GLU 125 N 0.48 0.00 -0.43 0.00 4.81 -1.86 0.36 114.58 117.95 3h0b h GLU 125 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 3h0b h GLU 125 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3h0b h GLU 125 CO -0.09 0.00 0.00 0.44 -0.73 0.00 0.00 179.01 178.63 3h0b n ILE 126 N -4.27 2.15 -2.73 2.32 -5.35 -1.03 -4.65 119.36 105.80 3h0b n ILE 126 Ca 0.17 -1.51 -0.39 0.00 -0.27 0.00 0.00 62.75 60.75 3h0b n ILE 126 Cb 0.90 -0.08 -0.06 0.00 -1.74 0.00 0.00 39.64 38.66 3h0b n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0b s ALA 127 N -2.38 3.29 -0.08 -1.28 0.00 0.13 -4.44 121.76 116.99 3h0b s ALA 127 Ca 0.45 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.95 3h0b s ALA 127 Cb 0.33 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 3h0b s ALA 127 CO 0.15 0.15 0.18 1.03 0.00 0.00 0.00 175.76 177.26 3h0b s ARG 128 N -1.56 3.49 0.18 0.00 1.81 -1.26 -2.43 118.95 119.18 3h0b s ARG 128 Ca 0.45 -0.11 0.25 0.00 -1.72 0.00 0.00 55.73 54.60 3h0b s ARG 128 Cb -0.24 -3.17 0.60 0.00 -0.45 0.00 0.00 34.95 31.69 3h0b s ARG 128 CO 0.30 0.75 1.58 -1.00 -0.68 0.00 0.00 175.30 176.25 3h0b h PRO 129 N 4.71 0.00 -3.09 3.54 0.13 -1.96 -3.47 132.00 131.86 3h0b h PRO 129 Ca -0.53 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.61 3h0b h PRO 129 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 3h0b h PRO 129 CO 0.61 0.00 0.21 0.16 -0.23 0.00 0.00 178.00 178.74 3h0b s ASP 130 N -4.49 -0.09 0.00 1.44 3.84 -1.02 -5.03 116.67 111.32 3h0b s ASP 130 Ca 0.09 -0.89 0.02 0.00 -0.00 0.00 0.00 52.55 51.76 3h0b s ASP 130 Cb 0.12 0.77 0.10 0.00 -1.38 0.00 0.00 42.92 42.53 3h0b s ASP 130 CO 0.65 -1.47 0.56 -0.90 -0.00 0.00 0.00 175.17 174.01 3h0b n ASP 131 N -0.89 0.00 -0.84 2.11 5.68 -1.26 -2.04 116.55 119.32 3h0b n ASP 131 Ca -0.05 -0.89 0.12 0.00 -0.50 0.00 0.00 54.79 53.47 3h0b n ASP 131 Cb 0.60 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.69 3h0b n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3h0b n SER 132 N -0.55 2.71 -4.46 -1.12 3.41 -1.26 -4.67 113.62 107.67 3h0b n SER 132 Ca 0.01 -1.87 -0.43 0.00 -0.26 0.00 0.00 58.87 56.32 3h0b n SER 132 Cb 0.01 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.00 3h0b n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3h0b s LEU 133 N -2.09 4.41 0.11 1.04 2.96 -0.86 -5.01 118.68 119.24 3h0b s LEU 133 Ca 0.27 -0.90 -0.31 0.00 -0.22 0.00 0.00 54.13 52.97 3h0b s LEU 133 Cb 0.20 -2.48 -0.10 0.00 0.50 0.00 0.00 46.19 44.30 3h0b s LEU 133 CO 0.35 -1.36 1.84 -0.70 -1.32 0.00 0.00 176.35 175.16 3h0b s GLU 134 N 3.91 4.14 0.70 1.98 2.12 -1.26 -4.88 118.70 125.40 3h0b s GLU 134 Ca 0.23 2.58 -0.16 0.00 0.36 0.00 0.00 54.97 57.98 3h0b s GLU 134 Cb -0.17 -3.66 0.02 0.00 0.26 0.00 0.00 34.13 30.59 3h0b s GLU 134 CO 0.12 -0.85 1.21 -2.14 -0.54 0.00 0.00 175.26 173.06 3h0b s PRO 135 N 2.93 2.33 0.15 4.30 0.02 -1.26 -4.55 135.00 138.92 3h0b s PRO 135 Ca 0.81 1.80 -0.17 0.00 0.02 0.00 0.00 61.00 63.46 3h0b s PRO 135 Cb -0.45 -1.85 0.06 0.00 0.02 0.00 0.00 34.50 32.28 3h0b s PRO 135 CO 0.37 -1.70 1.70 0.35 -0.33 0.00 0.00 177.00 177.40 3h0b h PHE 136 N -0.01 -0.03 -0.10 6.54 3.57 -1.81 -2.06 116.94 123.05 3h0b h PHE 136 Ca -0.48 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 3h0b h PHE 136 Cb 1.30 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.10 3h0b h PHE 136 CO 0.46 -0.07 0.04 0.35 -2.23 0.00 0.00 178.31 176.87 3h0b h PHE 137 N 0.09 0.13 -0.41 0.41 3.57 -1.92 -0.28 116.94 118.53 3h0b h PHE 137 Ca 0.16 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 3h0b h PHE 137 Cb 0.22 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3h0b h PHE 137 CO -0.24 0.11 0.06 -0.44 -2.23 0.00 0.00 178.31 175.57 3h0b h ASP 138 N 0.14 0.65 -0.47 0.41 3.32 -1.74 -1.61 116.42 117.11 3h0b h ASP 138 Ca 0.04 -0.26 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 3h0b h ASP 138 Cb 0.03 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3h0b h ASP 138 CO -0.00 0.75 0.03 0.28 -1.72 0.00 0.00 179.24 178.58 3h0b h SER 139 N 0.53 0.78 -0.30 6.45 0.02 -1.13 -1.99 113.55 117.91 3h0b h SER 139 Ca 0.12 -0.29 0.07 0.00 -0.84 0.00 0.00 61.79 60.85 3h0b h SER 139 Cb 0.38 -0.21 -0.07 0.00 0.14 0.00 0.00 62.40 62.64 3h0b h SER 139 CO 0.01 0.88 -0.13 0.25 -1.14 0.00 0.00 176.83 176.70 3h0b h LEU 140 N 0.66 -0.44 -0.16 5.07 5.85 -0.88 0.36 115.31 125.76 3h0b h LEU 140 Ca 0.14 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 3h0b h LEU 140 Cb 0.46 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3h0b h LEU 140 CO 0.02 -0.16 0.06 0.58 -0.34 0.00 0.00 178.44 178.59 3h0b h VAL 141 N -0.08 1.17 -0.77 1.05 2.07 -1.20 -2.10 116.25 116.39 3h0b h VAL 141 Ca 0.15 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3h0b h VAL 141 Cb 0.31 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 3h0b h VAL 141 CO -0.35 0.16 0.33 0.11 0.02 0.00 0.00 177.57 177.85 3h0b h LYS 142 N 0.10 1.14 0.00 1.57 1.57 -1.06 -3.03 116.57 116.85 3h0b h LYS 142 Ca 0.05 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3h0b h LYS 142 Cb 0.20 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3h0b h LYS 142 CO -0.00 0.91 -0.22 1.04 -0.57 0.00 0.00 179.45 180.61 3h0b n GLN 143 N -4.33 0.21 -2.21 3.15 6.02 0.09 -4.91 117.38 115.40 3h0b n GLN 143 Ca 0.07 0.13 -0.02 0.00 -0.01 0.00 0.00 57.00 57.16 3h0b n GLN 143 Cb 0.17 -1.70 -0.01 0.00 1.02 0.00 0.00 30.24 29.72 3h0b n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3h0b n THR 144 N -2.04 0.00 -0.26 5.09 -2.24 -0.80 -5.05 114.28 108.99 3h0b n THR 144 Ca 0.05 -0.21 0.09 0.00 -2.27 0.00 0.00 64.05 61.71 3h0b n THR 144 Cb 0.41 0.08 0.24 0.00 -2.10 0.00 0.00 70.33 68.95 3h0b n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3h0b n HIS 145 N -0.08 0.71 -1.69 4.78 8.25 -1.26 -4.81 115.22 121.12 3h0b n HIS 145 Ca -0.01 -0.49 -0.44 0.00 -0.26 0.00 0.00 57.72 56.53 3h0b n HIS 145 Cb 0.05 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.12 3h0b n HIS 145 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3h0b n VAL 146 N 1.09 0.34 -1.50 1.59 0.31 -1.26 -4.91 118.33 113.97 3h0b n VAL 146 Ca 0.18 -0.06 -0.37 0.00 -0.01 0.00 0.00 64.34 64.08 3h0b n VAL 146 Cb 0.52 -2.00 0.06 0.00 -0.91 0.00 0.00 33.84 31.52 3h0b n VAL 146 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3h0b n PRO 147 N 5.42 0.68 -2.03 5.55 -0.02 -1.26 -4.71 135.00 138.64 3h0b n PRO 147 Ca 0.18 0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 61.55 3h0b n PRO 147 Cb 0.35 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 3h0b n PRO 147 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3h0b n ASN 148 N -0.94 3.90 -3.65 2.55 5.15 -1.26 -4.33 115.26 116.68 3h0b n ASN 148 Ca 0.13 -2.82 -0.03 0.00 -0.60 0.00 0.00 54.58 51.26 3h0b n ASN 148 Cb 0.48 -1.62 -0.07 0.00 -0.53 0.00 0.00 39.78 38.04 3h0b n ASN 148 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3h0b s LEU 149 N 4.57 -0.17 0.03 1.20 0.20 -1.26 -1.05 118.68 122.21 3h0b s LEU 149 Ca 0.56 0.31 -0.01 0.00 0.69 0.00 0.00 54.13 55.67 3h0b s LEU 149 Cb 0.07 1.30 -0.03 0.00 -0.43 0.00 0.00 46.19 47.11 3h0b s LEU 149 CO 0.05 -0.05 -0.00 0.72 -0.29 0.00 0.00 176.35 176.78 3h0b s PHE 150 N 0.35 0.34 0.05 5.38 -0.71 -1.14 0.88 117.98 123.14 3h0b s PHE 150 Ca 0.03 -0.73 0.04 0.00 -1.04 0.00 0.00 56.93 55.23 3h0b s PHE 150 Cb -0.04 -0.26 -0.02 0.00 -1.21 0.00 0.00 43.02 41.49 3h0b s PHE 150 CO -0.13 -0.30 -0.12 -1.54 -1.34 0.00 0.00 175.22 171.80 3h0b s SER 151 N -2.14 1.41 -0.10 1.98 1.04 -0.57 0.35 113.70 115.67 3h0b s SER 151 Ca -0.05 -0.54 0.02 0.00 0.48 0.00 0.00 55.95 55.86 3h0b s SER 151 Cb -0.02 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 66.08 3h0b s SER 151 CO -0.05 -0.08 -0.16 -0.76 0.98 0.00 0.00 173.24 173.17 3h0b s LEU 152 N -1.49 1.77 -0.49 2.42 1.43 0.64 -1.22 118.68 121.74 3h0b s LEU 152 Ca -0.03 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 52.62 3h0b s LEU 152 Cb -0.09 -1.09 0.13 0.00 0.03 0.00 0.00 46.19 45.17 3h0b s LEU 152 CO 0.01 0.05 0.29 -1.58 0.23 0.00 0.00 176.35 175.35 3h0b s GLN 153 N 0.79 2.21 -0.43 1.70 0.74 0.01 -1.37 119.66 123.31 3h0b s GLN 153 Ca -0.11 -2.06 -0.21 0.00 0.05 0.00 0.00 55.36 53.03 3h0b s GLN 153 Cb -0.16 -3.65 0.02 0.00 1.10 0.00 0.00 33.01 30.32 3h0b s GLN 153 CO 0.02 -1.11 0.67 -0.51 -0.55 0.00 0.00 175.29 173.80 3h0b s LEU 154 N 0.74 4.41 0.13 3.68 1.43 -1.26 -0.91 118.68 126.89 3h0b s LEU 154 Ca 0.11 -0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3h0b s LEU 154 Cb -0.22 -2.78 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 3h0b s LEU 154 CO -0.04 -0.77 0.31 0.00 0.23 0.00 0.00 176.35 176.07 3h0b n GLY 156 N -0.14 6.23 0.00 0.00 0.00 -1.26 -3.65 105.19 106.38 3h0b n GLY 156 Ca -0.05 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.11 3h0b n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0b n ALA 157 N -3.00 0.00 0.00 4.61 0.00 -1.26 -4.86 120.51 116.00 3h0b n ALA 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h0b n ALA 157 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h0b n ALA 157 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h0b n SER 169 N 0.00 0.00 -4.82 0.00 3.41 -1.26 -4.91 113.62 106.04 3h0b n SER 169 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 3h0b n SER 169 Cb 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3h0b n SER 169 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3h0b s VAL 170 N 0.00 3.99 0.27 -3.33 -7.23 -0.82 -4.91 120.40 108.37 3h0b s VAL 170 Ca 0.00 0.65 -0.11 0.00 -1.81 0.00 0.00 61.98 60.71 3h0b s VAL 170 Cb 0.00 -3.40 -0.00 0.00 0.56 0.00 0.00 36.38 33.54 3h0b s VAL 170 CO 0.00 -0.84 0.48 -0.83 -0.31 0.00 0.00 175.10 173.60 3h0b s GLY 171 N -3.82 0.73 0.00 2.32 0.00 -1.24 -1.55 107.32 103.77 3h0b s GLY 171 Ca 0.58 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 44.28 3h0b s GLY 171 CO 0.55 -0.71 0.00 0.61 0.00 0.00 0.00 173.10 173.55 3h0b n GLY 172 N -0.42 0.70 2.96 0.20 0.00 -0.89 -1.39 105.19 106.36 3h0b n GLY 172 Ca -0.01 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.01 3h0b n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h0b s SER 173 N -0.63 0.93 -0.31 1.61 0.01 -0.09 -1.29 113.70 113.93 3h0b s SER 173 Ca 0.00 -0.14 -0.04 0.00 1.31 0.00 0.00 55.95 57.09 3h0b s SER 173 Cb 0.00 -0.24 0.04 0.00 0.21 0.00 0.00 66.02 66.04 3h0b s SER 173 CO 0.00 0.04 0.04 -0.32 0.41 0.00 0.00 173.24 173.41 3h0b s MET 174 N 0.21 2.53 -0.48 12.44 1.75 -1.26 -0.81 119.30 133.67 3h0b s MET 174 Ca -0.03 -1.21 -0.18 0.00 -1.25 0.00 0.00 55.69 53.02 3h0b s MET 174 Cb -0.07 -3.28 0.06 0.00 2.84 0.00 0.00 34.83 34.37 3h0b s MET 174 CO 0.00 -0.62 0.53 0.42 -0.65 0.00 0.00 175.02 174.69 3h0b s ILE 175 N 1.32 5.02 -0.30 10.11 -1.09 -0.36 -4.84 121.20 131.06 3h0b s ILE 175 Ca -0.04 -0.62 -0.23 0.00 -2.23 0.00 0.00 60.65 57.53 3h0b s ILE 175 Cb -0.19 -4.20 -0.00 0.00 -1.58 0.00 0.00 42.46 36.48 3h0b s ILE 175 CO 0.00 -0.67 0.77 -0.63 -1.23 0.00 0.00 174.94 173.19 3h0b s ILE 176 N 2.26 4.82 0.00 2.92 1.01 -1.26 -1.52 121.20 129.43 3h0b s ILE 176 Ca 0.11 1.20 0.00 0.00 0.00 0.00 0.00 60.65 61.96 3h0b s ILE 176 Cb -0.20 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.15 3h0b s ILE 176 CO 0.11 -0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.45 3h0b n GLY 177 N 4.16 0.65 3.84 6.18 0.00 0.25 -4.75 105.19 115.52 3h0b n GLY 177 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 3h0b n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h0b s GLY 178 N -1.32 0.21 -0.17 -0.02 0.00 -1.24 -4.27 107.32 100.51 3h0b s GLY 178 Ca 0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 44.72 44.20 3h0b s GLY 178 CO 0.00 0.84 -0.12 -0.42 0.00 0.00 0.00 173.10 173.40 3h0b s ILE 179 N -2.38 2.90 -0.36 0.90 1.01 -1.26 -4.29 121.20 117.73 3h0b s ILE 179 Ca 0.18 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 3h0b s ILE 179 Cb -0.04 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 3h0b s ILE 179 CO 0.08 0.50 0.31 -0.62 0.00 0.00 0.00 174.94 175.21 3h0b s ASP 180 N 0.91 6.12 0.51 3.58 3.68 -1.26 -4.97 116.67 125.25 3h0b s ASP 180 Ca -0.03 -0.44 0.18 0.00 2.13 0.00 0.00 52.55 54.39 3h0b s ASP 180 Cb -0.15 -2.17 1.27 0.00 -1.45 0.00 0.00 42.92 40.42 3h0b s ASP 180 CO -0.01 -0.33 2.09 0.45 0.13 0.00 0.00 175.17 177.50 3h0b h HIS 181 N 8.52 0.05 0.00 -5.34 3.86 -1.94 -1.68 115.15 118.62 3h0b h HIS 181 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 3h0b h HIS 181 Cb 1.14 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.60 3h0b h HIS 181 CO 0.65 0.03 0.00 -1.13 0.86 0.00 0.00 177.93 178.34 3h0b n SER 182 N -4.48 0.00 0.00 2.45 3.41 -1.26 -2.85 113.62 110.89 3h0b n SER 182 Ca 0.02 -0.28 0.11 0.00 -0.26 0.00 0.00 58.87 58.46 3h0b n SER 182 Cb 0.26 -0.17 0.14 0.00 -0.26 0.00 0.00 64.21 64.18 3h0b n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h0b n LEU 183 N -1.17 0.65 -4.12 1.04 4.77 -0.63 -4.78 117.00 112.76 3h0b n LEU 183 Ca 0.12 -0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.82 3h0b n LEU 183 Cb 0.12 -0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 40.97 3h0b n LEU 183 CO 0.14 0.16 0.00 -0.72 -1.33 0.00 0.00 177.39 175.65 3h0b s TYR 184 N -3.00 0.98 0.19 -1.77 1.13 -1.13 -0.99 117.35 112.76 3h0b s TYR 184 Ca 0.10 -1.20 0.04 0.00 -1.41 0.00 0.00 57.07 54.60 3h0b s TYR 184 Cb 0.17 -0.23 -0.05 0.00 -1.10 0.00 0.00 41.96 40.75 3h0b s TYR 184 CO 0.75 -0.91 -0.06 0.95 -2.51 0.00 0.00 175.55 173.77 3h0b s THR 185 N -3.71 1.15 0.00 -3.49 -4.23 -0.67 -4.72 115.64 99.97 3h0b s THR 185 Ca 0.32 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.77 3h0b s THR 185 Cb 0.02 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.76 3h0b s THR 185 CO 0.15 -0.54 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 3h0b n GLY 186 N -0.32 1.00 3.90 3.99 0.00 -1.26 -3.85 105.19 108.66 3h0b n GLY 186 Ca -0.08 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 3h0b n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h0b s SER 187 N -4.00 6.49 -0.18 1.61 0.01 -1.26 -4.97 113.70 111.39 3h0b s SER 187 Ca 0.00 0.66 -0.17 0.00 1.31 0.00 0.00 55.95 57.76 3h0b s SER 187 Cb 0.00 -2.12 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 3h0b s SER 187 CO 0.00 -0.05 0.43 -0.76 0.41 0.00 0.00 173.24 173.27 3h0b s LEU 188 N -3.03 4.18 -0.10 2.44 1.43 -1.26 -4.40 118.68 117.94 3h0b s LEU 188 Ca 0.43 0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 54.13 3h0b s LEU 188 Cb -0.11 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.50 3h0b s LEU 188 CO 0.26 -0.08 -0.08 0.26 0.23 0.00 0.00 176.35 176.95 3h0b s TRP 189 N 1.22 2.93 -0.11 0.29 0.52 -0.47 -4.88 118.94 118.43 3h0b s TRP 189 Ca 0.21 -0.20 -0.02 0.00 0.02 0.00 0.00 56.10 56.12 3h0b s TRP 189 Cb -0.15 -1.80 -0.03 0.00 -1.15 0.00 0.00 33.47 30.34 3h0b s TRP 189 CO 0.08 0.12 -0.04 0.71 0.02 0.00 0.00 176.95 177.84 3h0b s TYR 190 N -0.26 3.02 -0.04 -1.98 1.51 -1.26 -0.57 117.35 117.78 3h0b s TYR 190 Ca 0.03 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.03 3h0b s TYR 190 Cb -0.13 -1.84 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 3h0b s TYR 190 CO 0.03 0.20 -0.07 -0.08 -1.11 0.00 0.00 175.55 174.51 3h0b s THR 191 N -0.31 3.63 0.46 -0.71 -1.32 -0.23 -3.43 115.64 113.74 3h0b s THR 191 Ca 0.05 -0.61 -0.23 0.00 -1.21 0.00 0.00 61.69 59.68 3h0b s THR 191 Cb -0.12 -2.52 -0.07 0.00 -1.51 0.00 0.00 72.50 68.27 3h0b s THR 191 CO 0.02 0.52 1.21 -2.84 -2.21 0.00 0.00 174.62 171.32 3h0b s PRO 192 N -1.04 3.73 -0.47 7.08 0.02 -1.26 -0.38 135.00 142.68 3h0b s PRO 192 Ca 0.14 1.89 -0.29 0.00 0.02 0.00 0.00 61.00 62.76 3h0b s PRO 192 Cb -0.11 -2.46 0.03 0.00 0.02 0.00 0.00 34.50 31.98 3h0b s PRO 192 CO 0.04 -0.61 1.19 0.42 -0.33 0.00 0.00 177.00 177.71 3h0b s ILE 193 N -1.46 4.14 0.13 2.83 1.01 -0.44 -4.64 121.20 122.77 3h0b s ILE 193 Ca 0.63 1.16 -0.21 0.00 0.00 0.00 0.00 60.65 62.23 3h0b s ILE 193 Cb -0.32 -4.54 -0.03 0.00 0.01 0.00 0.00 42.46 37.59 3h0b s ILE 193 CO 0.39 -0.98 1.68 -0.09 0.00 0.00 0.00 174.94 175.94 3h0b h ARG 194 N 9.52 -0.11 -3.36 2.79 2.43 -1.51 -3.44 114.38 120.70 3h0b h ARG 194 Ca -0.24 0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 58.77 3h0b h ARG 194 Cb 1.07 0.02 -0.24 0.00 -0.42 0.00 0.00 29.97 30.40 3h0b h ARG 194 CO 1.12 -0.07 -0.49 0.50 -1.51 0.00 0.00 179.97 179.52 3h0b s ARG 195 N -6.17 0.32 -1.22 0.20 3.52 -1.26 -5.09 118.95 109.25 3h0b s ARG 195 Ca -0.14 0.01 -0.14 0.00 -0.13 0.00 0.00 55.73 55.33 3h0b s ARG 195 Cb 0.10 0.14 0.17 0.00 -1.56 0.00 0.00 34.95 33.80 3h0b s ARG 195 CO 0.68 -0.06 1.49 0.39 -0.81 0.00 0.00 175.30 176.99 3h0b n GLU 196 N 2.38 3.38 0.00 5.12 1.02 -1.26 -4.08 120.64 127.20 3h0b n GLU 196 Ca -0.16 -3.79 0.00 0.00 -0.02 0.00 0.00 57.16 53.18 3h0b n GLU 