#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sbl s ILE 8 N 0.00 2.24 0.17 -0.18 -4.36 0.01 -4.90 121.20 114.17 2sbl s ILE 8 Ca 0.00 -0.95 -0.30 0.00 -0.26 0.00 0.00 60.65 59.14 2sbl s ILE 8 Cb 0.00 -1.88 -0.07 0.00 1.25 0.00 0.00 42.46 41.76 2sbl s ILE 8 CO 0.00 0.55 0.98 -0.75 0.24 0.00 0.00 174.94 175.96 2sbl s LYS 9 N 0.44 4.74 0.02 0.37 2.47 -1.26 -1.10 119.74 125.42 2sbl s LYS 9 Ca -0.15 1.52 -0.02 0.00 -1.56 0.00 0.00 55.97 55.75 2sbl s LYS 9 Cb -0.17 -3.32 -0.02 0.00 -1.46 0.00 0.00 37.83 32.86 2sbl s LYS 9 CO 0.06 0.30 0.02 0.20 0.16 0.00 0.00 175.35 176.09 2sbl s GLY 10 N -0.46 0.22 -0.04 5.54 0.00 -0.06 -1.26 107.32 111.26 2sbl s GLY 10 Ca 0.45 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.60 2sbl s GLY 10 CO 0.32 -0.67 -0.02 -1.08 0.00 0.00 0.00 173.10 171.65 2sbl s THR 11 N -1.93 0.36 -0.23 0.90 -1.32 -0.28 -0.87 115.64 112.28 2sbl s THR 11 Ca -0.11 -0.01 -0.07 0.00 -1.21 0.00 0.00 61.69 60.29 2sbl s THR 11 Cb -0.06 -0.43 -0.03 0.00 -1.51 0.00 0.00 72.50 70.47 2sbl s THR 11 CO -0.02 0.19 0.05 -0.69 -2.21 0.00 0.00 174.62 171.94 2sbl s VAL 12 N 1.03 4.32 -0.22 5.08 1.01 0.11 -1.03 120.40 130.70 2sbl s VAL 12 Ca -0.10 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.61 2sbl s VAL 12 Cb -0.14 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 2sbl s VAL 12 CO -0.01 0.38 0.12 -0.69 0.00 0.00 0.00 175.10 174.90 2sbl s VAL 13 N 1.26 5.14 0.21 2.92 1.01 -0.48 -0.93 120.40 129.54 2sbl s VAL 13 Ca 0.05 0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.23 2sbl s VAL 13 Cb -0.15 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2sbl s VAL 13 CO 0.03 0.39 -0.20 -0.76 0.00 0.00 0.00 175.10 174.56 2sbl s LEU 14 N 0.83 2.50 -0.15 3.92 1.02 0.08 -1.24 118.68 125.64 2sbl s LEU 14 Ca 0.06 -0.93 -0.01 0.00 0.02 0.00 0.00 54.13 53.27 2sbl s LEU 14 Cb -0.13 -0.99 0.04 0.00 0.02 0.00 0.00 46.19 45.13 2sbl s LEU 14 CO 0.02 0.02 -0.04 -0.04 0.02 0.00 0.00 176.35 176.33 2sbl s MET 15 N -3.08 1.31 0.52 1.70 -1.94 -0.22 -0.27 119.30 117.31 2sbl s MET 15 Ca 0.22 -0.40 -0.22 0.00 -1.71 0.00 0.00 55.69 53.59 2sbl s MET 15 Cb -0.05 -1.83 -0.06 0.00 2.01 0.00 0.00 34.83 34.90 2sbl s MET 15 CO 0.10 -0.40 1.27 -1.25 -0.01 0.00 0.00 175.02 174.73 2sbl s PRO 16 N 1.70 3.35 0.24 2.03 0.04 -1.26 -0.70 135.00 140.40 2sbl s PRO 16 Ca 0.02 2.02 -0.09 0.00 0.04 0.00 0.00 61.00 62.98 2sbl s PRO 16 Cb -0.15 -2.28 0.36 0.00 0.04 0.00 0.00 34.50 32.48 2sbl s PRO 16 CO -0.08 -0.95 1.40 1.17 0.04 0.00 0.00 177.00 178.58 2sbl n LYS 17 N -0.89 -0.11 0.25 4.56 4.81 -1.25 -1.21 118.16 124.33 2sbl n LYS 17 Ca 0.10 1.40 0.17 0.00 -0.87 0.00 0.00 58.31 59.10 2sbl n LYS 17 Cb 0.47 -2.08 0.90 0.00 0.02 0.00 0.00 35.03 34.33 2sbl n LYS 17 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 2sbl h ASN 18 N 0.00 0.00 0.88 3.14 4.21 -1.91 -0.03 115.58 121.86 2sbl h ASN 18 Ca 0.40 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.86 2sbl h ASN 18 Cb 0.63 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.82 2sbl h ASN 18 CO -0.92 0.00 -0.26 -0.33 -1.29 0.00 0.00 177.43 174.63 2sbl h GLU 19 N 0.00 0.00 0.00 0.81 4.39 -1.53 -3.33 114.58 114.92 2sbl h GLU 19 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2sbl h GLU 19 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2sbl h GLU 19 CO -0.00 0.26 -0.60 1.28 -1.16 0.00 0.00 179.01 178.80 2sbl n LEU 20 N -3.45 0.03 -0.03 1.33 4.77 -0.36 -4.11 117.00 115.19 2sbl n LEU 20 Ca -0.00 -0.23 -0.08 0.00 -0.03 0.00 0.00 56.01 55.67 2sbl n LEU 20 Cb 0.45 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.47 2sbl n LEU 20 CO 0.34 0.01 0.24 -0.33 -1.33 0.00 0.00 177.39 176.32 2sbl h GLU 21 N 0.00 -0.06 0.00 3.23 3.07 -1.19 -1.98 114.58 117.65 2sbl h GLU 21 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2sbl h GLU 21 Cb 0.05 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2sbl h GLU 21 CO 0.00 0.42 0.00 1.28 -1.40 0.00 0.00 179.01 179.31 2sbl n LEU 32 N -4.76 0.00 0.29 1.33 4.32 -1.26 -4.92 117.00 112.01 2sbl n LEU 32 Ca -0.06 0.00 0.18 0.00 -0.02 0.00 0.00 56.01 56.11 2sbl n LEU 32 Cb 0.24 0.00 0.88 0.00 -1.62 0.00 0.00 43.42 42.92 2sbl n LEU 32 CO 0.19 0.00 1.05 0.78 -1.22 0.00 0.00 177.39 178.19 2sbl h ASN 33 N 0.00 0.00 0.35 -1.43 2.35 -2.04 -1.53 115.58 113.29 2sbl h ASN 33 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2sbl h ASN 33 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 2sbl h ASN 33 CO 0.00 0.04 -0.06 0.00 -1.65 0.00 0.00 177.43 175.76 2sbl h ALA 34 N 1.96 1.19 0.00 -0.83 0.00 -2.04 -1.27 119.26 118.27 2sbl h ALA 34 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2sbl h ALA 34 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2sbl h ALA 34 CO 0.01 0.07 0.00 1.19 0.00 0.00 0.00 179.25 180.52 2sbl n PHE 35 N -3.43 0.05 -2.64 0.00 3.72 -0.57 -4.73 117.46 109.86 2sbl n PHE 35 Ca -0.02 0.02 -0.21 0.00 -0.05 0.00 0.00 57.45 57.18 2sbl n PHE 35 Cb 0.19 -0.53 0.11 0.00 -0.94 0.00 0.00 39.48 38.31 2sbl n PHE 35 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2sbl n LEU 36 N -1.55 0.00 0.00 4.37 4.77 -0.48 -4.34 117.00 119.78 2sbl n LEU 36 Ca 0.06 -2.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.01 2sbl n LEU 36 Cb 0.28 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 2sbl n LEU 36 CO 0.22 -0.94 0.00 0.61 -1.33 0.00 0.00 177.39 175.96 2sbl n GLY 37 N -2.19 -0.31 2.57 -0.72 0.00 -1.25 -3.83 105.19 99.47 2sbl n GLY 37 Ca 0.16 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.72 2sbl n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sbl n ARG 38 N 1.59 2.64 -0.02 1.61 1.74 -1.26 -4.37 116.66 118.59 2sbl n ARG 38 Ca 0.00 -3.21 -0.13 0.00 -0.77 0.00 0.00 57.85 53.75 2sbl n ARG 38 Cb 0.00 -2.23 -0.14 0.00 -1.02 0.00 0.00 32.46 29.07 2sbl n ARG 38 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2sbl n SER 39 N -0.54 1.24 -3.74 0.55 7.64 -1.25 -4.79 113.62 112.74 2sbl n SER 39 Ca 0.56 0.33 -0.23 0.00 1.01 0.00 0.00 58.87 60.54 2sbl n SER 39 Cb 0.46 -0.28 -0.18 0.00 -1.01 0.00 0.00 64.21 63.21 2sbl n SER 39 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2sbl s VAL 40 N -2.58 0.27 -0.00 0.44 1.01 -1.26 -0.39 120.40 117.88 2sbl s VAL 40 Ca -0.11 0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2sbl s VAL 40 Cb 0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 2sbl s VAL 40 CO 0.81 0.18 -0.15 -0.94 0.00 0.00 0.00 175.10 175.00 2sbl s SER 41 N 2.01 4.03 0.20 3.32 1.04 -0.36 -2.91 113.70 121.02 2sbl s SER 41 Ca 0.04 -0.29 0.09 0.00 0.48 0.00 0.00 55.95 56.28 2sbl s SER 41 Cb -0.13 -0.78 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 2sbl s SER 41 CO -0.05 0.30 -0.07 -0.76 0.98 0.00 0.00 173.24 173.64 2sbl s LEU 42 N -1.16 3.06 -0.07 2.42 1.02 -0.10 -0.63 118.68 123.23 2sbl s LEU 42 Ca 0.14 -0.58 -0.03 0.00 0.02 0.00 0.00 54.13 53.68 2sbl s LEU 42 Cb -0.11 -1.70 0.04 0.00 0.02 0.00 0.00 46.19 44.45 2sbl s LEU 42 CO 0.04 0.08 0.13 -1.10 0.02 0.00 0.00 176.35 175.51 2sbl s GLN 43 N -3.05 0.02 0.38 1.70 -0.21 -0.46 -1.23 119.66 116.81 2sbl s GLN 43 Ca 0.27 0.45 -0.19 0.00 0.02 0.00 0.00 55.36 55.91 2sbl s GLN 43 Cb -0.08 -0.30 -0.10 0.00 1.00 0.00 0.00 33.01 33.53 2sbl s GLN 43 CO 0.17 -0.27 0.87 -0.51 -2.12 0.00 0.00 175.29 173.43 2sbl s LEU 44 N 1.92 4.03 -0.03 2.90 1.02 -1.26 -0.58 118.68 126.68 2sbl s LEU 