196 Cb 0.57 -3.06 0.00 0.00 -0.02 0.00 0.00 31.44 28.94 3h0b n GLU 196 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 3h0b n TRP 197 N 5.64 0.00 -1.71 -0.32 4.27 -1.26 -4.57 117.44 119.49 3h0b n TRP 197 Ca 0.38 0.00 -0.30 0.00 -3.89 0.00 0.00 57.50 53.69 3h0b n TRP 197 Cb 0.42 0.00 0.17 0.00 -1.36 0.00 0.00 31.31 30.54 3h0b n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3h0b s TYR 198 N -0.00 1.78 -1.32 -2.67 2.02 -1.26 -0.72 117.35 115.19 3h0b s TYR 198 Ca 0.00 0.51 -0.13 0.00 -0.37 0.00 0.00 57.07 57.08 3h0b s TYR 198 Cb 0.00 -3.78 0.12 0.00 -0.40 0.00 0.00 41.96 37.90 3h0b s TYR 198 CO 0.00 -2.67 1.87 0.66 -1.57 0.00 0.00 175.55 173.84 3h0b n TYR 199 N -3.86 3.74 -2.70 2.71 4.02 -1.26 -4.79 117.16 115.01 3h0b n TYR 199 Ca 0.12 -2.96 -0.40 0.00 -0.01 0.00 0.00 57.90 54.65 3h0b n TYR 199 Cb 0.60 -2.25 -0.05 0.00 -0.02 0.00 0.00 39.34 37.61 3h0b n TYR 199 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 3h0b s GLU 200 N 1.90 4.80 0.40 -0.72 2.12 -1.26 -2.22 118.70 123.72 3h0b s GLU 200 Ca 0.44 1.53 0.05 0.00 0.36 0.00 0.00 54.97 57.36 3h0b s GLU 200 Cb 0.08 -3.28 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 3h0b s GLU 200 CO -0.01 0.42 0.19 0.14 -0.54 0.00 0.00 175.26 175.46 3h0b s VAL 201 N -0.98 0.35 -0.19 3.70 -7.23 0.20 -1.26 120.40 115.00 3h0b s VAL 201 Ca 0.43 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 3h0b s VAL 201 Cb -0.27 -2.35 0.04 0.00 0.56 0.00 0.00 36.38 34.36 3h0b s VAL 201 CO 0.33 0.00 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.40 3h0b s ILE 202 N -3.26 1.48 -0.21 -0.62 1.01 -1.26 -4.01 121.20 114.33 3h0b s ILE 202 Ca 0.28 -0.88 -0.23 0.00 0.00 0.00 0.00 60.65 59.81 3h0b s ILE 202 Cb 0.02 -1.58 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 3h0b s ILE 202 CO 0.19 0.17 0.74 -0.63 0.00 0.00 0.00 174.94 175.41 3h0b s ILE 203 N 1.47 4.92 -2.18 2.92 1.01 -1.26 -1.56 121.20 126.53 3h0b s ILE 203 Ca -0.00 1.41 0.18 0.00 0.00 0.00 0.00 60.65 62.24 3h0b s ILE 203 Cb -0.16 -4.04 0.18 0.00 0.01 0.00 0.00 42.46 38.45 3h0b s ILE 203 CO -0.08 0.02 1.11 1.33 0.00 0.00 0.00 174.94 177.32 3h0b n VAL 204 N 4.93 0.11 0.00 2.92 0.24 0.60 -4.71 118.33 122.41 3h0b n VAL 204 Ca 0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 3h0b n VAL 204 Cb 0.49 1.28 0.00 0.00 -1.47 0.00 0.00 33.84 34.14 3h0b n VAL 204 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3h0b n ARG 205 N 1.03 0.00 -4.89 7.34 0.63 -1.23 -4.87 116.66 114.67 3h0b n ARG 205 Ca 0.11 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.78 3h0b n ARG 205 Cb 0.46 0.00 -0.16 0.00 0.45 0.00 0.00 32.46 33.21 3h0b n ARG 205 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3h0b s VAL 206 N -1.05 1.48 0.02 5.15 1.01 -1.26 -0.01 120.40 125.74 3h0b s VAL 206 Ca 0.00 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.26 3h0b s VAL 206 Cb 0.00 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 3h0b s VAL 206 CO 0.00 0.42 -0.15 -1.61 0.00 0.00 0.00 175.10 173.76 3h0b s GLU 207 N -0.20 1.10 -0.27 2.72 2.02 -0.19 -0.86 118.70 123.02 3h0b s GLU 207 Ca 0.01 -0.67 -0.02 0.00 0.02 0.00 0.00 54.97 54.31 3h0b s GLU 207 Cb -0.10 -1.10 0.03 0.00 0.10 0.00 0.00 34.13 33.07 3h0b s GLU 207 CO 0.01 0.29 -0.03 0.42 0.02 0.00 0.00 175.26 175.97 3h0b s ILE 208 N -0.61 3.05 -1.50 -1.63 -1.09 -0.54 -1.21 121.20 117.66 3h0b s ILE 208 Ca 0.04 -1.08 -0.06 0.00 -2.23 0.00 0.00 60.65 57.32 3h0b s ILE 208 Cb -0.07 -2.61 0.05 0.00 -1.58 0.00 0.00 42.46 38.25 3h0b s ILE 208 CO 0.00 0.10 0.54 0.59 -1.23 0.00 0.00 174.94 174.94 3h0b n ASN 209 N 4.68 -1.33 0.00 3.58 4.13 -0.34 -1.17 115.26 124.81 3h0b n ASN 209 Ca -0.15 -1.01 0.00 0.00 1.68 0.00 0.00 54.58 55.10 3h0b n ASN 209 Cb 0.46 -2.96 0.00 0.00 -1.54 0.00 0.00 39.78 35.74 3h0b n ASN 209 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h0b n GLY 210 N -1.83 2.66 3.58 7.41 0.00 -1.26 -4.99 105.19 110.76 3h0b n GLY 210 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3h0b n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3h0b s GLN 211 N -0.13 3.76 0.22 1.61 0.74 -0.31 -5.00 119.66 120.55 3h0b s GLN 211 Ca 0.00 0.17 -0.32 0.00 0.05 0.00 0.00 55.36 55.26 3h0b s GLN 211 Cb 0.00 -3.78 -0.13 0.00 1.10 0.00 0.00 33.01 30.20 3h0b s GLN 211 CO 0.00 -0.70 1.55 -3.47 -0.55 0.00 0.00 175.29 172.12 3h0b n ASP 212 N 6.03 3.29 0.27 6.67 2.03 -1.26 -1.47 116.55 132.11 3h0b n ASP 212 Ca -0.01 1.11 0.16 0.00 0.52 0.00 0.00 54.79 56.58 3h0b n ASP 212 Cb 0.49 -1.49 0.71 0.00 -0.72 0.00 0.00 41.12 40.11 3h0b n ASP 212 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3h0b h LEU 213 N 5.22 0.00 -3.07 -2.67 5.85 -1.37 -3.47 115.31 115.79 3h0b h LEU 213 Ca -0.45 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 57.92 3h0b h LEU 213 Cb 1.25 0.00 0.07 0.00 0.37 0.00 0.00 40.66 42.35 3h0b h LEU 213 CO 0.83 0.05 -0.79 1.17 -0.34 0.00 0.00 178.44 179.36 3h0b n LYS 214 N -3.19 -1.37 -4.30 1.25 4.81 -1.26 -5.02 118.16 109.07 3h0b n LYS 214 Ca -0.00 0.71 -0.18 0.00 -0.87 0.00 0.00 58.31 57.98 3h0b n LYS 214 Cb 0.30 -4.32 -0.10 0.00 0.02 0.00 0.00 35.03 30.92 3h0b n LYS 214 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3h0b s MET 215 N -5.18 1.21 -0.24 1.64 -1.94 -1.26 -5.07 119.30 108.46 3h0b s MET 215 Ca 0.33 -1.49 -0.36 0.00 -1.71 0.00 0.00 55.69 52.46 3h0b s MET 215 Cb -0.11 -0.98 -0.13 0.00 2.01 0.00 0.00 34.83 35.63 3h0b s MET 215 CO 0.84 0.16 1.95 -3.47 -0.01 0.00 0.00 175.02 174.49 3h0b n ASP 216 N -0.15 2.67 0.11 3.03 -0.08 -1.26 -4.75 116.55 116.12 3h0b n ASP 216 Ca -0.10 0.80 0.07 0.00 -1.51 0.00 0.00 54.79 54.05 3h0b n ASP 216 Cb 0.60 -1.26 0.36 0.00 2.34 0.00 0.00 41.12 43.15 3h0b n ASP 216 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3h0b h LYS 218 N 0.00 0.00 -0.18 0.00 1.57 -1.78 -2.79 116.57 113.38 3h0b h LYS 218 Ca 0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 3h0b h LYS 218 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3h0b h LYS 218 CO 0.00 0.17 -0.38 0.93 -0.57 0.00 0.00 179.45 179.61 3h0b h GLU 219 N 0.00 0.40 0.00 3.15 4.39 -0.00 -2.71 114.58 119.81 3h0b h GLU 219 Ca -0.00 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 3h0b h GLU 219 Cb 0.45 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 3h0b h GLU 219 CO 0.02 0.72 -0.19 1.88 -1.16 0.00 0.00 179.01 180.28 3h0b h TYR 220 N 0.34 0.00 -0.30 4.33 0.99 -1.62 -3.10 116.97 117.61 3h0b h TYR 220 Ca 0.03 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.56 3h0b h TYR 220 Cb 0.82 0.00 -0.15 0.00 1.00 0.00 0.00 36.73 38.40 3h0b h TYR 220 CO 0.02 0.19 -0.49 0.09 -0.00 0.00 0.00 178.16 177.97 3h0b n ASN 221 N -3.87 2.90 -4.28 3.88 3.02 -1.04 -4.33 115.26 111.53 3h0b n ASN 221 Ca -0.02 -3.84 -0.37 0.00 -0.03 0.00 0.00 54.58 50.32 3h0b n ASN 221 Cb 0.29 -0.50 -0.13 0.00 -0.61 0.00 0.00 39.78 38.82 3h0b n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3h0b s TYR 222 N -3.36 3.17 -2.34 3.10 5.04 -1.09 -0.44 117.35 121.42 3h0b s TYR 222 Ca 0.43 -1.29 0.21 0.00 -2.44 0.00 0.00 57.07 53.99 3h0b s TYR 222 Cb 0.39 -2.20 0.62 0.00 0.35 0.00 0.00 41.96 41.12 3h0b s TYR 222 CO -0.03 -0.67 1.49 -0.40 -1.34 0.00 0.00 175.55 174.60 3h0b n ASP 223 N 4.79 2.25 -3.62 4.32 3.85 -1.26 -3.76 116.55 123.12 3h0b n ASP 223 Ca -0.14 -1.81 -0.03 0.00 -0.71 0.00 0.00 54.79 52.09 3h0b n ASP 223 Cb 0.47 -0.15 -0.01 0.00 -1.35 0.00 0.00 41.12 40.07 3h0b n ASP 223 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 3h0b s LYS 224 N -1.69 0.62 -0.10 0.11 -2.85 0.41 -4.76 119.74 111.48 3h0b s LYS 224 Ca 0.34 -0.30 -0.00 0.00 -1.00 0.00 0.00 55.97 55.00 3h0b s LYS 224 Cb 0.19 0.24 0.02 0.00 -2.06 0.00 0.00 37.83 36.22 3h0b s LYS 224 CO 0.28 -0.28 -0.06 -1.12 0.10 0.00 0.00 175.35 174.26 3h0b s SER 225 N -2.66 2.00 0.21 0.03 0.01 -1.26 -0.19 113.70 111.84 3h0b s SER 225 Ca 0.11 -0.25 0.09 0.00 1.31 0.00 0.00 55.95 57.20 3h0b s SER 225 Cb 0.01 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.44 3h0b s SER 225 CO -0.04 -0.12 -0.16 0.27 0.41 0.00 0.00 173.24 173.60 3h0b s ILE 226 N 1.66 1.88 -0.33 1.44 -4.36 -0.51 0.59 121.20 121.57 3h0b s ILE 226 Ca 0.03 -2.22 -0.09 0.00 -0.26 0.00 0.00 60.65 58.11 3h0b s ILE 226 Cb -0.13 -2.07 0.01 0.00 1.25 0.00 0.00 42.46 41.52 3h0b s ILE 226 CO -0.07 -0.53 0.15 -0.69 0.24 0.00 0.00 174.94 174.04 3h0b s VAL 227 N -2.79 4.39 -0.28 8.37 1.01 -0.94 -0.20 120.40 129.95 3h0b s VAL 227 Ca 0.23 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 3h0b s VAL 227 Cb -0.02 -3.33 0.09 0.00 0.00 0.00 0.00 36.38 33.12 3h0b s VAL 227 CO 0.08 -0.05 0.08 -0.62 0.00 0.00 0.00 175.10 174.59 3h0b s ASP 228 N 1.55 3.81 0.07 3.32 2.15 -0.80 -4.54 116.67 122.22 3h0b s ASP 228 Ca 0.03 -1.45 0.13 0.00 0.43 0.00 0.00 52.55 51.69 3h0b s ASP 228 Cb -0.18 -0.83 0.59 0.00 -0.30 0.00 0.00 42.92 42.20 3h0b s ASP 228 CO 0.05 -0.38 1.42 -1.54 -0.17 0.00 0.00 175.17 174.55 3h0b n SER 229 N 4.88 0.16 -0.67 -0.34 3.41 -1.26 -2.07 113.62 117.73 3h0b n SER 229 Ca -0.04 0.55 0.08 0.00 -0.26 0.00 0.00 58.87 59.20 3h0b n SER 229 Cb 0.43 -0.58 0.25 0.00 -0.26 0.00 0.00 64.21 64.05 3h0b n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h0b n GLY 230 N -0.43 0.65 3.13 5.00 0.00 -1.26 -4.64 105.19 107.64 3h0b n GLY 230 Ca 0.02 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.35 3h0b n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h0b s THR 231 N -1.60 1.41 -0.06 2.61 2.01 -0.88 -4.98 115.64 114.15 3h0b s THR 231 Ca 0.29 -0.70 -0.16 0.00 0.31 0.00 0.00 61.69 61.42 3h0b s THR 231 Cb 0.15 -1.21 -0.12 0.00 0.01 0.00 0.00 72.50 71.34 3h0b s THR 231 CO 0.21 0.41 0.65 0.74 -0.69 0.00 0.00 174.62 175.94 3h0b h THR 232 N 5.26 0.52 -4.48 -0.82 2.02 -1.87 0.20 112.91 113.75 3h0b h THR 232 Ca -0.33 -1.03 -0.48 0.00 0.77 0.00 0.00 66.41 65.34 3h0b h THR 232 Cb 1.17 0.90 0.09 0.00 -1.74 0.00 0.00 68.15 68.58 3h0b h THR 232 CO 0.48 0.14 0.39 0.20 0.37 0.00 0.00 175.52 177.10 3h0b s ASN 233 N -5.38 4.82 -0.34 4.18 0.01 -1.26 -0.74 114.94 116.23 3h0b s ASN 233 Ca -0.10 1.02 -0.25 0.00 -0.71 0.00 0.00 52.86 52.83 3h0b s ASN 233 Cb 0.00 -1.69 0.01 0.00 0.41 0.00 0.00 41.25 39.98 3h0b s ASN 233 CO 0.34 -1.73 0.86 -0.22 -1.51 0.00 0.00 177.10 174.84 3h0b s LEU 234 N -5.55 4.05 -0.14 0.60 2.96 -0.93 -2.74 118.68 116.92 3h0b s LEU 234 Ca 0.60 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 55.09 3h0b s LEU 234 Cb -0.12 -3.17 -0.02 0.00 0.50 0.00 0.00 46.19 43.39 3h0b s LEU 234 CO 0.51 -0.75 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.56 3h0b s ARG 235 N 3.23 3.46 0.08 1.98 0.52 -0.67 -1.42 118.95 126.12 3h0b s ARG 235 Ca 0.35 -0.64 0.08 0.00 -0.52 0.00 0.00 55.73 55.00 3h0b s ARG 235 Cb -0.13 -2.73 -0.03 0.00 0.52 0.00 0.00 34.95 32.58 3h0b s ARG 235 CO 0.16 0.20 -0.21 -0.51 0.02 0.00 0.00 175.30 174.96 3h0b s LEU 236 N 0.42 2.24 0.80 2.53 1.43 -0.43 0.06 118.68 125.72 3h0b s LEU 236 Ca -0.08 -0.61 -0.16 0.00 -1.03 0.00 0.00 54.13 52.25 3h0b s LEU 236 Cb -0.15 -0.91 -0.07 0.00 0.03 0.00 0.00 46.19 45.09 3h0b s LEU 236 CO 0.04 0.10 0.07 -2.65 0.23 0.00 0.00 176.35 174.14 3h0b n PRO 237 N 1.43 0.07 0.09 1.29 -0.02 -1.26 -0.07 135.00 136.53 3h0b n PRO 237 Ca -0.18 0.05 -0.13 0.00 -2.02 0.00 0.00 63.50 61.21 3h0b n PRO 237 Cb 0.53 -1.49 -0.06 0.00 -0.02 0.00 0.00 33.50 32.46 3h0b n PRO 237 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3h0b h LYS 238 N -0.68 -0.53 -0.78 -0.52 3.64 -1.91 0.75 116.57 116.53 3h0b h LYS 238 Ca -0.44 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.05 3h0b h LYS 238 Cb 1.34 0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 33.22 3h0b h LYS 238 CO 0.36 -0.36 0.45 0.87 -2.27 0.00 0.00 179.45 178.51 3h0b h LYS 239 N -0.55 0.78 -0.08 1.90 1.57 -1.93 0.82 116.57 119.08 3h0b h LYS 239 Ca 0.04 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3h0b h LYS 239 Cb 0.61 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 3h0b h LYS 239 CO -0.25 0.52 -0.06 0.28 -0.57 0.00 0.00 179.45 179.37 3h0b h VAL 240 N 0.81 1.35 -0.65 0.50 2.07 -1.70 -2.21 116.25 116.41 3h0b h VAL 240 Ca 0.35 -1.16 0.06 0.00 0.82 0.00 0.00 66.70 66.77 3h0b h VAL 240 Cb 0.24 1.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 3h0b h VAL 240 CO -0.20 0.32 0.36 0.15 0.02 0.00 0.00 177.57 178.22 3h0b h PHE 241 N -0.22 0.65 -0.44 1.57 3.57 0.81 0.22 116.94 123.10 3h0b h PHE 241 Ca 0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3h0b h PHE 241 Cb 0.55 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 3h0b h PHE 241 CO 0.08 0.31 0.29 0.93 -2.23 0.00 0.00 178.31 177.69 3h0b h GLU 242 N 0.66 0.58 -0.18 1.11 5.08 -0.80 -0.53 114.58 120.50 3h0b h GLU 242 Ca 0.29 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.59 3h0b h GLU 242 Cb 0.18 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3h0b h GLU 242 CO -0.18 0.38 0.02 0.00 -1.00 0.00 0.00 179.01 178.23 3h0b h ALA 243 N 1.16 0.25 -0.94 3.43 0.00 -0.82 -2.10 119.26 120.24 3h0b h ALA 243 Ca 0.16 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.94 3h0b h ALA 243 Cb -0.07 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 3h0b h ALA 243 CO -0.03 -0.07 0.60 0.00 0.00 0.00 0.00 179.25 179.75 3h0b h ALA 244 N 0.80 1.28 -0.21 0.00 0.00 -0.33 -0.54 119.26 120.27 3h0b h ALA 244 Ca 0.05 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 3h0b h ALA 244 Cb 0.35 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3h0b h ALA 244 CO 0.01 0.41 -0.61 0.28 0.00 0.00 0.00 179.25 179.34 3h0b h VAL 245 N 1.12 1.29 -0.43 0.00 2.07 -1.04 0.19 116.25 119.45 3h0b h VAL 245 Ca 0.40 -1.82 0.04 0.00 0.82 0.00 0.00 66.70 66.14 3h0b h VAL 245 Cb 0.11 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 3h0b h VAL 245 CO -0.15 0.58 0.20 0.50 0.02 0.00 0.00 177.57 178.71 3h0b h LYS 246 N 0.51 0.39 -0.31 1.57 3.64 -0.93 0.19 116.57 121.63 3h0b h LYS 246 Ca -0.02 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.25 3h0b h LYS 246 Cb 1.23 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 3h0b h LYS 246 CO 0.13 0.26 -0.14 1.03 -2.27 0.00 0.00 179.45 178.46 3h0b h SER 247 N 0.40 0.67 -0.40 4.20 0.87 -0.97 -1.05 113.55 117.27 3h0b h SER 247 Ca 0.19 -0.40 -0.05 0.00 -1.23 0.00 0.00 61.79 60.30 3h0b h SER 247 Cb 0.13 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 3h0b h SER 247 CO -0.15 0.92 0.08 0.40 -0.53 0.00 0.00 176.83 177.54 3h0b h ILE 248 N 0.41 1.22 0.61 2.23 2.04 -0.39 -0.08 117.51 123.55 3h0b h ILE 248 Ca 0.07 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 3h0b h ILE 248 Cb 0.66 0.78 0.01 0.00 -0.74 0.00 0.00 36.82 37.53 3h0b h ILE 248 CO 0.04 0.30 -0.29 0.11 0.00 0.00 0.00 178.15 178.31 3h0b h LYS 249 N 0.70 -0.79 -0.33 2.37 1.57 -0.36 -2.58 116.57 117.14 3h0b h LYS 249 Ca 0.15 0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.06 3h0b h LYS 249 Cb 0.32 0.18 -0.08 0.00 0.08 0.00 0.00 32.23 32.73 3h0b h LYS 249 CO 0.00 -0.50 -0.22 0.00 -0.57 0.00 0.00 179.45 178.16 3h0b h ALA 250 N -0.51 -0.01 -0.22 3.86 0.00 -0.97 -1.36 119.26 120.04 3h0b h ALA 250 Ca -0.08 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.00 3h0b h ALA 250 Cb 0.65 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h0b h ALA 250 CO 0.14 -0.61 0.29 0.00 0.00 0.00 0.00 179.25 179.06 3h0b h ALA 251 N 0.98 1.80 -0.07 0.00 0.00 -0.90 -2.00 119.26 119.07 3h0b h ALA 251 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3h0b h ALA 251 Cb 0.44 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3h0b h ALA 251 CO -0.44 -0.40 -0.16 -1.13 0.00 0.00 0.00 179.25 177.12 3h0b n SER 252 N -3.61 2.37 0.09 0.00 3.41 -0.56 -4.70 113.62 110.62 3h0b n SER 252 Ca 0.03 -3.40 0.07 0.00 -0.26 0.00 0.00 58.87 55.31 3h0b n SER 252 Cb 0.41 -0.50 0.35 0.00 -0.26 0.00 0.00 64.21 64.22 3h0b n SER 252 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3h0b n SER 253 N -1.19 0.33 0.31 4.04 3.41 -0.75 -2.32 113.62 117.45 3h0b n SER 253 Ca 0.20 0.63 0.17 0.00 -0.26 0.00 0.00 58.87 59.61 3h0b n SER 253 Cb 0.73 -0.68 1.00 0.00 -0.26 0.00 0.00 64.21 65.00 3h0b n SER 253 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3h0b h THR 254 N 0.00 0.37 -4.20 6.66 1.35 -1.87 -3.39 112.91 111.83 3h0b h THR 254 Ca 0.00 -0.03 -0.50 0.00 -0.55 0.00 0.00 66.41 65.33 3h0b h THR 254 Cb 0.10 1.02 -0.28 0.00 -1.73 0.00 0.00 68.15 67.26 3h0b h THR 254 CO 0.00 0.01 -0.82 -1.61 -0.25 0.00 0.00 175.52 172.85 3h0b s GLU 255 N -4.46 1.18 -0.07 4.72 2.02 -0.98 -5.15 118.70 115.97 3h0b s GLU 255 Ca -0.05 -0.61 -0.02 0.00 0.02 0.00 0.00 54.97 54.31 3h0b s GLU 255 Cb 0.14 -1.16 -0.04 0.00 0.10 0.00 0.00 34.13 33.18 3h0b s GLU 255 CO 0.51 0.31 0.05 0.15 0.02 0.00 0.00 175.26 176.30 3h0b s LYS 256 N -0.56 3.08 0.06 1.61 1.02 -1.26 -4.94 119.74 118.74 3h0b s LYS 256 Ca 0.05 -0.39 0.08 0.00 0.02 0.00 0.00 55.97 