44 Ca -0.00 1.55 0.05 0.00 0.02 0.00 0.00 54.13 55.75 2sbl s LEU 44 Cb -0.12 -4.31 -0.01 0.00 0.02 0.00 0.00 46.19 41.77 2sbl s LEU 44 CO -0.05 -0.27 -0.18 -0.63 0.02 0.00 0.00 176.35 175.24 2sbl s ILE 45 N -2.05 1.43 0.23 -0.59 1.01 0.21 -0.57 121.20 120.88 2sbl s ILE 45 Ca 0.58 -0.74 -0.29 0.00 0.00 0.00 0.00 60.65 60.19 2sbl s ILE 45 Cb -0.10 -1.21 -0.09 0.00 0.01 0.00 0.00 42.46 41.06 2sbl s ILE 45 CO 0.16 0.41 0.90 -0.55 0.00 0.00 0.00 174.94 175.86 2sbl s SER 46 N -0.18 7.58 0.06 3.58 0.15 0.19 -0.60 113.70 124.49 2sbl s SER 46 Ca 0.01 1.88 0.21 0.00 0.70 0.00 0.00 55.95 58.75 2sbl s SER 46 Cb -0.09 -2.58 -0.16 0.00 -1.71 0.00 0.00 66.02 61.47 2sbl s SER 46 CO 0.01 0.16 0.73 0.00 1.20 0.00 0.00 173.24 175.34 2sbl n ALA 47 N 1.48 2.41 -0.02 5.45 0.00 -0.08 -4.26 120.51 125.50 2sbl n ALA 47 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2sbl n ALA 47 Cb 0.47 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.04 2sbl n ALA 47 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2sbl n THR 48 N -2.59 0.00 -3.90 0.00 -2.24 -1.24 -4.36 114.28 99.96 2sbl n THR 48 Ca -0.06 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.02 2sbl n THR 48 Cb 0.67 1.02 -0.17 0.00 -2.10 0.00 0.00 70.33 69.75 2sbl n THR 48 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2sbl s LYS 49 N -0.15 0.58 0.23 -0.78 -0.14 -1.26 -4.92 119.74 113.29 2sbl s LYS 49 Ca 0.00 0.06 0.06 0.00 -1.36 0.00 0.00 55.97 54.73 2sbl s LYS 49 Cb 0.00 -0.83 -0.03 0.00 -1.68 0.00 0.00 37.83 35.29 2sbl s LYS 49 CO 0.00 -0.22 0.24 0.00 -0.76 0.00 0.00 175.35 174.61 2sbl s ALA 50 N 1.53 3.71 0.84 5.17 0.00 -1.26 -1.15 121.76 130.60 2sbl s ALA 50 Ca -0.02 -1.31 -0.08 0.00 0.00 0.00 0.00 51.96 50.55 2sbl s ALA 50 Cb -0.13 -1.46 0.16 0.00 0.00 0.00 0.00 23.12 21.69 2sbl s ALA 50 CO -0.03 0.30 1.15 0.16 0.00 0.00 0.00 175.76 177.34 2sbl s ASP 51 N -3.74 3.76 0.00 0.00 -4.77 0.60 -4.70 116.67 107.82 2sbl s ASP 51 Ca 0.33 -0.08 0.00 0.00 -3.30 0.00 0.00 52.55 49.50 2sbl s ASP 51 Cb -0.09 -0.13 0.00 0.00 -1.09 0.00 0.00 42.92 41.61 2sbl s ASP 51 CO 0.26 -2.28 0.20 0.00 0.70 0.00 0.00 175.17 174.05 2sbl n ALA 52 N -3.27 1.67 -0.60 2.11 0.00 -1.26 -0.84 120.51 118.32 2sbl n ALA 52 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.61 2sbl n ALA 52 Cb 0.60 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 19.07 2sbl n ALA 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2sbl n HIS 53 N -0.42 0.00 0.00 0.00 8.25 -1.26 -5.01 115.22 116.78 2sbl n HIS 53 Ca 0.00 -0.38 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 2sbl n HIS 53 Cb 0.00 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2sbl n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2sbl n GLY 54 N -0.43 3.00 3.82 -1.41 0.00 -0.02 -5.05 105.19 105.10 2sbl n GLY 54 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2sbl n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sbl s LYS 55 N -0.49 3.53 0.44 1.61 1.02 -1.26 -4.17 119.74 120.42 2sbl s LYS 55 Ca 0.00 1.08 -0.25 0.00 0.02 0.00 0.00 55.97 56.83 2sbl s LYS 55 Cb 0.00 -2.07 -0.08 0.00 -0.52 0.00 0.00 37.83 35.16 2sbl s LYS 55 CO 0.00 -0.63 1.33 0.20 -0.92 0.00 0.00 175.35 175.33 2sbl s GLY 56 N -3.00 2.90 0.31 -3.33 0.00 -0.59 -0.29 107.32 103.32 2sbl s GLY 56 Ca 0.61 1.29 -0.29 0.00 0.00 0.00 0.00 44.72 46.33 2sbl s GLY 56 CO 0.37 1.86 1.43 0.54 0.00 0.00 0.00 173.10 177.29 2sbl s LYS 57 N -2.45 4.24 -0.10 2.90 1.02 -0.30 -4.54 119.74 120.51 2sbl s LYS 57 Ca 0.61 2.37 -0.05 0.00 0.02 0.00 0.00 55.97 58.92 2sbl s LYS 57 Cb -0.39 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 33.83 2sbl s LYS 57 CO 0.49 -0.40 0.09 0.08 -0.92 0.00 0.00 175.35 174.69 2sbl s VAL 58 N -0.59 5.08 0.67 3.17 1.01 -1.26 -0.64 120.40 127.84 2sbl s VAL 58 Ca 0.55 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.60 2sbl s VAL 58 Cb -0.43 -3.20 0.12 0.00 0.00 0.00 0.00 36.38 32.87 2sbl s VAL 58 CO 0.51 0.60 0.92 -0.83 0.00 0.00 0.00 175.10 176.31 2sbl s GLY 59 N -1.02 1.73 0.74 4.51 0.00 0.26 -4.98 107.32 108.56 2sbl s GLY 59 Ca 0.15 -1.98 -0.13 0.00 0.00 0.00 0.00 44.72 42.76 2sbl s GLY 59 CO 0.04 -1.43 1.13 0.54 0.00 0.00 0.00 173.10 173.38 2sbl s LYS 60 N -4.96 2.27 -0.03 2.90 1.02 -1.26 -4.51 119.74 115.17 2sbl s LYS 60 Ca 0.65 1.43 -0.30 0.00 0.02 0.00 0.00 55.97 57.77 2sbl s LYS 60 Cb -0.05 -1.88 -0.05 0.00 -0.52 0.00 0.00 37.83 35.33 2sbl s LYS 60 CO 0.42 -1.67 1.52 -0.51 -0.92 0.00 0.00 175.35 174.20 2sbl s ASP 61 N -2.69 6.76 -0.07 2.83 1.11 -1.26 -4.49 116.67 118.85 2sbl s ASP 61 Ca 0.67 2.16 0.05 0.00 0.18 0.00 0.00 52.55 55.61 2sbl s ASP 61 Cb -0.22 -2.55 -0.01 0.00 1.07 0.00 0.00 42.92 41.21 2sbl s ASP 61 CO 0.48 -0.83 -0.22 -0.89 1.18 0.00 0.00 175.17 174.89 2sbl s THR 62 N 3.18 2.31 0.38 -1.27 2.01 -0.36 -4.96 115.64 116.93 2sbl s THR 62 Ca 0.68 -0.97 0.08 0.00 0.31 0.00 0.00 61.69 61.78 2sbl s THR 62 Cb -0.32 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.30 2sbl s THR 62 CO 0.27 0.57 0.34 -0.36 -0.69 0.00 0.00 174.62 174.74 2sbl s PHE 63 N -0.17 2.79 0.06 4.92 0.40 -1.26 -0.92 117.98 123.80 2sbl s PHE 63 Ca -0.03 -0.41 -0.31 0.00 -0.60 0.00 0.00 56.93 55.59 2sbl s PHE 63 Cb -0.14 -2.00 -0.07 0.00 0.51 0.00 0.00 43.02 41.33 2sbl s PHE 63 CO 0.04 0.02 1.46 -0.51 0.70 0.00 0.00 175.22 176.93 2sbl s LEU 64 N -4.07 4.35 -0.07 -0.37 1.02 -1.15 -4.71 118.68 113.68 2sbl s LEU 64 Ca 0.45 2.29 -0.03 0.00 0.02 0.00 0.00 54.13 56.86 2sbl s LEU 64 Cb -0.04 -3.57 -0.01 0.00 0.02 0.00 0.00 46.19 42.59 2sbl s LEU 64 CO 0.27 -0.74 -0.05 -0.33 0.02 0.00 0.00 176.35 175.52 2sbl h GLU 65 N 7.55 0.00 -3.05 1.70 5.08 -1.51 -3.31 114.58 121.04 2sbl h GLU 65 Ca -0.40 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.88 2sbl h GLU 65 Cb 1.19 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.28 2sbl h GLU 65 CO 0.90 0.00 -0.10 0.20 -1.00 0.00 0.00 179.01 179.01 2sbl s GLY 66 N -3.21 -0.28 0.41 -3.84 0.00 -1.21 -4.74 107.32 94.45 2sbl s GLY 66 Ca -0.04 0.29 -0.25 0.00 0.00 0.00 0.00 44.72 44.71 2sbl s GLY 66 CO 0.06 0.03 1.19 -0.42 0.00 0.00 0.00 173.10 173.97 2sbl s ILE 67 N -2.58 3.04 0.00 0.90 1.01 -1.26 -1.07 121.20 121.24 2sbl s ILE 67 Ca -0.05 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.47 2sbl s ILE 67 Cb -0.01 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2sbl s ILE 67 CO -0.03 0.08 0.00 -3.20 0.00 0.00 0.00 174.94 171.78 2sbl n ASN 68 N -0.00 0.00 0.00 3.58 4.05 0.11 -4.82 115.26 118.18 2sbl n ASN 68 Ca 0.05 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.08 2sbl n ASN 68 Cb 0.46 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.47 2sbl n ASN 68 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2sbl n LEU 74 N 0.00 0.00 -4.66 1.20 -0.00 -1.26 -3.52 117.00 108.76 2sbl n LEU 74 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.72 2sbl n LEU 74 Cb 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 43.42 43.61 2sbl n LEU 74 CO 0.00 0.00 0.64 -0.83 -0.00 0.00 0.00 177.39 177.20 2sbl s GLY 75 N 0.00 1.57 0.18 1.47 0.00 -1.26 -4.95 107.32 104.32 2sbl s GLY 75 Ca 0.00 -0.54 -0.31 0.00 0.00 0.00 0.00 44.72 43.87 2sbl s GLY 75 CO 0.00 0.15 1.51 0.00 0.00 0.00 0.00 173.10 174.76 2sbl s ALA 76 N -3.00 3.71 0.00 3.20 0.00 -1.26 -2.35 121.76 122.07 2sbl s ALA 76 Ca 0.67 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.95 2sbl s ALA 76 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2sbl s ALA 76 CO 0.57 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2sbl n GLY 77 N 3.35 2.82 3.85 0.00 0.00 -1.26 -5.02 105.19 108.93 2sbl n GLY 77 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2sbl n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2sbl s GLU 78 N -0.43 3.70 -0.08 1.61 2.02 -0.99 -4.35 118.70 120.19 2sbl s GLU 78 Ca 0.00 0.89 -0.04 0.00 0.02 0.00 0.00 54.97 55.84 2sbl s GLU 78 Cb 0.00 -2.10 0.04 0.00 0.10 0.00 0.00 34.13 32.17 2sbl s GLU 78 CO 0.00 -0.48 0.18 0.45 0.02 0.00 0.00 175.26 175.43 2sbl s SER 79 N -3.56 -0.17 0.05 -0.19 0.15 0.63 -4.92 113.70 105.70 2sbl s SER 79 Ca 0.57 0.38 -0.02 0.00 0.70 0.00 0.00 55.95 57.58 2sbl s SER 79 Cb -0.11 0.27 -0.04 0.00 -1.71 0.00 0.00 66.02 64.42 2sbl s SER 79 CO 0.43 -0.15 0.24 0.00 1.20 0.00 0.00 173.24 174.95 2sbl s ALA 80 N 1.19 3.94 0.00 5.45 0.00 -1.23 -0.74 121.76 130.37 2sbl s ALA 80 Ca -0.09 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.14 2sbl s ALA 80 Cb -0.11 -1.93 -0.00 0.00 0.00 0.00 0.00 23.12 21.08 2sbl s ALA 80 CO -0.07 0.76 -0.01 -0.06 0.00 0.00 0.00 175.76 176.37 2sbl s PHE 81 N -1.47 0.13 0.03 0.00 0.40 -0.11 -0.71 117.98 116.25 2sbl s PHE 81 Ca 0.33 -0.09 -0.06 0.00 -0.60 0.00 0.00 56.93 56.51 2sbl s PHE 81 Cb -0.13 -0.09 -0.05 0.00 0.51 0.00 0.00 43.02 43.27 2sbl s PHE 81 CO 0.24 -0.03 0.28 -0.80 0.70 0.00 0.00 175.22 175.61 2sbl s ASN 82 N -0.25 6.50 -0.01 1.36 0.01 -0.23 -0.71 114.94 121.62 2sbl s ASN 82 Ca -0.02 0.57 -0.08 0.00 -0.71 0.00 0.00 52.86 52.61 2sbl s ASN 82 Cb -0.02 -2.09 0.01 0.00 0.41 0.00 0.00 41.25 39.56 2sbl s ASN 82 CO -0.00 0.23 0.16 -0.51 -1.51 0.00 0.00 177.10 175.47 2sbl s ILE 83 N -1.35 0.07 -0.09 0.60 2.07 -0.05 -1.23 121.20 121.23 2sbl s ILE 83 Ca 0.29 -0.60 0.00 0.00 -1.41 0.00 0.00 60.65 58.94 2sbl s ILE 83 Cb -0.13 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.04 2sbl s ILE 83 CO 0.18 -0.33 -0.07 -1.00 -1.91 0.00 0.00 174.94 171.80 2sbl s HIS 84 N -1.24 1.29 -0.12 3.50 3.76 -1.26 -0.88 115.29 120.35 2sbl s HIS 84 Ca -0.13 -0.56 -0.03 0.00 -0.15 0.00 0.00 55.06 54.19 2sbl s HIS 84 Cb -0.07 -1.07 -0.03 0.00 1.11 0.00 0.00 32.58 32.52 2sbl s HIS 84 CO 0.02 -0.40 0.00 -0.06 -0.85 0.00 0.00 174.74 173.45 2sbl s PHE 85 N 1.38 3.14 0.04 1.40 0.08 -0.26 -4.91 117.98 118.86 2sbl s PHE 85 Ca -0.02 0.04 -0.30 0.00 0.12 0.00 0.00 56.93 56.77 2sbl s PHE 85 Cb -0.14 -1.88 -0.05 0.00 -0.57 0.00 0.00 43.02 40.38 2sbl s PHE 85 CO -0.04 0.28 1.11 -1.21 -0.10 0.00 0.00 175.22 175.26 2sbl s GLU 86 N -0.34 4.49 -0.13 0.44 2.02 -1.26 -0.81 118.70 123.10 2sbl s GLU 86 Ca 0.07 1.62 -0.08 0.00 0.02 0.00 0.00 54.97 56.60 2sbl s GLU 86 Cb -0.12 -3.39 0.05 0.00 0.10 0.00 0.00 34.13 30.76 2sbl s GLU 86 CO 0.02 -0.17 0.33 -0.46 0.02 0.00 0.00 175.26 175.00 2sbl s TRP 87 N 1.02 -0.45 0.32 1.61 -0.11 -1.26 -4.84 118.94 115.24 2sbl s TRP 87 Ca 0.56 1.01 0.08 0.00 1.22 0.00 0.00 56.10 58.97 2sbl s TRP 87 Cb -0.26 0.15 -0.04 0.00 -1.50 0.00 0.00 33.47 31.82 2sbl s TRP 87 CO 0.29 -0.27 0.11 0.34 -4.62 0.00 0.00 176.95 172.81 2sbl s ASP 88 N 1.10 4.70 0.64 5.86 -1.08 -1.26 -4.36 116.67 122.27 2sbl s ASP 88 Ca -0.08 -0.72 0.40 0.00 -0.52 0.00 0.00 52.55 51.64 2sbl s ASP 88 Cb -0.08 -0.79 2.22 0.00 -1.46 0.00 0.00 42.92 42.81 2sbl s ASP 88 CO -0.08 -0.22 2.32 1.23 0.52 0.00 0.00 175.17 178.94 2sbl h GLY 89 N 1.62 0.00 2.00 2.66 0.00 -2.02 -0.65 103.07 106.68 2sbl h GLY 89 Ca -0.44 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 2sbl h GLY 89 CO 0.62 0.00 -0.10 1.48 0.00 0.00 0.00 176.54 178.55 2sbl h SER 90 N 0.00 0.00 0.83 0.19 4.64 -2.05 -2.91 113.55 114.26 2sbl h SER 90 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2sbl h SER 90 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2sbl h SER 90 CO 0.00 0.10 -0.71 0.24 -0.87 0.00 0.00 176.83 175.58 2sbl h MET 91 N 0.00 0.00 0.00 4.77 2.86 -1.51 -3.48 114.93 117.57 2sbl h MET 91 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2sbl h MET 91 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 2sbl h MET 91 CO 0.01 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.39 2sbl n GLY 92 N 1.32 -0.28 3.56 8.32 0.00 -1.10 -4.35 105.19 112.66 2sbl n GLY 92 Ca 0.03 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 2sbl n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2sbl s ILE 93 N 0.00 4.28 0.26 -0.61 1.01 -1.26 -4.91 121.20 119.97 2sbl s ILE 93 Ca 0.00 -0.22 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 2sbl s ILE 93 Cb 0.00 -2.90 -0.10 0.00 0.01 0.00 0.00 42.46 39.47 2sbl s ILE 93 CO 0.00 0.48 1.38 -2.84 0.00 0.00 0.00 174.94 173.96 2sbl s PRO 94 N 0.34 4.31 0.00 2.79 0.02 -1.26 -0.90 135.00 140.30 2sbl s PRO 94 Ca -0.01 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.24 2sbl s PRO 94 Cb -0.13 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2sbl s PRO 94 CO 0.02 -0.32 0.09 0.41 -0.33 0.00 0.00 177.00 176.86 2sbl n GLY 95 N 1.83 0.56 3.85 0.52 0.00 0.23 -4.70 105.19 107.49 2sbl n GLY 95 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 2sbl n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2sbl s ALA 96 N -0.29 -1.15 0.01 4.61 0.00 -1.14 -0.59 121.76 123.21 2sbl s ALA 96 Ca 0.00 -0.36 -0.25 0.00 0.00 0.00 0.00 51.96 51.35 2sbl s ALA 96 Cb 0.00 0.84 0.06 0.00 0.00 0.00 0.00 23.12 24.02 2sbl s ALA 96 CO 0.00 -1.03 0.56 -0.59 0.00 0.00 0.00 175.76 174.70 2sbl s PHE 97 N -3.77 -0.49 0.15 0.00 -0.71 0.03 -0.61 117.98 112.56 2sbl s PHE 97 Ca 0.12 0.70 -0.03 0.00 -1.04 0.00 0.00 56.93 56.67 2sbl s PHE 97 Cb -0.06 0.35 -0.05 0.00 -1.21 0.00 0.00 43.02 42.05 2sbl s PHE 97 CO 0.07 -0.61 0.35 0.71 -1.34 0.00 0.00 175.22 174.41 2sbl s TYR 98 N -1.88 3.48 -0.01 3.49 2.02 0.26 -1.02 117.35 123.69 2sbl s TYR 98 Ca -0.08 0.45 -0.00 0.00 -0.37 0.00 0.00 57.07 57.07 2sbl s TYR 98 Cb -0.01 -1.92 0.01 0.00 -0.40 0.00 0.00 41.96 39.64 2sbl s TYR 98 CO 0.03 0.44 0.01 -1.50 -1.57 0.00 0.00 175.55 172.96 2sbl s ILE 99 N -1.69 -0.02 -0.13 2.71 2.07 -0.90 -1.35 121.20 121.89 2sbl s ILE 99 Ca 0.39 0.07 0.02 0.00 -1.41 0.00 0.00 60.65 59.72 2sbl s ILE 99 Cb -0.12 -0.03 0.02 0.00 0.13 0.00 0.00 42.46 42.45 2sbl s ILE 99 CO 0.26 0.03 -0.16 -0.54 -1.91 0.00 0.00 174.94 172.62 2sbl s LYS 100 N 0.36 2.42 -0.36 3.50 1.02 0.20 -4.08 119.74 122.80 2sbl s LYS 100 Ca -0.03 -0.63 -0.12 0.00 0.02 0.00 0.00 55.97 55.21 2sbl s LYS 100 Cb -0.04 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 2sbl s LYS 100 CO -0.01 -0.10 0.23 1.21 -0.92 0.00 0.00 175.35 175.76 2sbl s ASN 101 N 1.08 5.90 0.00 2.83 2.47 -1.26 -1.23 114.94 124.73 2sbl s ASN 101 Ca -0.04 -0.66 0.24 0.00 0.42 0.00 0.00 52.86 52.83 2sbl s ASN 101 Cb -0.14 -2.09 0.41 0.00 -1.45 0.00 0.00 41.25 37.97 2sbl s ASN 101 CO -0.04 -0.30 1.34 -1.22 -3.72 0.00 0.00 177.10 173.15 2sbl n TYR 102 N 5.07 0.00 -1.63 0.43 4.01 0.47 -0.71 117.16 124.81 2sbl n TYR 102 Ca -0.12 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.30 2sbl n TYR 102 Cb 0.48 -0.16 0.05 0.00 -0.31 0.00 0.00 39.34 39.40 2sbl n TYR 102 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 2sbl s MET 103 N -2.85 2.79 0.28 -0.72 -1.94 -1.23 -4.94 119.30 110.68 2sbl s MET 103 Ca 0.14 1.18 0.26 0.00 -1.71 0.00 0.00 55.69 55.56 2sbl s MET 103 Cb 0.18 -1.96 0.85 0.00 2.01 0.00 0.00 34.83 35.90 2sbl s MET 103 CO 0.68 -1.24 1.75 0.37 -0.01 0.00 0.00 175.02 176.58 2sbl h GLN 104 N -0.39 0.00 -6.14 2.03 4.15 -1.97 -3.37 115.11 109.42 2sbl h GLN 104 Ca -0.45 0.00 -0.55 0.00 0.77 0.00 0.00 58.65 58.42 2sbl h GLN 104 Cb 1.23 0.00 -0.22 0.00 0.21 0.00 0.00 27.48 28.70 2sbl h GLN 104 CO 0.55 0.00 -0.83 0.08 -1.93 0.00 0.00 178.83 176.70 2sbl s VAL 105 N -3.22 1.70 0.70 2.39 1.01 -1.26 -4.79 120.40 116.92 2sbl s VAL 105 Ca 0.08 -1.54 -0.11 0.00 0.00 0.00 0.00 61.98 60.41 2sbl s VAL 105 Cb 0.10 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.95 2sbl s VAL 105 CO 0.54 -0.07 1.07 -1.61 0.00 0.00 0.00 175.10 175.04 2sbl s GLU 106 N -1.91 2.93 0.12 2.72 8.01 -1.26 -4.69 118.70 124.62 2sbl s GLU 106 Ca 0.06 0.69 -0.09 0.00 0.01 0.00 0.00 54.97 55.64 2sbl s GLU 106 Cb -0.10 -2.01 -0.01 0.00 -4.31 0.00 0.00 34.13 27.70 2sbl s GLU 106 CO 0.04 -1.04 0.23 -0.59 0.01 0.00 0.00 175.26 173.91 2sbl s PHE 107 N -3.20 0.27 -0.41 1.61 -0.12 -1.18 -3.86 117.98 111.09 2sbl s PHE 107 Ca 0.58 -0.67 -0.13 0.00 -0.05 0.00 0.00 56.93 56.65 2sbl s PHE 107 Cb -0.12 -0.07 0.04 0.00 -0.63 0.00 0.00 43.02 42.24 2sbl s PHE 107 CO 0.54 -0.62 0.29 0.12 -0.05 0.00 0.00 175.22 175.50 2sbl s PHE 108 N -3.91 3.25 -0.17 3.49 5.36 0.12 -1.62 117.98 124.50 2sbl s PHE 108 Ca 0.10 -0.87 -0.29 0.00 -0.96 0.00 0.00 56.93 54.91 2sbl s PHE 108 Cb 0.04 -2.71 -0.00 0.00 -0.34 0.00 0.00 43.02 40.01 2sbl s PHE 108 CO -0.06 -0.68 1.04 -1.17 -1.46 0.00 0.00 175.22 172.89 2sbl s LEU 109 N 1.61 4.17 -0.18 6.12 2.96 0.13 -1.06 118.68 132.42 2sbl s LEU 109 Ca 0.04 1.46 -0.17 0.00 -0.22 0.00 0.00 54.13 55.24 2sbl s LEU 109 Cb -0.21 -3.55 -0.13 0.00 0.50 0.00 0.00 46.19 42.81 2sbl s LEU 109 CO 0.07 -0.58 0.07 0.11 -1.32 0.00 0.00 176.35 174.70 2sbl h LYS 110 N 7.33 0.00 -2.67 1.98 1.57 -1.46 0.49 116.57 123.81 2sbl h LYS 110 Ca -0.24 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.66 2sbl h LYS 110 Cb 1.10 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.34 2sbl h LYS 110 CO 0.93 0.61 0.36 -1.54 -0.57 0.00 0.00 179.45 179.23 2sbl s SER 111 N -6.41 -0.22 -0.02 0.86 1.04 -1.16 -0.29 113.70 107.51 2sbl s SER 111 Ca -0.23 -0.50 0.01 0.00 0.48 0.00 0.00 55.95 55.71 2sbl s SER 111 Cb 0.04 0.61 0.01 0.00 0.10 0.00 0.00 66.02 66.78 2sbl s SER 111 CO 0.44 -1.12 -0.02 -0.22 0.98 0.00 0.00 173.24 173.30 2sbl s LEU 112 N -2.93 1.58 -0.07 2.42 2.96 -0.80 -1.38 118.68 120.46 2sbl s LEU 112 Ca 0.12 -0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.01 2sbl s LEU 112 Cb -0.04 -0.22 0.00 0.00 0.50 0.00 0.00 46.19 46.44 2sbl s LEU 112 CO 0.04 -0.03 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.97 2sbl s THR 113 N 0.49 1.62 -0.15 3.68 2.01 -0.20 -1.42 115.64 121.67 2sbl s THR 113 Ca -0.05 -0.79 -0.02 0.00 0.31 0.00 0.00 61.69 61.14 2sbl s THR 113 Cb -0.08 -1.41 -0.02 0.00 0.01 0.00 0.00 72.50 71.00 2sbl s THR 113 CO -0.01 0.46 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.54 2sbl s LEU 114 N 0.28 2.92 -0.03 4.42 1.02 0.06 -1.12 118.68 126.23 2sbl s LEU 114 Ca -0.12 -0.27 -0.00 0.00 0.02 0.00 0.00 54.13 53.76 2sbl s LEU 114 Cb -0.15 -1.69 0.01 0.00 0.02 0.00 0.00 46.19 44.38 2sbl s LEU 114 CO 0.05 0.14 2.08 -0.62 0.02 0.00 0.00 176.35 178.02 2sbl n GLU 115 N 3.72 1.13 -2.02 1.70 -0.58 -0.39 -0.65 120.64 123.56 2sbl n GLU 115 Ca -0.18 -0.20 -0.11 0.00 -0.42 0.00 0.00 57.16 56.25 2sbl n GLU 115 Cb 0.52 -1.11 0.04 0.00 -0.57 0.00 0.00 31.44 30.33 2sbl n GLU 115 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2sbl n ALA 116 N 1.43 0.59 -0.12 0.62 0.00 -1.26 -4.78 120.51 116.99 2sbl n ALA 116 Ca 0.05 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.35 2sbl n ALA 116 Cb 0.53 0.29 0.00 0.00 0.00 0.00 0.00 19.45 20.27 2sbl n ALA 116 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2sbl n ILE 117 N -1.77 0.00 -2.75 0.00 2.08 -1.26 -4.39 119.36 111.27 2sbl n ILE 117 Ca 0.09 0.00 -0.32 0.00 0.56 0.00 0.00 62.75 63.08 2sbl n ILE 117 Cb 0.33 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 39.17 2sbl n ILE 117 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2sbl s THR 122 N 0.00 4.62 -0.09 1.39 -1.32 -1.26 -5.28 115.64 113.70 2sbl s THR 122 Ca 0.00 1.01 0.03 0.00 -1.21 0.00 0.00 61.69 61.52 2sbl s THR 122 Cb 0.00 -3.68 0.01 0.00 -1.51 0.00 0.00 72.50 67.31 2sbl s THR 122 CO 0.00 -0.48 -0.17 -0.63 -2.21 0.00 0.00 174.62 171.13 2sbl s ILE 123 N -2.35 1.54 -0.10 5.08 1.01 0.18 -4.96 121.20 121.59 2sbl s ILE 123 Ca 0.56 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.52 2sbl s ILE 123 Cb -0.10 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 2sbl s ILE 123 CO 0.26 0.45 -0.16 -0.13 0.00 0.00 0.00 174.94 175.35 2sbl s ARG 124 N 0.62 3.09 -0.24 2.79 0.52 -1.26 -0.76 118.95 123.70 2sbl s ARG 124 Ca -0.14 -0.74 -0.00 0.00 -0.52 0.00 0.00 55.73 54.33 2sbl s ARG 124 Cb -0.16 -2.49 0.03 0.00 0.52 0.00 0.00 34.95 32.85 2sbl s ARG 124 CO 0.04 0.31 -0.09 -0.06 0.02 0.00 0.00 175.30 175.52 2sbl s PHE 125 N 0.09 3.06 -0.46 -0.53 0.40 -0.51 -1.00 117.98 119.03 2sbl s PHE 125 Ca -0.07 -1.71 -0.15 0.00 -0.60 0.00 0.00 56.93 54.40 2sbl s PHE 125 Cb -0.15 -2.02 0.07 0.00 0.51 0.00 0.00 43.02 41.43 2sbl s PHE 125 CO 0.05 -0.77 0.37 0.08 0.70 0.00 0.00 175.22 175.65 2sbl s VAL 126 N 1.28 5.15 -0.16 -0.44 1.01 -1.26 -1.90 120.40 124.08 2sbl s VAL 126 Ca -0.01 -1.05 -0.13 0.00 0.00 0.00 0.00 61.98 60.79 2sbl s VAL 126 Cb -0.17 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 2sbl s VAL 126 CO -0.06 -0.54 -0.25 0.00 0.00 0.00 0.00 175.10 174.25 2sbl n ASN 128 N -4.54 -4.91 -3.77 0.00 3.02 -0.46 -4.97 115.26 99.63 2sbl n ASN 128 Ca -0.11 -1.08 -0.13 0.00 -0.03 0.00 0.00 54.58 53.23 2sbl n ASN 128 Cb 0.39 -2.51 -0.11 0.00 -0.61 0.00 0.00 39.78 36.94 2sbl n ASN 128 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2sbl s SER 129 N -3.39 -0.30 0.12 6.41 0.15 0.04 -4.97 113.70 111.76 2sbl s SER 129 Ca 0.39 0.55 -0.30 0.00 0.70 0.00 0.00 55.95 57.29 2sbl s SER 129 Cb -0.18 0.59 -0.06 0.00 -1.71 0.00 0.00 66.02 64.66 2sbl s SER 129 CO 0.91 -0.14 1.03 0.26 1.20 0.00 0.00 173.24 176.50 2sbl s TRP 130 N -0.00 3.69 -0.16 3.44 0.52 -1.26 -0.70 118.94 124.47 2sbl s TRP 130 Ca -0.01 1.67 0.00 0.00 0.02 0.00 0.00 56.10 57.78 2sbl s TRP 130 Cb -0.03 -3.17 0.03 0.00 -1.15 0.00 0.00 33.47 29.15 2sbl s TRP 130 CO 0.01 -0.24 -0.10 0.14 0.02 0.00 0.00 176.95 176.78 2sbl s VAL 131 N 0.09 1.40 0.82 4.03 -7.23 -0.64 -4.92 120.40 113.95 2sbl s VAL 131 Ca 0.49 -0.64 -0.10 0.00 -1.81 0.00 0.00 61.98 59.92 2sbl s VAL 131 Cb -0.26 -1.41 0.13 0.00 0.56 0.00 0.00 36.38 35.41 2sbl s VAL 131 CO 0.31 0.32 1.15 -0.31 -0.31 0.00 0.00 175.10 176.27 2sbl s TYR 132 N 1.54 2.08 0.24 2.82 1.51 -1.26 -3.09 117.35 121.19 2sbl s TYR 132 Ca 0.03 0.26 -0.31 0.00 -1.01 0.00 0.00 57.07 56.04 2sbl s TYR 132 Cb -0.14 -3.56 -0.14 0.00 -0.11 0.00 0.00 41.96 38.02 2sbl s TYR 132 CO -0.09 -2.02 1.37 -1.71 -1.11 0.00 0.00 175.55 171.99 2sbl n ASN 133 N -3.29 2.59 -0.33 2.29 2.85 -1.26 -4.51 115.26 113.60 2sbl n ASN 133 Ca 0.13 1.15 0.12 0.00 -0.11 0.00 0.00 54.58 55.86 2sbl n ASN 133 Cb 0.60 -1.41 0.25 0.00 1.24 0.00 0.00 39.78 40.46 2sbl n ASN 133 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 2sbl n THR 134 N 1.76 -0.40 0.34 -0.44 -1.04 0.11 -1.07 114.28 113.54 2sbl n THR 134 Ca 0.12 2.11 0.04 0.00 -2.04 0.00 0.00 64.05 64.27 2sbl n THR 134 Cb 0.31 -3.04 0.19 0.00 -1.82 0.00 0.00 70.33 65.96 2sbl n THR 134 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2sbl n LYS 135 N -5.44 0.08 -0.03 -2.82 5.02 -1.26 -0.89 118.16 112.81 2sbl n LYS 135 Ca 0.21 0.26 0.13 0.00 -2.02 0.00 0.00 58.31 56.88 2sbl n LYS 135 Cb 0.68 -1.