55.74 3h0b s LYS 256 Cb -0.06 -2.88 -0.03 0.00 -0.52 0.00 0.00 37.83 34.34 3h0b s LYS 256 CO -0.00 0.70 -0.23 -0.06 -0.92 0.00 0.00 175.35 174.84 3h0b s PHE 257 N -1.00 1.98 0.24 3.18 0.40 -1.26 -5.11 117.98 116.41 3h0b s PHE 257 Ca 0.16 -0.39 -0.31 0.00 -0.60 0.00 0.00 56.93 55.79 3h0b s PHE 257 Cb -0.12 -1.17 -0.12 0.00 0.51 0.00 0.00 43.02 42.12 3h0b s PHE 257 CO 0.06 0.13 1.63 -0.35 0.70 0.00 0.00 175.22 177.39 3h0b n PRO 258 N 1.70 2.60 0.33 0.24 -0.04 -1.26 -4.82 135.00 133.74 3h0b n PRO 258 Ca -0.17 0.93 0.08 0.00 -0.04 0.00 0.00 63.50 64.30 3h0b n PRO 258 Cb 0.53 -2.73 0.45 0.00 -0.04 0.00 0.00 33.50 31.71 3h0b n PRO 258 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3h0b h ASP 259 N 5.71 0.00 0.76 3.54 5.19 -2.00 1.02 116.42 130.63 3h0b h ASP 259 Ca -0.45 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.90 3h0b h ASP 259 Cb 1.22 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.72 3h0b h ASP 259 CO 0.87 0.00 -0.31 1.23 -3.12 0.00 0.00 179.24 177.91 3h0b h GLY 260 N 0.00 0.00 1.01 2.75 0.00 -1.95 -2.98 103.07 101.90 3h0b h GLY 260 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 3h0b h GLY 260 CO 0.00 0.00 -0.29 -2.75 0.00 0.00 0.00 176.54 173.50 3h0b h PHE 261 N 0.00 0.91 0.00 5.60 3.57 0.92 0.15 116.94 128.09 3h0b h PHE 261 Ca -0.00 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.23 3h0b h PHE 261 Cb 0.77 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.32 3h0b h PHE 261 CO 0.00 1.03 0.00 0.91 -2.23 0.00 0.00 178.31 178.02 3h0b n TRP 262 N -4.22 0.00 0.54 0.41 7.02 -1.13 -1.62 117.44 118.44 3h0b n TRP 262 Ca -0.03 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.54 3h0b n TRP 262 Cb 0.48 -0.32 0.11 0.00 -2.42 0.00 0.00 31.31 29.16 3h0b n TRP 262 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3h0b n LEU 263 N -1.32 2.66 0.00 -0.99 4.77 -1.10 -4.95 117.00 116.07 3h0b n LEU 263 Ca 0.08 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 3h0b n LEU 263 Cb 0.16 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3h0b n LEU 263 CO 0.15 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 3h0b n GLY 264 N 1.01 0.66 0.09 -0.72 0.00 -0.64 -4.91 105.19 100.69 3h0b n GLY 264 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 3h0b n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0b h GLU 265 N 1.73 0.04 -6.24 1.61 5.08 -1.04 -3.46 114.58 112.30 3h0b h GLU 265 Ca 0.00 -0.07 -0.49 0.00 -1.00 0.00 0.00 59.36 57.80 3h0b h GLU 265 Cb 0.05 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3h0b h GLU 265 CO 0.00 1.03 -0.37 -1.14 -1.00 0.00 0.00 179.01 177.54 3h0b s GLN 266 N -2.30 3.47 0.60 2.33 0.74 0.28 -4.93 119.66 119.85 3h0b s GLN 266 Ca -0.22 -0.55 0.04 0.00 0.05 0.00 0.00 55.36 54.68 3h0b s GLN 266 Cb 0.00 -2.85 0.08 0.00 1.10 0.00 0.00 33.01 31.35 3h0b s GLN 266 CO 0.68 0.38 0.83 -0.51 -0.55 0.00 0.00 175.29 176.12 3h0b s LEU 267 N -3.77 3.16 -0.06 3.68 1.43 -1.26 -4.25 118.68 117.61 3h0b s LEU 267 Ca 0.36 -0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 52.96 3h0b s LEU 267 Cb -0.10 -2.09 0.04 0.00 0.03 0.00 0.00 46.19 44.06 3h0b s LEU 267 CO 0.30 -1.42 0.12 -0.69 0.23 0.00 0.00 176.35 174.89 3h0b s VAL 268 N -2.81 -0.06 0.09 -1.59 1.01 -0.64 -4.87 120.40 111.51 3h0b s VAL 268 Ca 0.62 0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.87 3h0b s VAL 268 Cb -0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3h0b s VAL 268 CO 0.40 0.08 -0.18 0.00 0.00 0.00 0.00 175.10 175.41 3h0b s TRP 270 N -1.20 0.40 0.07 0.00 0.51 -0.53 -4.96 118.94 113.23 3h0b s TRP 270 Ca 0.03 -0.82 -0.37 0.00 -2.12 0.00 0.00 56.10 52.82 3h0b s TRP 270 Cb -0.10 -0.29 -0.16 0.00 -0.81 0.00 0.00 33.47 32.10 3h0b s TRP 270 CO 0.03 -0.30 1.38 0.94 -0.51 0.00 0.00 176.95 178.50 3h0b n GLN 271 N 0.77 1.22 -1.51 4.98 7.27 -1.26 -0.29 117.38 128.56 3h0b n GLN 271 Ca -0.18 0.44 -0.59 0.00 0.07 0.00 0.00 57.00 56.74 3h0b n GLN 271 Cb 0.58 -2.10 -0.08 0.00 2.41 0.00 0.00 30.24 31.05 3h0b n GLN 271 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3h0b n ALA 272 N 2.78 -2.64 -0.91 1.69 0.00 -1.10 -0.48 120.51 119.84 3h0b n ALA 272 Ca 0.19 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.16 3h0b n ALA 272 Cb 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 17.93 3h0b n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0b n GLY 273 N 2.32 0.54 0.03 0.00 0.00 -1.26 -4.91 105.19 101.91 3h0b n GLY 273 Ca 0.23 -0.04 0.02 0.00 0.00 0.00 0.00 46.02 46.23 3h0b n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h0b n THR 274 N -2.91 1.06 -1.67 2.61 -2.24 0.36 -5.04 114.28 106.44 3h0b n THR 274 Ca 0.00 -1.14 -0.51 0.00 -2.27 0.00 0.00 64.05 60.13 3h0b n THR 274 Cb 0.00 0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 3h0b n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3h0b n THR 275 N -0.63 0.31 -1.10 4.28 -1.04 -1.26 -4.82 114.28 110.02 3h0b n THR 275 Ca 0.03 -0.06 -0.32 0.00 -2.04 0.00 0.00 64.05 61.66 3h0b n THR 275 Cb 0.36 -1.49 -0.03 0.00 -1.82 0.00 0.00 70.33 67.35 3h0b n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3h0b n PRO 276 N 5.06 3.10 -0.29 -2.82 -0.04 -1.26 -4.75 135.00 134.00 3h0b n PRO 276 Ca 0.22 -1.90 0.12 0.00 -0.04 0.00 0.00 63.50 61.89 3h0b n PRO 276 Cb 0.24 -2.65 0.28 0.00 -0.04 0.00 0.00 33.50 31.32 3h0b n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3h0b h TRP 277 N 5.36 0.45 0.00 0.54 4.06 -1.96 -2.24 115.95 122.16 3h0b h TRP 277 Ca 0.72 0.05 -0.02 0.00 2.06 0.00 0.00 58.89 61.70 3h0b h TRP 277 Cb 0.28 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.38 3h0b h TRP 277 CO 1.90 -0.13 -0.08 -2.95 -3.56 0.00 0.00 178.44 173.62 3h0b h ASN 278 N 0.29 0.00 1.14 -3.49 -1.07 -2.01 -0.88 115.58 109.57 3h0b h ASN 278 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.90 3h0b h ASN 278 Cb 1.02 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.27 3h0b h ASN 278 CO -0.58 0.08 0.00 0.16 0.07 0.00 0.00 177.43 177.16 3h0b h ILE 279 N 0.00 0.00 -3.19 6.14 3.07 -1.76 -3.43 117.51 118.33 3h0b h ILE 279 Ca -0.00 -0.43 -0.58 0.00 1.55 0.00 0.00 64.86 65.39 3h0b h ILE 279 Cb 0.23 1.32 -0.05 0.00 -0.27 0.00 0.00 36.82 38.05 3h0b h ILE 279 CO 0.01 0.00 -0.10 -0.36 -1.05 0.00 0.00 178.15 176.65 3h0b s PHE 280 N -3.29 3.73 0.63 0.16 0.08 -0.34 -3.80 117.98 115.15 3h0b s PHE 280 Ca 0.06 1.12 -0.11 0.00 0.12 0.00 0.00 56.93 58.13 3h0b s PHE 280 Cb 0.10 -2.46 -0.03 0.00 -0.57 0.00 0.00 43.02 40.06 3h0b s PHE 280 CO 0.51 0.52 1.03 -1.25 -0.10 0.00 0.00 175.22 175.93 3h0b s PRO 281 N -0.73 3.45 0.62 0.24 0.04 -1.26 -4.78 135.00 132.58 3h0b s PRO 281 Ca 0.27 0.66 -0.08 0.00 0.04 0.00 0.00 61.00 61.90 3h0b s PRO 281 Cb -0.18 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.28 3h0b s PRO 281 CO 0.16 -0.64 0.97 0.14 0.04 0.00 0.00 177.00 177.66 3h0b s VAL 282 N -3.19 3.78 -0.10 -0.36 -7.23 -1.26 -4.17 120.40 107.87 3h0b s VAL 282 Ca 0.55 0.24 0.01 0.00 -1.81 0.00 0.00 61.98 60.97 3h0b s VAL 282 Cb -0.11 -3.53 0.02 0.00 0.56 0.00 0.00 36.38 33.32 3h0b s VAL 282 CO 0.53 -0.60 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.99 3h0b s ILE 283 N -3.11 1.13 -0.15 -0.62 1.01 -0.10 -1.20 121.20 118.17 3h0b s ILE 283 Ca 0.55 -0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.79 3h0b s ILE 283 Cb -0.11 -1.10 -0.01 0.00 0.01 0.00 0.00 42.46 41.25 3h0b s ILE 283 CO 0.48 0.38 -0.11 -0.44 0.00 0.00 0.00 174.94 175.24 3h0b s SER 284 N 1.32 4.10 -0.18 3.58 0.01 -0.35 -0.84 113.70 121.34 3h0b s SER 284 Ca -0.02 -0.33 -0.04 0.00 1.31 0.00 0.00 55.95 56.88 3h0b s SER 284 Cb -0.14 -1.64 -0.02 0.00 0.21 0.00 0.00 66.02 64.43 3h0b s SER 284 CO -0.04 0.14 -0.04 -0.76 0.41 0.00 0.00 173.24 172.94 3h0b s LEU 285 N 0.53 3.09 -0.17 2.44 1.43 -0.42 -1.02 118.68 124.56 3h0b s LEU 285 Ca -0.08 -0.25 -0.20 0.00 -1.03 0.00 0.00 54.13 52.58 3h0b s LEU 285 Cb -0.15 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 3h0b s LEU 285 CO 0.04 0.08 0.56 -0.31 0.23 0.00 0.00 176.35 176.95 3h0b s TYR 286 N 0.86 3.41 -0.04 0.29 1.51 0.99 -0.90 117.35 123.48 3h0b s TYR 286 Ca -0.01 0.88 -0.01 0.00 -1.01 0.00 0.00 57.07 56.93 3h0b s TYR 286 Cb -0.15 -2.70 -0.04 0.00 -0.11 0.00 0.00 41.96 38.97 3h0b s TYR 286 CO 0.01 -0.06 0.04 -0.51 -1.11 0.00 0.00 175.55 173.92 3h0b s LEU 287 N 1.48 3.72 0.20 -1.29 1.43 0.27 -0.30 118.68 124.19 3h0b s LEU 287 Ca 0.27 0.12 -0.32 0.00 -1.03 0.00 0.00 54.13 53.17 3h0b s LEU 287 Cb -0.16 -2.04 -0.15 0.00 0.03 0.00 0.00 46.19 43.88 3h0b s LEU 287 CO 0.11 0.32 1.25 0.80 0.23 0.00 0.00 176.35 179.05 3h0b n MET 288 N 1.61 1.47 -1.20 1.70 0.00 -0.60 -1.80 117.12 118.29 3h0b n MET 288 Ca -0.16 0.52 -0.10 0.00 -0.00 0.00 0.00 57.70 57.96 3h0b n MET 288 Cb 0.53 -2.08 0.06 0.00 0.00 0.00 0.00 33.22 31.73 3h0b n MET 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3h0b n GLY 289 N 2.07 0.08 0.10 -5.12 0.00 0.50 -4.09 105.19 98.73 3h0b n GLY 289 Ca 0.14 -1.89 0.03 0.00 0.00 0.00 0.00 46.02 44.30 3h0b n GLY 289 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h0b n GLU 290 N -1.88 0.62 -3.94 1.61 -0.58 -1.22 -4.39 120.64 110.85 3h0b n GLU 290 Ca 0.07 0.20 -0.31 0.00 -0.42 0.00 0.00 57.16 56.69 3h0b n GLU 290 Cb 0.24 -1.81 -0.05 0.00 -0.57 0.00 0.00 31.44 29.25 3h0b n GLU 290 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3h0b s VAL 291 N -3.04 5.24 0.28 2.62 1.01 -1.26 -5.06 120.40 120.20 3h0b s VAL 291 Ca -0.02 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 3h0b s VAL 291 Cb 0.09 -3.54 -0.13 0.00 0.00 0.00 0.00 36.38 32.80 3h0b s VAL 291 CO 0.81 0.16 1.38 0.41 0.00 0.00 0.00 175.10 177.86 3h0b n THR 292 N 0.38 1.35 -1.39 3.92 -1.04 -1.26 -1.73 114.28 114.51 3h0b n THR 292 Ca -0.06 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.05 61.47 3h0b n THR 292 Cb 0.51 -1.57 -0.06 0.00 -1.82 0.00 0.00 70.33 67.40 3h0b n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3h0b n ASN 293 N 1.64 -4.71 -4.25 8.00 3.02 -1.26 -4.94 115.26 112.77 3h0b n ASN 293 Ca 0.09 0.35 -0.33 0.00 -0.03 0.00 0.00 54.58 54.66 3h0b n ASN 293 Cb 0.34 -3.96 -0.16 0.00 -0.61 0.00 0.00 39.78 35.39 3h0b n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3h0b s GLN 294 N -3.15 3.16 0.46 3.52 -0.44 -0.71 0.38 119.66 122.88 3h0b s GLN 294 Ca 0.00 -0.79 0.04 0.00 -2.50 0.00 0.00 55.36 52.11 3h0b s GLN 294 Cb 0.00 -2.52 -0.04 0.00 -1.64 0.00 0.00 33.01 28.81 3h0b s GLN 294 CO 0.00 0.06 0.02 -1.54 0.50 0.00 0.00 175.29 174.32 3h0b s SER 295 N 0.68 3.86 0.08 6.67 1.04 -0.35 -0.37 113.70 125.31 3h0b s SER 295 Ca -0.09 -1.54 -0.03 0.00 0.48 0.00 0.00 55.95 54.77 3h0b s SER 295 Cb -0.16 0.16 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 3h0b s SER 295 CO 0.02 -0.70 0.06 0.72 0.98 0.00 0.00 173.24 174.31 3h0b s PHE 296 N -2.86 0.49 0.11 5.02 -0.12 -0.75 -1.13 117.98 118.74 3h0b s PHE 296 Ca 0.19 -0.97 0.10 0.00 -0.05 0.00 0.00 56.93 56.20 3h0b s PHE 296 Cb 0.05 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.10 3h0b s PHE 296 CO 0.10 -0.46 -0.24 -0.98 -0.05 0.00 0.00 175.22 173.58 3h0b s ARG 297 N -3.93 1.28 -0.08 1.99 1.70 0.01 0.95 118.95 120.86 3h0b s ARG 297 Ca 0.10 -1.24 0.03 0.00 -0.47 0.00 0.00 55.73 54.16 3h0b s ARG 297 Cb 0.07 -1.65 -0.01 0.00 -0.57 0.00 0.00 34.95 32.78 3h0b s ARG 297 CO -0.07 0.39 -0.19 0.96 -1.08 0.00 0.00 175.30 175.30 3h0b s ILE 298 N -1.09 2.56 -0.12 4.99 -4.36 -0.08 -1.19 121.20 121.91 3h0b s ILE 298 Ca 0.10 -0.87 0.03 0.00 -0.26 0.00 0.00 60.65 59.65 3h0b s ILE 298 Cb -0.10 -2.00 0.01 0.00 1.25 0.00 0.00 42.46 41.62 3h0b s ILE 298 CO 0.05 0.56 -0.22 -0.89 0.24 0.00 0.00 174.94 174.68 3h0b s THR 299 N -0.07 2.01 0.21 8.37 2.01 0.76 -1.30 115.64 127.64 3h0b s THR 299 Ca -0.05 -0.97 0.09 0.00 0.31 0.00 0.00 61.69 61.08 3h0b s THR 299 Cb -0.14 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 3h0b s THR 299 CO 0.04 0.54 -0.04 0.27 -0.69 0.00 0.00 174.62 174.75 3h0b s ILE 300 N 0.67 3.40 0.38 1.82 -4.36 -0.02 -1.44 121.20 121.65 3h0b s ILE 300 Ca -0.11 -1.71 0.08 0.00 -0.26 0.00 0.00 60.65 58.65 3h0b s ILE 300 Cb -0.16 -2.74 -0.02 0.00 1.25 0.00 0.00 42.46 40.79 3h0b s ILE 300 CO 0.02 -0.21 0.37 -0.76 0.24 0.00 0.00 174.94 174.60 3h0b s LEU 301 N -3.18 3.55 0.55 0.37 1.43 -1.26 -0.92 118.68 119.21 3h0b s LEU 301 Ca 0.28 -0.57 0.29 0.00 -1.03 0.00 0.00 54.13 53.10 3h0b s LEU 301 Cb -0.08 -2.24 1.46 0.00 0.03 0.00 0.00 46.19 45.36 3h0b s LEU 301 CO 0.18 -0.53 1.93 1.55 0.23 0.00 0.00 176.35 179.71 3h0b h PRO 302 N 1.06 0.00 0.00 1.29 0.13 -1.87 0.38 132.00 133.00 3h0b h PRO 302 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3h0b h PRO 302 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3h0b h PRO 302 CO 0.56 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.29 3h0b h GLN 303 N 0.00 0.00 0.04 0.86 7.50 -1.87 0.34 115.11 121.99 3h0b h GLN 303 Ca 0.30 0.00 -0.37 0.00 0.50 0.00 0.00 58.65 59.08 3h0b h GLN 303 Cb 1.30 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 28.78 3h0b h GLN 303 CO -0.00 0.00 -2.10 1.04 -1.50 0.00 0.00 178.83 176.27 3h0b n GLN 304 N -2.53 0.66 0.00 1.46 3.00 0.13 -4.49 117.38 115.61 3h0b n GLN 304 Ca -0.01 0.29 0.13 0.00 -0.01 0.00 0.00 57.00 57.40 3h0b n GLN 304 Cb 0.08 -1.62 0.36 0.00 0.00 0.00 0.00 30.24 29.06 3h0b n GLN 304 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 3h0b n TYR 305 N -3.73 0.00 -3.46 1.08 0.18 -1.00 -4.53 117.16 105.69 3h0b n TYR 305 Ca -0.40 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 58.95 3h0b n TYR 305 Cb 0.93 -0.06 -0.06 0.00 -0.38 0.00 0.00 39.34 39.78 3h0b n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3h0b s LEU 306 N -2.28 6.07 -0.24 -3.48 1.43 0.12 0.20 118.68 120.50 3h0b s LEU 306 Ca 0.29 -2.34 -0.29 0.00 -1.03 0.00 0.00 54.13 50.75 3h0b s LEU 306 Cb 0.20 -2.09 -0.00 0.00 0.03 0.00 0.00 46.19 44.33 3h0b s LEU 306 CO 0.44 -0.62 1.22 -0.13 0.23 0.00 0.00 176.35 177.50 3h0b s ARG 307 N 0.72 4.11 0.39 1.70 0.52 -0.19 -4.79 118.95 121.41 3h0b s ARG 307 Ca 0.12 1.42 -0.27 0.00 -0.52 0.00 0.00 55.73 56.47 3h0b s ARG 307 Cb -0.20 -3.78 -0.11 0.00 0.52 0.00 0.00 34.95 31.38 3h0b s ARG 307 CO -0.03 -0.85 1.46 -0.35 0.02 0.00 0.00 175.30 175.55 3h0b n PRO 308 N 6.83 2.56 0.00 3.54 -0.04 -1.26 -0.79 135.00 145.84 3h0b n PRO 308 Ca 0.14 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.50 3h0b n PRO 308 Cb 0.46 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 3h0b n PRO 308 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3h0b n VAL 309 N 0.28 0.00 0.00 0.52 0.31 -0.49 -4.86 118.33 114.10 3h0b n VAL 309 Ca 0.02 0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 3h0b n VAL 309 Cb 0.39 -0.76 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3h0b n VAL 309 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3h0b n SER 315 N -1.49 0.00 -0.78 4.52 7.64 -1.26 -4.73 113.62 117.52 3h0b n SER 315 Ca 0.00 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.95 3h0b n SER 315 Cb 0.00 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.40 3h0b n SER 315 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h0b n GLN 316 N 0.37 2.93 -3.85 1.43 6.02 -1.26 -4.98 117.38 118.04 3h0b n GLN 316 Ca 0.00 -2.29 -0.22 0.00 -0.01 0.00 0.00 57.00 54.48 3h0b n GLN 316 Cb 0.00 -1.44 -0.04 0.00 1.02 0.00 0.00 30.24 29.78 3h0b n GLN 316 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h0b s ASP 317 N -1.18 5.04 -0.28 1.08 1.11 -1.26 -2.71 116.67 118.47 3h0b s ASP 317 Ca 0.30 -0.65 -0.09 0.00 0.18 0.00 0.00 52.55 52.28 3h0b s ASP 317 Cb 0.18 -0.80 -0.03 0.00 1.07 0.00 0.00 42.92 43.35 3h0b s ASP 317 CO 0.16 -0.42 0.14 -1.81 1.18 0.00 0.00 175.17 174.42 3h0b s ASP 318 N -3.98 5.57 0.03 0.27 -0.00 0.60 -4.71 116.67 114.44 3h0b s ASP 318 Ca 0.42 -0.23 0.07 0.00 -0.00 0.00 0.00 52.55 52.81 3h0b s ASP 318 Cb -0.04 -2.02 -0.03 0.00 -0.00 0.00 0.00 42.92 40.83 3h0b s ASP 318 CO 0.26 -0.09 -0.19 0.00 -0.00 0.00 0.00 175.17 175.15 3h0b s TYR 320 N -0.88 0.48 -0.03 0.00 1.51 -0.34 -1.39 117.35 116.70 3h0b s TYR 320 Ca 0.14 -0.80 0.04 0.00 -1.01 0.00 0.00 57.07 55.44 3h0b s TYR 320 Cb -0.10 -0.33 -0.03 0.00 -0.11 0.00 0.00 41.96 41.39 3h0b s TYR 320 CO 0.04 -0.26 -0.14 0.21 -1.11 0.00 0.00 175.55 174.29 3h0b s LYS 321 N -2.79 2.44 -0.16 -0.62 2.20 0.03 -1.62 119.74 119.21 3h0b s LYS 321 Ca -0.02 -0.74 -0.29 0.00 -0.36 0.00 0.00 55.97 54.55 3h0b s LYS 321 Cb -0.01 -2.36 -0.05 0.00 -1.51 0.00 0.00 37.83 33.91 3h0b s LYS 321 CO -0.05 0.61 1.86 0.12 -0.36 0.00 0.00 175.35 177.52 3h0b s PHE 322 N -0.79 1.66 -0.55 4.03 5.36 -1.26 -1.02 117.98 125.41 3h0b s PHE 322 Ca 0.13 0.31 0.15 0.00 -0.96 0.00 0.00 56.93 56.55 3h0b s PHE 322 Cb -0.11 -4.03 0.76 0.00 -0.34 0.00 0.00 43.02 39.30 3h0b s PHE 322 CO 0.02 -3.85 1.67 0.00 -1.46 0.00 0.00 175.22 171.60 3h0b n