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.57 2sbl n LYS 135 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2sbl n LEU 136 N -1.35 2.00 -4.39 -0.35 4.77 -0.23 -4.91 117.00 112.54 2sbl n LEU 136 Ca 0.03 -0.72 -0.31 0.00 -0.03 0.00 0.00 56.01 54.98 2sbl n LEU 136 Cb 0.07 -0.04 -0.15 0.00 -2.33 0.00 0.00 43.42 40.98 2sbl n LEU 136 CO 0.06 0.36 -0.52 -0.31 -1.33 0.00 0.00 177.39 175.65 2sbl s TYR 137 N -1.92 2.48 0.08 -1.77 2.02 -0.07 -5.00 117.35 113.16 2sbl s TYR 137 Ca 0.35 -0.32 -0.08 0.00 -0.37 0.00 0.00 57.07 56.64 2sbl s TYR 137 Cb 0.20 -1.52 -0.23 0.00 -0.40 0.00 0.00 41.96 40.00 2sbl s TYR 137 CO 0.31 0.09 1.17 0.87 -1.57 0.00 0.00 175.55 176.42 2sbl h LYS 138 N 5.24 0.42 -6.46 -0.62 1.79 -1.91 -3.45 116.57 111.59 2sbl h LYS 138 Ca -0.45 -0.59 -0.68 0.00 -2.18 0.00 0.00 60.65 56.75 2sbl h LYS 138 Cb 1.14 0.20 -0.19 0.00 -1.58 0.00 0.00 32.23 31.79 2sbl h LYS 138 CO 0.48 1.25 -0.76 -1.12 -1.08 0.00 0.00 179.45 178.22 2sbl s SER 139 N -7.24 4.20 0.26 0.86 0.01 -1.26 -5.10 113.70 105.43 2sbl s SER 139 Ca -0.06 -0.31 -0.30 0.00 1.31 0.00 0.00 55.95 56.59 2sbl s SER 139 Cb 0.07 -0.82 -0.09 0.00 0.21 0.00 0.00 66.02 65.39 2sbl s SER 139 CO 0.90 0.25 1.10 0.54 0.41 0.00 0.00 173.24 176.44 2sbl s VAL 140 N -0.99 3.56 0.27 3.43 0.11 -1.26 -4.96 120.40 120.56 2sbl s VAL 140 Ca 0.17 1.52 -0.30 0.00 -2.93 0.00 0.00 61.98 60.44 2sbl s VAL 140 Cb -0.11 -3.97 -0.10 0.00 -1.53 0.00 0.00 36.38 30.67 2sbl s VAL 140 CO 0.07 0.34 1.45 -0.13 -3.33 0.00 0.00 175.10 173.51 2sbl s ARG 141 N -1.20 4.25 0.01 1.54 1.81 -1.26 -4.94 118.95 119.16 2sbl s ARG 141 Ca 0.46 2.34 0.06 0.00 -1.72 0.00 0.00 55.73 56.87 2sbl s ARG 141 Cb -0.31 -3.09 -0.02 0.00 -0.45 0.00 0.00 34.95 31.08 2sbl s ARG 141 CO 0.40 -0.44 -0.17 -1.50 -0.68 0.00 0.00 175.30 172.91 2sbl s ILE 142 N -0.13 1.39 0.10 1.52 2.07 -1.26 -2.13 121.20 122.75 2sbl s ILE 142 Ca 0.59 -0.87 0.07 0.00 -1.41 0.00 0.00 60.65 59.02 2sbl s ILE 142 Cb -0.43 -1.18 -0.03 0.00 0.13 0.00 0.00 42.46 40.95 2sbl s ILE 142 CO 0.45 0.29 -0.17 -0.36 -1.91 0.00 0.00 174.94 173.24 2sbl s PHE 143 N -0.55 1.51 0.32 3.50 0.08 -0.19 -4.98 117.98 117.67 2sbl s PHE 143 Ca 0.06 -0.46 0.10 0.00 0.12 0.00 0.00 56.93 56.75 2sbl s PHE 143 Cb -0.07 -0.82 -0.06 0.00 -0.57 0.00 0.00 43.02 41.50 2sbl s PHE 143 CO 0.00 0.15 -0.11 -0.06 -0.10 0.00 0.00 175.22 175.10 2sbl s PHE 144 N -1.47 2.40 0.74 0.36 0.40 -1.26 -0.79 117.98 118.35 2sbl s PHE 144 Ca 0.05 -0.42 -0.11 0.00 -0.60 0.00 0.00 56.93 55.84 2sbl s PHE 144 Cb -0.09 -1.26 0.03 0.00 0.51 0.00 0.00 43.02 42.22 2sbl s PHE 144 CO 0.03 0.62 1.09 0.00 0.70 0.00 0.00 175.22 177.66 2sbl s ALA 145 N -2.55 2.61 0.00 5.36 0.00 0.24 -4.41 121.76 123.02 2sbl s ALA 145 Ca 0.32 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2sbl s ALA 145 Cb -0.01 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2sbl s ALA 145 CO 0.17 -1.36 0.93 0.27 0.00 0.00 0.00 175.76 175.77 2sbl n ASN 146 N -3.18 2.63 -4.84 0.00 6.94 -0.17 -4.83 115.26 111.81 2sbl n ASN 146 Ca 0.07 -1.58 -0.36 0.00 -0.02 0.00 0.00 54.58 52.70 2sbl n ASN 146 Cb 0.56 -0.50 -0.06 0.00 -2.36 0.00 0.00 39.78 37.42 2sbl n ASN 146 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 2sbl s HIS 147 N 0.45 3.62 -0.15 -2.53 3.76 -1.26 -1.08 115.29 118.10 2sbl s HIS 147 Ca 0.00 1.06 -0.07 0.00 -0.15 0.00 0.00 55.06 55.90 2sbl s HIS 147 Cb 0.00 -2.36 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 2sbl s HIS 147 CO 0.00 0.45 0.07 0.99 -0.85 0.00 0.00 174.74 175.40 2sbl s THR 148 N -1.43 4.91 -0.10 1.30 2.01 -1.26 -4.71 115.64 116.36 2sbl s THR 148 Ca 0.37 -0.00 -0.05 0.00 0.31 0.00 0.00 61.69 62.32 2sbl s THR 148 Cb -0.15 -3.18 0.05 0.00 0.01 0.00 0.00 72.50 69.23 2sbl s THR 148 CO 0.19 0.52 0.22 -0.31 -0.69 0.00 0.00 174.62 174.55 2sbl s TYR 149 N -0.13 -0.31 0.77 4.92 2.02 0.37 -4.95 117.35 120.04 2sbl s TYR 149 Ca 0.08 0.76 -0.11 0.00 -0.37 0.00 0.00 57.07 57.43 2sbl s TYR 149 Cb -0.12 -0.02 0.06 0.00 -0.40 0.00 0.00 41.96 41.48 2sbl s TYR 149 CO 0.01 -0.25 1.09 0.14 -1.57 0.00 0.00 175.55 174.97 2sbl s VAL 150 N 1.56 3.36 0.28 0.71 -7.23 -1.26 -3.94 120.40 113.87 2sbl s VAL 150 Ca -0.06 0.44 -0.00 0.00 -1.81 0.00 0.00 61.98 60.55 2sbl s VAL 150 Cb -0.11 -2.94 0.30 0.00 0.56 0.00 0.00 36.38 34.19 2sbl s VAL 150 CO -0.08 -0.58 1.65 -0.65 -0.31 0.00 0.00 175.10 175.14 2sbl h PRO 151 N -1.11 0.21 0.00 4.82 0.11 -1.96 -1.14 132.00 132.93 2sbl h PRO 151 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2sbl h PRO 151 Cb 1.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2sbl h PRO 151 CO 0.52 0.14 0.00 -1.13 -0.21 0.00 0.00 178.00 177.31 2sbl n SER 152 N -5.22 0.46 -0.98 -2.05 3.41 -1.26 -2.52 113.62 105.45 2sbl n SER 152 Ca 0.19 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.50 2sbl n SER 152 Cb 0.62 -0.69 0.13 0.00 -0.26 0.00 0.00 64.21 64.01 2sbl n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2sbl n GLU 153 N -1.98 2.28 -1.83 4.33 -0.58 -0.43 -4.98 120.64 117.45 2sbl n GLU 153 Ca 0.04 -1.99 -0.41 0.00 -0.42 0.00 0.00 57.16 54.37 2sbl n GLU 153 Cb 0.28 -1.46 -0.02 0.00 -0.57 0.00 0.00 31.44 29.67 2sbl n GLU 153 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2sbl s THR 154 N -1.77 2.18 -0.03 2.62 2.01 -1.05 -4.89 115.64 114.72 2sbl s THR 154 Ca 0.30 0.16 -0.36 0.00 0.31 0.00 0.00 61.69 62.10 2sbl s THR 154 Cb 0.20 -3.10 -0.14 0.00 0.01 0.00 0.00 72.50 69.47 2sbl s THR 154 CO 0.29 0.03 1.64 -2.65 -0.69 0.00 0.00 174.62 173.24 2sbl n PRO 155 N 1.96 1.66 -0.35 4.92 -0.02 -1.26 -4.85 135.00 137.07 2sbl n PRO 155 Ca 0.07 0.60 0.17 0.00 -2.02 0.00 0.00 63.50 62.32 2sbl n PRO 155 Cb 0.38 -2.34 0.37 0.00 -0.02 0.00 0.00 33.50 31.90 2sbl n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2sbl h ALA 156 N 6.75 1.78 -0.49 3.55 0.00 -1.92 0.72 119.26 129.66 2sbl h ALA 156 Ca -0.47 0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.67 2sbl h ALA 156 Cb 1.29 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2sbl h ALA 156 CO 0.89 -0.23 0.35 -1.35 0.00 0.00 0.00 179.25 178.91 2sbl h PRO 157 N 0.62 0.10 0.00 0.00 0.11 -1.76 -2.02 132.00 129.06 2sbl h PRO 157 Ca 0.62 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.73 2sbl h PRO 157 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2sbl h PRO 157 CO -0.44 0.07 -0.50 1.28 -0.21 0.00 0.00 178.00 178.19 2sbl n LEU 158 N -4.42 0.64 -0.14 2.35 4.32 0.23 -1.54 117.00 118.45 2sbl n LEU 158 Ca 0.08 0.25 -0.06 0.00 -0.02 0.00 0.00 56.01 56.26 2sbl n LEU 158 Cb 0.49 -0.23 0.03 0.00 -1.62 0.00 0.00 43.42 42.10 2sbl n LEU 158 CO 0.36 -0.04 0.99 0.58 -1.22 0.00 0.00 177.39 178.06 2sbl h VAL 159 N 0.00 0.96 -0.15 4.08 2.07 -1.16 -0.99 116.25 121.06 2sbl h VAL 159 Ca 0.00 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2sbl h VAL 159 Cb 0.69 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 2sbl h VAL 159 CO 0.00 0.08 0.00 -1.28 0.02 0.00 0.00 177.57 176.39 2sbl h SER 160 N 0.42 -0.04 -0.80 0.57 0.87 -1.77 -2.36 113.55 110.45 2sbl h SER 160 Ca 0.19 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2sbl h SER 160 Cb 0.11 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.08 2sbl h SER 160 CO -0.14 -0.00 0.49 1.88 -0.53 0.00 0.00 176.83 178.53 2sbl h TYR 161 N 0.05 1.04 -0.20 2.24 0.05 -1.69 -1.26 116.97 117.21 2sbl h TYR 161 Ca 0.07 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.88 2sbl h TYR 161 Cb 0.08 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.45 2sbl h TYR 161 CO -0.15 0.69 0.03 -0.09 -1.05 0.00 0.00 178.16 177.59 2sbl h ARG 162 N 1.09 0.11 -0.25 4.88 2.43 -0.92 -2.34 114.38 119.37 2sbl h ARG 162 Ca 0.29 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.42 2sbl h ARG 162 Cb -0.06 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2sbl h ARG 162 CO -0.06 0.07 0.04 0.93 -1.51 0.00 0.00 179.97 179.44 2sbl h GLU 163 N 0.11 0.42 -0.85 0.20 5.08 -0.89 -2.72 114.58 115.93 2sbl h GLU 163 Ca 0.09 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2sbl h GLU 163 Cb 0.09 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 2sbl h GLU 163 CO -0.12 0.55 0.42 0.93 -1.00 0.00 0.00 179.01 179.78 2sbl h GLU 164 N 0.23 1.21 -0.35 2.33 5.08 -1.23 -1.91 114.58 119.93 2sbl h GLU 164 Ca 0.08 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2sbl h GLU 164 Cb 0.33 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2sbl h GLU 164 CO 0.01 0.92 0.06 1.49 -1.00 0.00 0.00 179.01 180.48 2sbl h GLU 165 N 1.20 0.58 -0.31 2.33 4.57 -1.37 -1.17 114.58 120.40 2sbl h GLU 165 Ca 0.29 -0.16 0.04 0.00 -1.18 0.00 0.00 59.36 58.36 2sbl h GLU 165 Cb 0.09 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 2sbl h GLU 165 CO -0.04 0.66 0.07 -0.07 -1.18 0.00 0.00 179.01 178.44 2sbl h LEU 166 N 0.42 0.03 -0.88 1.64 3.38 -1.15 -1.85 115.31 116.89 2sbl h LEU 166 Ca 0.11 0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.25 2sbl h LEU 166 Cb 0.36 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.08 2sbl h LEU 166 CO 0.01 0.05 0.50 0.11 0.09 0.00 0.00 178.44 179.20 2sbl h LYS 167 N 0.18 0.75 -0.66 1.13 1.79 -1.06 -1.99 116.57 116.72 2sbl h LYS 167 Ca 0.15 -0.05 0.02 0.00 -2.18 0.00 0.00 60.65 58.59 2sbl h LYS 167 Cb 0.15 -0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.59 2sbl h LYS 167 CO -0.19 0.50 0.41 0.77 -1.08 0.00 0.00 179.45 179.86 2sbl h SER 168 N 0.77 0.68 0.53 0.86 0.02 -0.38 -2.12 113.55 113.91 2sbl h SER 168 Ca 0.45 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 2sbl h SER 168 Cb 0.52 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2sbl h SER 168 CO -0.30 0.48 0.00 -0.07 -1.14 0.00 0.00 176.83 175.80 2sbl h LEU 169 N 0.82 0.00 0.19 5.07 3.38 -1.03 -3.18 115.31 120.56 2sbl h LEU 169 Ca 0.26 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.93 2sbl h LEU 169 Cb -0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 2sbl h LEU 169 CO -0.09 0.00 -1.36 0.03 0.09 0.00 0.00 178.44 177.10 2sbl h ARG 170 N 0.00 0.41 0.00 1.13 3.08 -1.32 0.12 114.38 117.80 2sbl h ARG 170 Ca 0.00 -0.70 0.18 0.00 0.07 0.00 0.00 59.98 59.53 2sbl h ARG 170 Cb 0.27 0.26 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 2sbl h ARG 170 CO 0.00 1.34 -0.24 0.41 -1.07 0.00 0.00 179.97 180.41 2sbl n GLY 171 N 1.74 -2.02 1.10 0.04 0.00 -1.20 -4.43 105.19 100.42 2sbl n GLY 171 Ca -0.19 -1.33 0.08 0.00 0.00 0.00 0.00 46.02 44.58 2sbl n GLY 171 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2sbl n ASN 172 N -2.50 3.92 0.00 1.61 2.85 -1.26 -4.95 115.26 114.93 2sbl n ASN 172 Ca 0.00 -2.42 0.00 0.00 -0.11 0.00 0.00 54.58 52.06 2sbl n ASN 172 Cb 0.30 -0.45 0.00 0.00 1.24 0.00 0.00 39.78 40.87 2sbl n ASN 172 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2sbl n GLY 173 N 0.55 2.66 3.79 8.20 0.00 -1.26 -5.01 105.19 114.11 2sbl n GLY 173 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 2sbl n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2sbl s THR 174 N -2.17 2.80 0.00 2.61 -4.23 -1.26 -5.09 115.64 108.30 2sbl s THR 174 Ca 0.00 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 2sbl s THR 174 Cb 0.00 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.83 2sbl s THR 174 CO 0.00 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2sbl n GLY 175 N -1.30 1.56 3.69 3.99 0.00 -1.26 -4.96 105.19 106.91 2sbl n GLY 175 Ca -0.01 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 2sbl n GLY 175 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2sbl s GLU 176 N -3.89 4.37 -0.06 1.61 2.12 -1.25 -4.46 118.70 117.15 2sbl s GLU 176 Ca 0.00 0.95 -0.30 0.00 0.36 0.00 0.00 54.97 55.98 2sbl s GLU 176 Cb 0.00 -3.51 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 2sbl s GLU 176 CO 0.00 -0.13 1.09 1.03 -0.54 0.00 0.00 175.26 176.71 2sbl s ARG 177 N 1.46 4.42 0.40 4.30 1.81 -0.46 -5.02 118.95 125.86 2sbl s ARG 177 Ca 0.38 1.54 -0.02 0.00 -1.72 0.00 0.00 55.73 55.91 2sbl s ARG 177 Cb -0.17 -3.52 -0.04 0.00 -0.45 0.00 0.00 34.95 30.78 2sbl s ARG 177 CO 0.16 -0.32 0.64 0.15 -0.68 0.00 0.00 175.30 175.25 2sbl s LYS 178 N 1.85 3.51 0.29 3.54 -0.14 -1.26 -4.92 119.74 122.62 2sbl s LYS 178 Ca 0.53 -0.11 0.04 0.00 -1.36 0.00 0.00 55.97 55.07 2sbl s LYS 178 Cb -0.22 -2.55 0.76 0.00 -1.68 0.00 0.00 37.83 34.13 2sbl s LYS 178 CO 0.22 0.02 1.68 1.49 -0.76 0.00 0.00 175.35 178.00 2sbl h GLU 179 N 0.60 0.35 -0.05 1.68 4.81 -1.95 -1.85 114.58 118.16 2sbl h GLU 179 Ca -0.49 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2sbl h GLU 179 Cb 1.21 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.51 2sbl h GLU 179 CO 0.62 0.23 0.00 2.48 -0.73 0.00 0.00 179.01 181.61 2sbl n TYR 180 N -5.08 0.06 -2.60 0.92 0.18 -1.26 -4.21 117.16 105.18 2sbl n TYR 180 Ca 0.23 -0.03 -0.37 0.00 1.88 0.00 0.00 57.90 59.60 2sbl n TYR 180 Cb 0.69 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.60 2sbl n TYR 180 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2sbl s ASP 181 N -1.84 7.03 -0.41 9.48 1.01 -0.70 -4.77 116.67 126.48 2sbl s ASP 181 Ca 0.37 2.03 0.04 0.00 0.71 0.00 0.00 52.55 55.70 2sbl s ASP 181 Cb 0.19 -2.59 0.45 0.00 1.01 0.00 0.00 42.92 41.98 2sbl s ASP 181 CO 0.31 -0.30 1.41 0.54 0.21 0.00 0.00 175.17 177.34 2sbl n ARG 182 N 0.38 3.36 -4.05 8.23 1.74 -1.26 -0.76 116.66 124.30 2sbl n ARG 182 Ca 0.03 -3.97 -0.35 0.00 -0.77 0.00 0.00 57.85 52.79 2sbl n ARG 182 Cb 0.49 -2.28 -0.09 0.00 -1.02 0.00 0.00 32.46 29.55 2sbl n ARG 182 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2sbl s ILE 183 N -4.73 4.79 -0.17 0.55 1.01 -1.26 -4.52 121.20 116.87 2sbl s ILE 183 Ca 0.54 -0.04 -0.03 0.00 0.00 0.00 0.00 60.65 61.12 2sbl s ILE 183 Cb 0.43 -3.13 -0.02 0.00 0.01 0.00 0.00 42.46 39.75 2sbl s ILE 183 CO 0.00 0.50 -0.05 -0.31 0.00 0.00 0.00 174.94 175.07 2sbl s TYR 184 N 0.07 2.97 0.31 3.97 1.51 0.41 -4.55 117.35 122.04 2sbl s TYR 184 Ca 0.05 -0.51 -0.17 0.00 -1.01 0.00 0.00 57.07 55.44 2sbl s TYR 184 Cb -0.12 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.77 2sbl s TYR 184 CO 0.01 -0.20 0.68 0.34 -1.11 0.00 0.00 175.55 175.27 2sbl s ASP 185 N 0.66 -0.07 0.04 2.29 -1.08 -1.26 -4.57 116.67 112.67 2sbl s ASP 185 Ca -0.03 -0.89 0.03 0.00 -0.52 0.00 0.00 52.55 51.14 2sbl s ASP 185 Cb -0.15 0.74 -0.04 0.00 -1.46 0.00 0.00 42.92 42.01 2sbl s ASP 185 CO 0.02 -1.41 -0.01 -0.31 0.52 0.00 0.00 