ALA 323 N 9.11 3.61 -2.96 11.12 0.00 0.13 -4.40 120.51 137.11 3h0b n ALA 323 Ca 0.22 -1.74 -0.35 0.00 0.00 0.00 0.00 53.44 51.57 3h0b n ALA 323 Cb 0.44 -1.09 -0.12 0.00 0.00 0.00 0.00 19.45 18.68 3h0b n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3h0b s ILE 324 N -2.43 4.36 0.28 0.00 1.01 -1.26 -2.20 121.20 120.96 3h0b s ILE 324 Ca 0.51 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 61.01 3h0b s ILE 324 Cb 0.37 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 3h0b s ILE 324 CO 0.18 0.41 0.14 -0.94 0.00 0.00 0.00 174.94 174.73 3h0b s SER 325 N 0.92 1.27 0.18 3.58 1.04 -0.51 -4.85 113.70 115.32 3h0b s SER 325 Ca 0.03 -1.49 -0.26 0.00 0.48 0.00 0.00 55.95 54.71 3h0b s SER 325 Cb -0.14 0.32 -0.08 0.00 0.10 0.00 0.00 66.02 66.22 3h0b s SER 325 CO 0.02 -0.83 0.80 -1.58 0.98 0.00 0.00 173.24 172.63 3h0b s GLN 326 N -3.92 4.61 0.11 4.02 0.74 -1.26 -1.31 119.66 122.64 3h0b s GLN 326 Ca 0.37 1.20 0.07 0.00 0.05 0.00 0.00 55.36 57.05 3h0b s GLN 326 Cb 0.06 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.88 3h0b s GLN 326 CO 0.16 0.56 -0.18 0.45 -0.55 0.00 0.00 175.29 175.73 3h0b s SER 327 N -1.16 2.32 0.00 6.67 0.15 0.90 -4.73 113.70 117.85 3h0b s SER 327 Ca 0.37 -0.72 0.02 0.00 0.70 0.00 0.00 55.95 56.32 3h0b s SER 327 Cb -0.23 -0.11 -0.01 0.00 -1.71 0.00 0.00 66.02 63.95 3h0b s SER 327 CO 0.27 -0.01 0.19 -1.54 1.20 0.00 0.00 173.24 173.35 3h0b n SER 328 N 0.92 0.33 -1.64 5.45 3.41 -1.26 -3.22 113.62 117.61 3h0b n SER 328 Ca -0.18 -0.67 -0.13 0.00 -0.26 0.00 0.00 58.87 57.63 3h0b n SER 328 Cb 0.55 0.79 0.19 0.00 -0.26 0.00 0.00 64.21 65.48 3h0b n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3h0b n THR 329 N -0.80 2.85 -0.65 6.66 -2.24 -1.26 -4.74 114.28 114.10 3h0b n THR 329 Ca 0.01 -2.40 0.00 0.00 -2.27 0.00 0.00 64.05 59.38 3h0b n THR 329 Cb 0.04 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 3h0b n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h0b n GLY 330 N -1.14 -2.88 3.72 3.38 0.00 -1.25 -4.62 105.19 102.42 3h0b n GLY 330 Ca 0.45 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 3h0b n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h0b s THR 331 N -0.63 4.19 -0.26 2.61 2.01 0.73 -4.31 115.64 119.98 3h0b s THR 331 Ca 0.00 1.70 0.03 0.00 0.31 0.00 0.00 61.69 63.73 3h0b s THR 331 Cb 0.00 -4.09 0.06 0.00 0.01 0.00 0.00 72.50 68.48 3h0b s THR 331 CO 0.00 0.21 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.34 3h0b s VAL 332 N 0.44 2.14 -1.17 3.82 1.01 0.11 -1.42 120.40 125.33 3h0b s VAL 332 Ca 0.53 -1.63 -0.19 0.00 0.00 0.00 0.00 61.98 60.68 3h0b s VAL 332 Cb -0.27 -2.27 0.08 0.00 0.00 0.00 0.00 36.38 33.92 3h0b s VAL 332 CO 0.31 -0.04 1.56 -0.04 0.00 0.00 0.00 175.10 176.89 3h0b s MET 333 N 1.11 3.84 0.00 2.72 -1.94 0.72 -1.68 119.30 124.08 3h0b s MET 333 Ca -0.09 -1.76 0.00 0.00 -1.71 0.00 0.00 55.69 52.14 3h0b s MET 333 Cb -0.20 -5.38 0.00 0.00 2.01 0.00 0.00 34.83 31.26 3h0b s MET 333 CO -0.05 -2.15 0.00 0.41 -0.01 0.00 0.00 175.02 173.22 3h0b n GLY 334 N 5.76 0.40 0.37 -0.03 0.00 -1.11 -1.91 105.19 108.66 3h0b n GLY 334 Ca 0.40 -1.74 0.15 0.00 0.00 0.00 0.00 46.02 44.84 3h0b n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0b h ALA 335 N -1.66 2.18 -0.93 4.61 0.00 0.13 0.11 119.26 123.70 3h0b h ALA 335 Ca 0.00 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.01 3h0b h ALA 335 Cb 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 3h0b h ALA 335 CO 0.00 -0.34 0.60 0.28 0.00 0.00 0.00 179.25 179.79 3h0b h VAL 336 N 0.30 0.94 0.00 0.00 2.07 -1.15 0.26 116.25 118.66 3h0b h VAL 336 Ca 0.30 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 3h0b h VAL 336 Cb 0.76 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3h0b h VAL 336 CO -0.07 0.16 -0.43 0.40 0.02 0.00 0.00 177.57 177.66 3h0b h ILE 337 N 0.90 1.25 -0.04 4.57 1.08 -1.19 -3.38 117.51 120.71 3h0b h ILE 337 Ca 0.44 -2.10 0.01 0.00 -0.39 0.00 0.00 64.86 62.83 3h0b h ILE 337 Cb 0.47 2.52 -0.00 0.00 -3.07 0.00 0.00 36.82 36.74 3h0b h ILE 337 CO -0.21 0.42 0.04 0.24 -0.69 0.00 0.00 178.15 177.95 3h0b h MET 338 N -1.00 0.00 0.00 2.37 2.86 -0.71 -1.79 114.93 116.66 3h0b h MET 338 Ca -0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3h0b h MET 338 Cb 0.98 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.64 3h0b h MET 338 CO -0.07 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.29 3h0b n GLU 339 N -4.16 0.39 0.00 1.72 1.02 0.06 -1.89 120.64 117.79 3h0b n GLU 339 Ca -0.02 0.07 0.11 0.00 -0.02 0.00 0.00 57.16 57.29 3h0b n GLU 339 Cb 0.13 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.03 3h0b n GLU 339 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h0b n GLY 340 N 0.50 -1.09 3.15 0.62 0.00 -0.67 -4.47 105.19 103.22 3h0b n GLY 340 Ca 0.12 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 3h0b n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0b s PHE 341 N -3.08 0.84 -0.35 1.61 0.40 -0.79 -1.59 117.98 115.01 3h0b s PHE 341 Ca 0.06 -0.87 -0.22 0.00 -0.60 0.00 0.00 56.93 55.31 3h0b s PHE 341 Cb 0.16 -0.49 0.00 0.00 0.51 0.00 0.00 43.02 43.20 3h0b s PHE 341 CO 0.82 -0.15 0.70 -0.47 0.70 0.00 0.00 175.22 176.82 3h0b s TYR 342 N -3.35 3.14 -0.30 0.36 5.04 0.18 -4.44 117.35 117.99 3h0b s TYR 342 Ca 0.09 0.46 -0.09 0.00 -2.44 0.00 0.00 57.07 55.09 3h0b s TYR 342 Cb 0.03 -3.22 -0.01 0.00 0.35 0.00 0.00 41.96 39.11 3h0b s TYR 342 CO -0.04 -0.65 0.13 0.08 -1.34 0.00 0.00 175.55 173.73 3h0b s VAL 343 N 2.85 4.44 -0.29 3.14 1.01 -0.47 -1.84 120.40 129.25 3h0b s VAL 343 Ca 0.27 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.69 3h0b s VAL 343 Cb -0.14 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 3h0b s VAL 343 CO 0.15 0.10 0.21 -0.69 0.00 0.00 0.00 175.10 174.87 3h0b s VAL 344 N 1.59 5.30 -1.15 2.92 1.01 -0.04 -0.26 120.40 129.77 3h0b s VAL 344 Ca 0.04 0.16 -0.11 0.00 0.00 0.00 0.00 61.98 62.07 3h0b s VAL 344 Cb -0.17 -3.57 0.23 0.00 0.00 0.00 0.00 36.38 32.88 3h0b s VAL 344 CO 0.05 0.21 1.24 -0.36 0.00 0.00 0.00 175.10 176.24 3h0b s PHE 345 N 1.78 3.94 -1.35 5.22 0.08 0.15 0.55 117.98 128.35 3h0b s PHE 345 Ca 0.08 -2.45 -0.17 0.00 0.12 0.00 0.00 56.93 54.51 3h0b s PHE 345 Cb -0.16 -4.04 0.05 0.00 -0.57 0.00 0.00 43.02 38.30 3h0b s PHE 345 CO 0.11 -1.14 1.92 -3.47 -0.10 0.00 0.00 175.22 172.54 3h0b n ASP 346 N 3.96 4.50 -0.36 1.36 -0.08 0.04 -2.91 116.55 123.06 3h0b n ASP 346 Ca 0.29 -2.89 -0.03 0.00 -1.51 0.00 0.00 54.79 50.66 3h0b n ASP 346 Cb 0.41 -1.71 0.11 0.00 2.34 0.00 0.00 41.12 42.26 3h0b n ASP 346 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3h0b h ARG 347 N 7.03 1.30 -0.84 -0.67 3.08 -1.74 0.73 114.38 123.27 3h0b h ARG 347 Ca 0.49 -0.10 0.15 0.00 0.07 0.00 0.00 59.98 60.59 3h0b h ARG 347 Cb 0.78 -0.28 -0.10 0.00 0.08 0.00 0.00 29.97 30.46 3h0b h ARG 347 CO 1.62 0.89 0.42 0.00 -1.07 0.00 0.00 179.97 181.83 3h0b h ALA 348 N 1.34 1.27 -0.40 0.04 0.00 -1.39 -2.09 119.26 118.03 3h0b h ALA 348 Ca 0.35 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3h0b h ALA 348 Cb -0.10 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3h0b h ALA 348 CO -0.07 -0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.59 3h0b n ARG 349 N -4.90 2.56 -3.40 0.00 1.74 -0.93 -4.99 116.66 106.73 3h0b n ARG 349 Ca 0.17 -2.12 -0.17 0.00 -0.77 0.00 0.00 57.85 54.96 3h0b n ARG 349 Cb 0.46 -1.36 0.08 0.00 -1.02 0.00 0.00 32.46 30.62 3h0b n ARG 349 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3h0b n LYS 350 N 0.88 -5.33 -3.54 5.56 4.81 0.18 -4.92 118.16 115.80 3h0b n LYS 350 Ca 0.15 0.84 -0.13 0.00 -0.87 0.00 0.00 58.31 58.29 3h0b n LYS 350 Cb 0.47 -5.81 -0.04 0.00 0.02 0.00 0.00 35.03 29.67 3h0b n LYS 350 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 3h0b s ARG 351 N -5.14 1.10 -0.14 1.64 1.70 -0.75 -1.33 118.95 116.03 3h0b s ARG 351 Ca 0.13 -0.29 0.02 0.00 -0.47 0.00 0.00 55.73 55.11 3h0b s ARG 351 Cb -0.02 0.51 0.01 0.00 -0.57 0.00 0.00 34.95 34.87 3h0b s ARG 351 CO 0.74 -0.42 -0.20 0.42 -1.08 0.00 0.00 175.30 174.76 3h0b s ILE 352 N -2.79 2.27 0.08 4.99 1.01 0.49 -0.78 121.20 126.46 3h0b s ILE 352 Ca -0.03 -0.91 -0.13 0.00 0.00 0.00 0.00 60.65 59.58 3h0b s ILE 352 Cb -0.00 -1.92 -0.06 0.00 0.01 0.00 0.00 42.46 40.48 3h0b s ILE 352 CO -0.04 0.54 0.46 -0.83 0.00 0.00 0.00 174.94 175.06 3h0b s GLY 353 N 0.79 2.43 -0.08 6.18 0.00 0.19 -1.06 107.32 115.76 3h0b s GLY 353 Ca -0.07 -0.24 0.02 0.00 0.00 0.00 0.00 44.72 44.43 3h0b s GLY 353 CO -0.01 0.05 -0.12 -1.36 0.00 0.00 0.00 173.10 171.66 3h0b s PHE 354 N -1.32 1.60 0.05 1.90 0.40 0.26 -0.86 117.98 120.01 3h0b s PHE 354 Ca 0.32 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 56.00 3h0b s PHE 354 Cb -0.15 -1.19 -0.02 0.00 0.51 0.00 0.00 43.02 42.16 3h0b s PHE 354 CO 0.17 -0.37 -0.09 0.00 0.70 0.00 0.00 175.22 175.63 3h0b s ALA 355 N 0.92 0.70 0.14 5.36 0.00 -0.77 -1.37 121.76 126.74 3h0b s ALA 355 Ca -0.09 -0.79 -0.35 0.00 0.00 0.00 0.00 51.96 50.73 3h0b s ALA 355 Cb -0.15 0.01 -0.15 0.00 0.00 0.00 0.00 23.12 22.83 3h0b s ALA 355 CO 0.00 0.03 1.46 0.28 0.00 0.00 0.00 175.76 177.53 3h0b n VAL 356 N 1.49 0.12 -2.59 0.00 0.31 -1.25 0.50 118.33 116.91 3h0b n VAL 356 Ca -0.22 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.67 3h0b n VAL 356 Cb 0.55 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.18 3h0b n VAL 356 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3h0b s SER 357 N 0.67 7.39 0.32 4.52 0.15 -0.62 -1.66 113.70 124.47 3h0b s SER 357 Ca 0.80 2.06 0.26 0.00 0.70 0.00 0.00 55.95 59.76 3h0b s SER 357 Cb -0.78 -2.61 1.04 0.00 -1.71 0.00 0.00 66.02 61.96 3h0b s SER 357 CO 0.43 -0.09 1.78 0.00 1.20 0.00 0.00 173.24 176.55 3h0b h ALA 358 N 4.63 1.00 -0.14 5.45 0.00 -1.35 -3.13 119.26 125.73 3h0b h ALA 358 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3h0b h ALA 358 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3h0b h ALA 358 CO 0.70 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.95 3h0b s HIS 360 N -0.89 2.84 -0.12 0.00 -0.00 -1.19 -4.69 115.29 111.24 3h0b s HIS 360 Ca 0.10 1.56 -0.26 0.00 -0.00 0.00 0.00 55.06 56.46 3h0b s HIS 360 Cb 0.06 -3.26 -0.02 0.00 -0.00 0.00 0.00 32.58 29.36 3h0b s HIS 360 CO 0.07 -1.33 0.86 0.08 -0.00 0.00 0.00 174.74 174.43 3h0b s VAL 361 N -1.74 4.89 0.35 -5.38 1.01 -1.26 -5.03 120.40 113.23 3h0b s VAL 361 Ca 0.68 1.73 -0.03 0.00 0.00 0.00 0.00 61.98 64.36 3h0b s VAL 361 Cb -0.24 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 31.98 3h0b s VAL 361 CO 0.28 0.07 0.52 0.00 0.00 0.00 0.00 175.10 175.97 3h0b n HIS 362 N 4.81 -1.56 -3.41 5.22 -0.00 -1.26 -4.72 115.22 114.29 3h0b n HIS 362 Ca 0.05 -2.26 0.00 0.00 -0.00 0.00 0.00 57.72 55.51 3h0b n HIS 362 Cb 0.49 0.59 0.00 0.00 -0.00 0.00 0.00 29.99 31.08 3h0b n HIS 362 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3h0b n ASP 363 N -1.61 1.22 -0.09 4.39 5.68 -1.21 -5.02 116.55 119.91 3h0b n ASP 363 Ca -0.01 -0.80 0.14 0.00 -0.50 0.00 0.00 54.79 53.62 3h0b n ASP 363 Cb 0.58 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.16 3h0b n ASP 363 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3h0b n GLU 364 N -0.31 0.56 -0.03 0.11 0.28 -1.26 -3.84 120.64 116.14 3h0b n GLU 364 Ca 0.00 -0.18 0.01 0.00 -0.16 0.00 0.00 57.16 56.83 3h0b n GLU 364 Cb 0.00 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.28 3h0b n GLU 364 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3h0b n PHE 365 N -1.07 0.00 -4.17 -1.84 3.01 -1.26 -5.03 117.46 107.11 3h0b n PHE 365 Ca 0.13 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.46 3h0b n PHE 365 Cb 0.28 -0.40 -0.11 0.00 -0.01 0.00 0.00 39.48 39.25 3h0b n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3h0b s ARG 366 N -2.56 0.82 -0.05 -1.08 0.52 -1.25 -5.16 118.95 110.19 3h0b s ARG 366 Ca -0.05 -1.18 -0.14 0.00 -0.52 0.00 0.00 55.73 53.84 3h0b s ARG 366 Cb 0.06 -0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.13 3h0b s ARG 366 CO 0.47 0.05 0.33 -0.08 0.02 0.00 0.00 175.30 176.09 3h0b s THR 367 N -2.69 0.04 0.65 0.02 -1.32 -1.26 -3.33 115.64 107.74 3h0b s THR 367 Ca 0.06 -0.31 -0.17 0.00 -1.21 0.00 0.00 61.69 60.06 3h0b s THR 367 Cb -0.01 -0.58 -0.05 0.00 -1.51 0.00 0.00 72.50 70.35 3h0b s THR 367 CO -0.01 -0.17 0.72 0.00 -2.21 0.00 0.00 174.62 172.95 3h0b n ALA 368 N 1.82 -0.74 -2.62 11.08 0.00 -1.26 -4.93 120.51 123.86 3h0b n ALA 368 Ca -0.19 -0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.06 3h0b n ALA 368 Cb 0.57 -1.96 -0.09 0.00 0.00 0.00 0.00 19.45 17.97 3h0b n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0b s ALA 369 N -1.73 0.00 -0.28 0.00 0.00 -0.52 -4.91 121.76 114.32 3h0b s ALA 369 Ca 0.71 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.98 3h0b s ALA 369 Cb -0.39 0.28 0.09 0.00 0.00 0.00 0.00 23.12 23.10 3h0b s ALA 369 CO 0.52 -0.35 0.11 0.08 0.00 0.00 0.00 175.76 176.13 3h0b s VAL 370 N -2.93 0.16 0.15 0.00 1.01 -1.26 -0.17 120.40 117.37 3h0b s VAL 370 Ca -0.02 -0.82 0.10 0.00 0.00 0.00 0.00 61.98 61.24 3h0b s VAL 370 Cb 0.01 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3h0b s VAL 370 CO -0.06 -0.64 -0.24 -1.61 0.00 0.00 0.00 175.10 172.55 3h0b s GLU 371 N 1.99 1.38 0.00 2.72 2.02 -0.33 -4.85 118.70 121.62 3h0b s GLU 371 Ca 0.08 -1.39 0.00 0.00 0.02 0.00 0.00 54.97 53.68 3h0b s GLU 371 Cb -0.16 -1.72 0.00 0.00 0.10 0.00 0.00 34.13 32.35 3h0b s GLU 371 CO -0.30 0.39 0.00 0.41 0.02 0.00 0.00 175.26 175.78 3h0b n GLY 372 N 0.63 -0.15 3.99 -1.39 0.00 -1.26 -0.81 105.19 106.20 3h0b n GLY 372 Ca -0.16 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.76 3h0b n GLY 372 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h0b s PRO 373 N -2.00 2.38 -0.02 1.61 0.04 -1.26 -5.09 135.00 130.66 3h0b s PRO 373 Ca 0.00 -1.03 0.03 0.00 0.04 0.00 0.00 61.00 60.04 3h0b s PRO 373 Cb 0.00 -2.52 -0.00 0.00 0.04 0.00 0.00 34.50 32.02 3h0b s PRO 373 CO 0.00 -0.81 -0.09 -0.06 0.04 0.00 0.00 177.00 176.07 3h0b s PHE 374 N -2.76 0.88 -0.05 0.56 0.40 -0.28 -4.95 117.98 111.77 3h0b s PHE 374 Ca 0.59 -0.19 -0.30 0.00 -0.60 0.00 0.00 56.93 56.44 3h0b s PHE 374 Cb -0.09 -0.60 -0.05 0.00 0.51 0.00 0.00 43.02 42.80 3h0b s PHE 374 CO 0.39 -0.05 1.51 0.08 0.70 0.00 0.00 175.22 177.85 3h0b s VAL 375 N -0.03 3.70 -0.03 -0.44 1.01 -1.26 -1.21 120.40 122.12 3h0b s VAL 375 Ca 0.01 0.94 -0.01 0.00 0.00 0.00 0.00 61.98 62.92 3h0b s VAL 375 Cb -0.06 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.74 3h0b s VAL 375 CO -0.00 -0.05 0.06 -0.89 0.00 0.00 0.00 175.10 174.21 3h0b s THR 376 N 3.36 -0.09 0.03 3.92 2.01 0.16 -4.92 115.64 120.11 3h0b s THR 376 Ca 0.67 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.99 3h0b s THR 376 Cb -0.31 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 3h0b s THR 376 CO 0.26 0.13 0.13 -0.76 -0.69 0.00 0.00 174.62 173.69 3h0b s LEU 377 N 1.63 4.06 -1.15 4.42 1.43 -1.26 -4.02 118.68 123.79 3h0b s LEU 377 Ca -0.02 0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.22 3h0b s LEU 377 Cb -0.12 -2.52 0.00 0.00 0.03 0.00 0.00 46.19 43.58 3h0b s LEU 377 CO -0.03 0.23 0.46 0.47 0.23 0.00 0.00 176.35 177.71 3h0b n ASP 378 N 0.79 -4.95 0.25 2.29 10.43 -1.26 -4.88 116.55 119.21 3h0b n ASP 378 Ca -0.10 -0.22 0.08 0.00 2.57 0.00 0.00 54.79 57.13 3h0b n ASP 378 Cb 0.52 -3.80 0.62 0.00 1.84 0.00 0.00 41.12 40.31 3h0b n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 3h0b h MET 379 N -1.05 0.00 -0.13 -1.24 2.86 -1.99 -0.50 114.93 112.87 3h0b h MET 379 Ca -0.39 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.24 3h0b h MET 379 Cb 1.27 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 3h0b h MET 379 CO 0.42 0.12 0.07 0.93 1.06 0.00 0.00 176.91 179.50 3h0b h GLU 380 N 0.00 0.18 0.00 1.72 4.39 -1.97 -2.10 114.58 116.80 3h0b h GLU 380 Ca -0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3h0b h GLU 380 Cb 0.23 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 3h0b h GLU 380 CO 0.02 0.14 0.00 -0.44 -1.16 0.00 0.00 179.01 177.56 3h0b h ASP 381 N 0.18 0.00 1.06 1.42 3.32 -1.46 -2.55 116.42 118.39 3h0b h ASP 381 Ca 0.05 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.01 3h0b h ASP 381 Cb 0.02 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3h0b h ASP 381 CO -0.01 0.00 -0.40 0.00 -1.72 0.00 0.00 179.24 177.11 3h0b s GLY 383 N -4.38 2.13 0.12 0.00 0.00 -0.96 -3.83 107.32 100.39 3h0b s GLY 383 Ca 0.01 1.20 -0.06 0.00 0.00 0.00 0.00 44.72 45.88 3h0b s GLY 383 CO 0.70 2.30 0.38 -0.47 0.00 0.00 0.00 173.10 176.00 3h0b s TYR 384 N 0.57 3.50 -0.62 1.90 5.04 -1.26 -4.96 117.35 121.52 3h0b s TYR 384 Ca 0.62 0.61 0.05 0.00 -2.44 0.00 0.00 57.07 55.91 3h0b s TYR 384 Cb -0.39 -2.04 0.04 0.00 0.35 0.00 0.00 41.96 39.92 3h0b s TYR 384 CO 0.36 0.46 0.66 0.09 -1.34 0.00 0.00 175.55 175.77