175.17 173.98 2sbl s TYR 186 N -3.40 3.01 0.18 -5.34 1.51 -1.26 -0.90 117.35 111.15 2sbl s TYR 186 Ca 0.16 0.02 -0.09 0.00 -1.01 0.00 0.00 57.07 56.15 2sbl s TYR 186 Cb -0.04 -1.60 -0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2sbl s TYR 186 CO 0.10 0.46 0.30 0.34 -1.11 0.00 0.00 175.55 175.64 2sbl s ASP 187 N -1.86 0.03 0.57 2.29 -1.08 0.38 -4.50 116.67 112.48 2sbl s ASP 187 Ca 0.22 -0.93 -0.09 0.00 -0.52 0.00 0.00 52.55 51.23 2sbl s ASP 187 Cb -0.12 0.46 -0.04 0.00 -1.46 0.00 0.00 42.92 41.76 2sbl s ASP 187 CO 0.13 -0.93 0.93 -0.69 0.52 0.00 0.00 175.17 175.13 2sbl s VAL 188 N -4.00 4.79 -1.34 1.11 1.01 -1.26 -1.31 120.40 119.39 2sbl s VAL 188 Ca 0.20 0.61 -0.15 0.00 0.00 0.00 0.00 61.98 62.64 2sbl s VAL 188 Cb 0.03 -3.87 0.08 0.00 0.00 0.00 0.00 36.38 32.62 2sbl s VAL 188 CO 0.03 -1.03 1.89 -1.22 0.00 0.00 0.00 175.10 174.77 2sbl n TYR 189 N -2.56 4.12 -0.77 5.22 4.02 -0.59 -4.53 117.16 122.07 2sbl n TYR 189 Ca 0.04 -2.95 0.08 0.00 -0.01 0.00 0.00 57.90 55.06 2sbl n TYR 189 Cb 0.54 -2.48 0.23 0.00 -0.02 0.00 0.00 39.34 37.61 2sbl n TYR 189 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2sbl n ASN 190 N 6.73 3.57 -0.33 7.72 6.94 -1.26 -2.45 115.26 136.19 2sbl n ASN 190 Ca 0.47 -2.74 0.03 0.00 -0.02 0.00 0.00 54.58 52.32 2sbl n ASN 190 Cb 0.42 -0.45 0.07 0.00 -2.36 0.00 0.00 39.78 37.46 2sbl n ASN 190 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2sbl n ASP 191 N -0.27 2.31 0.02 0.53 5.75 -1.26 -0.80 116.55 122.83 2sbl n ASP 191 Ca 0.18 -1.86 -0.05 0.00 -0.01 0.00 0.00 54.79 53.05 2sbl n ASP 191 Cb 0.76 -0.10 -0.11 0.00 -1.03 0.00 0.00 41.12 40.64 2sbl n ASP 191 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2sbl h LEU 192 N 1.13 0.00-10.38 -2.12 4.07 -1.86 -3.47 115.31 102.67 2sbl h LEU 192 Ca 0.00 0.00 -0.50 0.00 0.08 0.00 0.00 57.88 57.46 2sbl h LEU 192 Cb 0.55 0.00 0.06 0.00 1.08 0.00 0.00 40.66 42.36 2sbl h LEU 192 CO 0.00 0.86 0.40 -0.83 -1.08 0.00 0.00 178.44 177.79 2sbl s GLY 193 N -4.90 1.65 -0.48 0.83 0.00 -1.26 -0.79 107.32 102.36 2sbl s GLY 193 Ca -0.02 -0.17 0.08 0.00 0.00 0.00 0.00 44.72 44.61 2sbl s GLY 193 CO 0.81 0.12 0.69 -2.01 0.00 0.00 0.00 173.10 172.71 2sbl n ASN 194 N -2.79 1.91 0.13 1.64 4.05 0.48 -4.89 115.26 115.79 2sbl n ASN 194 Ca 0.06 -3.11 0.03 0.00 0.45 0.00 0.00 54.58 52.01 2sbl n ASN 194 Cb 0.55 -0.63 0.42 0.00 1.23 0.00 0.00 39.78 41.34 2sbl n ASN 194 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 2sbl h PRO 195 N 3.70 0.22 0.00 1.20 0.11 -1.74 -0.99 132.00 134.50 2sbl h PRO 195 Ca 0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2sbl h PRO 195 Cb 0.78 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2sbl h PRO 195 CO 0.62 0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 178.50 2sbl n ASP 196 N -4.31 0.73 0.02 -2.05 8.00 -1.26 -3.35 116.55 114.33 2sbl n ASP 196 Ca -0.01 0.60 -0.17 0.00 0.71 0.00 0.00 54.79 55.92 2sbl n ASP 196 Cb 0.24 -0.79 -0.14 0.00 -0.02 0.00 0.00 41.12 40.41 2sbl n ASP 196 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2sbl h LYS 197 N 0.00 0.20 -1.40 -1.24 3.64 -1.61 -3.49 116.57 112.67 2sbl h LYS 197 Ca 0.00 -0.35 0.12 0.00 -1.27 0.00 0.00 60.65 59.15 2sbl h LYS 197 Cb 0.60 0.13 -0.27 0.00 -0.41 0.00 0.00 32.23 32.28 2sbl h LYS 197 CO 0.00 1.02 0.63 0.45 -2.27 0.00 0.00 179.45 179.28 2sbl s SER 198 N -6.80 -0.29 0.53 4.20 0.15 -1.09 -5.01 113.70 105.38 2sbl s SER 198 Ca -0.15 0.48 0.33 0.00 0.70 0.00 0.00 55.95 57.32 2sbl s SER 198 Cb 0.07 0.46 1.37 0.00 -1.71 0.00 0.00 66.02 66.22 2sbl s SER 198 CO 0.81 -0.15 1.97 -0.33 1.20 0.00 0.00 173.24 176.74 2sbl h GLU 199 N 3.32 0.00 0.00 5.44 4.39 -1.84 -0.91 114.58 124.98 2sbl h GLU 199 Ca -0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2sbl h GLU 199 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2sbl h GLU 199 CO 0.19 0.00 0.00 0.87 -1.16 0.00 0.00 179.01 178.91 2sbl h LYS 200 N 0.00 0.00 -0.68 2.33 1.79 -1.92 -1.59 116.57 116.50 2sbl h LYS 200 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2sbl h LYS 200 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2sbl h LYS 200 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 2sbl n LEU 201 N -2.49 4.69 -4.77 2.94 4.77 -0.35 -4.94 117.00 116.85 2sbl n LEU 201 Ca 0.01 -2.38 -0.38 0.00 -0.03 0.00 0.00 56.01 53.23 2sbl n LEU 201 Cb 0.19 -0.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.66 2sbl n LEU 201 CO 0.19 0.85 0.71 0.00 -1.33 0.00 0.00 177.39 177.81 2sbl s ALA 202 N -1.71 3.22 0.04 -1.18 0.00 -0.60 -0.39 121.76 121.14 2sbl s ALA 202 Ca 0.52 0.67 0.01 0.00 0.00 0.00 0.00 51.96 53.16 2sbl s ALA 202 Cb 0.32 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.17 2sbl s ALA 202 CO 0.27 -0.03 -0.05 1.03 0.00 0.00 0.00 175.76 176.98 2sbl s ARG 203 N -1.99 0.47 0.58 0.00 1.81 -1.26 -4.92 118.95 113.62 2sbl s ARG 203 Ca 0.51 -0.82 -0.20 0.00 -1.72 0.00 0.00 55.73 53.50 2sbl s ARG 203 Cb -0.23 -0.01 -0.04 0.00 -0.45 0.00 0.00 34.95 34.22 2sbl s ARG 203 CO 0.30 -0.03 1.25 -1.25 -0.68 0.00 0.00 175.30 174.88 2sbl s PRO 204 N -2.14 3.03 -0.29 3.54 0.04 -1.26 -4.81 135.00 133.12 2sbl s PRO 204 Ca -0.08 1.94 -0.28 0.00 0.04 0.00 0.00 61.00 62.62 2sbl s PRO 204 Cb -0.05 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.46 2sbl s PRO 204 CO -0.03 -1.19 1.02 0.08 0.04 0.00 0.00 177.00 176.93 2sbl s VAL 205 N -1.49 4.61 -0.24 -0.36 1.01 -1.26 -4.88 120.40 117.79 2sbl s VAL 205 Ca 0.75 1.76 -0.15 0.00 0.00 0.00 0.00 61.98 64.34 2sbl s VAL 205 Cb -0.33 -4.34 -0.04 0.00 0.00 0.00 0.00 36.38 31.67 2sbl s VAL 205 CO 0.37 -0.34 0.36 -0.76 0.00 0.00 0.00 175.10 174.74 2sbl s LEU 206 N 3.39 4.10 0.00 3.92 1.43 -1.03 -4.87 118.68 125.62 2sbl s LEU 206 Ca 0.43 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.91 2sbl s LEU 206 Cb -0.13 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2sbl s LEU 206 CO 0.12 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.20 2sbl n GLY 207 N 4.29 2.67 2.05 -3.19 0.00 0.21 -1.55 105.19 109.66 2sbl n GLY 207 Ca -0.09 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.11 2sbl n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sbl n GLY 208 N 0.78 0.79 3.26 -0.02 0.00 -1.26 -4.86 105.19 103.89 2sbl n GLY 208 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2sbl n GLY 208 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2sbl s SER 209 N -2.65 0.85 0.12 1.61 1.04 -1.24 -5.04 113.70 108.39 2sbl s SER 209 Ca 0.00 -1.47 0.17 0.00 0.48 0.00 0.00 55.95 55.13 2sbl s SER 209 Cb 0.00 0.36 -0.08 0.00 0.10 0.00 0.00 66.02 66.40 2sbl s SER 209 CO 0.00 -0.86 0.96 0.28 0.98 0.00 0.00 173.24 174.60 2sbl h SER 210 N 2.42 0.00 0.01 7.02 0.02 -1.96 -2.92 113.55 118.15 2sbl h SER 210 Ca -0.35 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2sbl h SER 210 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2sbl h SER 210 CO 0.52 0.50 -0.01 0.74 -1.14 0.00 0.00 176.83 177.44 2sbl h THR 211 N 0.00 1.17 -2.97 -2.27 2.02 -2.00 -3.37 112.91 105.48 2sbl h THR 211 Ca -0.12 -0.55 -0.62 0.00 0.77 0.00 0.00 66.41 65.89 2sbl h THR 211 Cb 1.48 1.54 -0.41 0.00 -1.74 0.00 0.00 68.15 69.02 2sbl h THR 211 CO 0.04 0.14 -0.64 -0.36 0.37 0.00 0.00 175.52 175.07 2sbl s PHE 212 N -5.24 3.13 0.41 3.16 0.08 -1.25 -4.88 117.98 113.39 2sbl s PHE 212 Ca -0.14 -3.16 -0.25 0.00 0.12 0.00 0.00 56.93 53.50 2sbl s PHE 212 Cb 0.04 -2.40 -0.08 0.00 -0.57 0.00 0.00 43.02 40.00 2sbl s PHE 212 CO 0.66 -0.60 1.17 -1.25 -0.10 0.00 0.00 175.22 175.10 2sbl s PRO 213 N -1.15 4.02 0.03 0.24 0.04 -1.10 -0.62 135.00 136.45 2sbl s PRO 213 Ca 0.26 1.83 -0.23 0.00 0.04 0.00 0.00 61.00 62.89 2sbl s PRO 213 Cb -0.04 -2.64 0.05 0.00 0.04 0.00 0.00 34.50 31.91 2sbl s PRO 213 CO -0.16 -0.35 0.53 -0.47 0.04 0.00 0.00 177.00 176.59 2sbl s TYR 214 N -1.44 -0.44 0.68 0.56 5.04 -1.26 -4.49 117.35 116.00 2sbl s TYR 214 Ca 0.58 0.55 -0.16 0.00 -2.44 0.00 0.00 57.07 55.60 2sbl s TYR 214 Cb -0.30 0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.35 2sbl s TYR 214 CO 0.38 -0.62 1.17 -1.25 -1.34 0.00 0.00 175.55 173.89 2sbl s PRO 215 N -2.19 2.54 0.61 4.97 0.04 -1.26 -4.66 135.00 135.05 2sbl s PRO 215 Ca -0.07 1.64 -0.08 0.00 0.04 0.00 0.00 61.00 62.53 2sbl s PRO 215 Cb -0.01 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.63 2sbl s PRO 215 CO 0.00 -1.50 0.96 1.03 0.04 0.00 0.00 177.00 177.53 2sbl s ARG 216 N -3.85 3.16 0.42 4.56 1.81 -0.48 -4.77 118.95 119.80 2sbl s ARG 216 Ca 0.72 0.31 0.04 0.00 -1.72 0.00 0.00 55.73 55.09 2sbl s ARG 216 Cb -0.26 -2.18 -0.05 0.00 -0.45 0.00 0.00 34.95 32.00 2sbl s ARG 216 CO 0.41 -0.67 0.03 -0.98 -0.68 0.00 0.00 175.30 173.42 2sbl s ARG 217 N -5.08 1.96 0.22 3.54 1.04 -0.43 -4.03 118.95 116.18 2sbl s ARG 217 Ca 0.54 -2.17 -0.30 0.00 -1.04 0.00 0.00 55.73 52.77 2sbl s ARG 217 Cb -0.11 -1.30 -0.09 0.00 -2.04 0.00 0.00 34.95 31.42 2sbl s ARG 217 CO 0.49 -0.23 1.12 0.20 -0.04 0.00 0.00 175.30 176.84 2sbl s GLY 218 N -3.70 2.91 0.12 3.88 0.00 -1.26 -0.47 107.32 108.80 2sbl s GLY 218 Ca 0.25 0.88 -0.30 0.00 0.00 0.00 0.00 44.72 45.55 2sbl s GLY 218 CO 0.13 1.63 1.04 -1.60 0.00 0.00 0.00 173.10 174.30 2sbl s ARG 219 N -0.82 4.62 -0.16 2.90 3.52 -0.08 -4.60 118.95 124.33 2sbl s ARG 219 Ca 0.48 1.58 0.02 0.00 -0.13 0.00 0.00 55.73 57.67 2sbl s ARG 219 Cb -0.31 -3.35 -0.11 0.00 -1.56 0.00 0.00 34.95 29.62 2sbl s ARG 219 CO 0.38 0.08 -0.13 0.25 -0.81 0.00 0.00 175.30 175.07 2sbl n THR 220 N 2.90 0.91 -1.86 4.11 -2.24 -1.26 -4.76 114.28 112.07 2sbl n THR 220 Ca 0.04 -0.36 -0.01 0.00 -2.27 0.00 0.00 64.05 61.45 2sbl n THR 220 Cb 0.48 -1.04 -0.00 0.00 -2.10 0.00 0.00 70.33 67.67 2sbl n THR 220 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2sbl n GLY 221 N 2.71 0.35 0.24 3.38 0.00 -1.26 -1.35 105.19 109.26 2sbl n GLY 221 Ca -0.28 -0.88 0.16 0.00 0.00 0.00 0.00 46.02 45.03 2sbl n GLY 221 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2sbl h ARG 222 N 0.00 0.00 0.00 1.61 3.08 -1.88 -3.31 114.38 113.88 2sbl h ARG 222 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2sbl h ARG 222 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.92 2sbl h ARG 222 CO 0.03 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.34 2sbl n GLY 223 N -0.38 1.16 3.85 0.04 0.00 -1.26 -4.73 105.19 103.87 2sbl n GLY 223 Ca -0.00 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 2sbl n GLY 223 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2sbl s PRO 224 N -2.19 2.60 0.78 1.61 0.04 -1.26 -0.49 135.00 136.10 2sbl s PRO 224 Ca 0.00 0.57 -0.11 0.00 0.04 0.00 0.00 61.00 61.50 2sbl s PRO 224 Cb 0.00 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.63 2sbl s PRO 224 CO 0.00 -1.24 1.14 0.95 0.04 0.00 0.00 177.00 177.88 2sbl s THR 225 N -3.26 2.23 0.11 1.26 -4.23 -0.58 -4.33 115.64 106.85 2sbl s THR 225 Ca 0.59 -0.00 -0.17 0.00 -1.18 0.00 0.00 61.69 60.93 2sbl s THR 225 Cb -0.12 -3.06 -0.05 0.00 1.34 0.00 0.00 72.50 70.61 2sbl s THR 225 CO 0.53 -0.07 1.57 0.58 -0.54 0.00 0.00 174.62 176.69 2sbl h VAL 226 N -0.92 1.24 0.05 2.29 2.07 -1.98 -3.30 116.25 115.71 2sbl h VAL 226 Ca -0.46 -0.86 -0.25 0.00 0.82 0.00 0.00 66.70 65.96 2sbl h VAL 226 Cb 1.32 1.18 0.01 0.00 -1.52 0.00 0.00 31.29 32.28 2sbl h VAL 226 CO 0.65 0.28 -1.05 0.71 0.02 0.00 0.00 177.57 178.18 2sbl h THR 227 N 0.36 1.42 -3.30 2.57 1.35 -1.94 -3.43 112.91 109.94 2sbl h THR 227 Ca 0.10 -2.62 -0.52 0.00 -0.55 0.00 0.00 66.41 62.82 2sbl h THR 227 Cb 0.38 2.59 -0.39 0.00 -1.73 0.00 0.00 68.15 69.00 2sbl h THR 227 CO 0.01 0.78 -0.77 -0.62 -0.25 0.00 0.00 175.52 174.67 2sbl s ASP 228 N -7.13 2.81 0.00 5.36 2.15 -1.24 -4.98 116.67 113.63 2sbl s ASP 228 Ca -0.06 -0.74 0.00 0.00 0.43 0.00 0.00 52.55 52.18 2sbl s ASP 228 Cb 0.08 -0.65 0.00 0.00 -0.30 0.00 0.00 42.92 42.05 2sbl s ASP 228 CO 0.88 -0.28 0.91 -0.81 -0.17 0.00 0.00 175.17 175.70 2sbl n PRO 229 N 5.02 0.00 0.00 4.34 -0.04 -1.26 -2.35 135.00 140.71 2sbl n PRO 229 Ca -0.09 0.41 0.08 0.00 -0.04 0.00 0.00 63.50 63.86 2sbl n PRO 229 Cb 0.47 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 2sbl n PRO 229 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2sbl n ASN 230 N -1.41 1.31 -4.85 3.54 4.13 -1.26 -4.77 115.26 111.95 2sbl n ASN 230 Ca 0.00 -1.15 -0.35 0.00 1.68 0.00 0.00 54.58 54.76 2sbl n ASN 230 Cb 0.07 0.71 -0.06 0.00 -1.54 0.00 0.00 39.78 38.96 2sbl n ASN 230 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2sbl s THR 231 N -2.31 5.21 0.23 3.41 2.01 -0.99 -4.81 115.64 118.39 2sbl s THR 231 Ca 0.11 -0.08 -0.24 0.00 0.31 0.00 0.00 61.69 61.79 2sbl s THR 231 Cb 0.14 -3.34 -0.09 0.00 0.01 0.00 0.00 72.50 69.22 2sbl s THR 231 CO 0.56 0.47 0.81 -0.70 -0.69 0.00 0.00 174.62 175.07 2sbl s GLU 232 N -1.45 4.48 0.45 4.92 2.12 0.02 -1.52 118.70 127.71 2sbl s GLU 232 Ca 0.20 1.12 -0.21 0.00 0.36 0.00 0.00 54.97 56.44 2sbl s GLU 232 Cb -0.12 -3.01 -0.09 0.00 0.26 0.00 0.00 34.13 31.16 2sbl s GLU 232 CO 0.11 0.43 1.01 -1.59 -0.54 0.00 0.00 175.26 174.68 2sbl s LYS 233 N -1.67 4.02 0.89 4.30 -2.85 0.36 -4.67 119.74 120.11 2sbl s LYS 233 Ca 0.42 1.31 -0.13 0.00 -1.00 0.00 0.00 55.97 56.57 2sbl s LYS 233 Cb -0.20 -2.22 0.04 0.00 -2.06 0.00 0.00 37.83 33.40 2sbl s LYS 233 CO 0.24 -0.24 0.58 1.04 0.10 0.00 0.00 175.35 177.08 2sbl n GLN 234 N -0.67 -0.16 -3.82 1.78 1.13 -1.26 -4.85 117.38 109.53 2sbl n GLN 234 Ca 0.08 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 55.05 2sbl n GLN 234 Cb 0.52 -1.96 -0.07 0.00 0.11 0.00 0.00 30.24 28.84 2sbl n GLN 234 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2sbl s GLY 235 N -2.00 0.06 -0.04 1.08 0.00 -1.26 -5.06 107.32 100.10 2sbl s GLY 235 Ca 0.61 -0.54 -0.26 0.00 0.00 0.00 0.00 44.72 44.54 2sbl s GLY 235 CO 0.63 -0.71 1.17 0.83 0.00 0.00 0.00 173.10 175.02 2sbl h GLU 236 N 2.66 -0.03 -5.48 2.90 4.39 -2.05 -3.44 114.58 113.52 2sbl h GLU 236 Ca -0.34 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.74 2sbl h GLU 236 Cb 1.21 0.01 -0.32 0.00 -0.10 0.00 0.00 28.75 29.55 2sbl h GLU 236 CO 0.54 0.51 -0.86 0.14 -1.16 0.00 0.00 179.01 178.18 2sbl s VAL 237 N -3.93 1.75 -0.47 3.13 -7.23 -1.26 -5.07 120.40 107.32 2sbl s VAL 237 Ca -0.16 -0.88 -0.22 0.00 -1.81 0.00 0.00 61.98 58.91 2sbl s VAL 237 Cb 0.01 -1.50 0.03 0.00 0.56 0.00 0.00 36.38 35.48 2sbl s VAL 237 CO 0.65 0.49 0.77 -0.36 -0.31 0.00 0.00 175.10 176.34 2sbl s PHE 238 N 0.09 2.98 0.41 2.82 0.40 -1.26 -5.02 117.98 118.40 2sbl s PHE 238 Ca -0.08 0.02 -0.25 0.00 -0.60 0.00 0.00 56.93 56.01 2sbl s PHE 238 Cb -0.14 -3.66 -0.10 0.00 0.51 0.00 0.00 43.02 39.63 2sbl s PHE 238 CO 0.04 -1.03 1.21 0.98 0.70 0.00 0.00 175.22 177.13 2sbl n TYR 239 N 6.69 1.92 -4.24 0.36 4.19 -1.26 -4.83 117.16 120.00 2sbl n TYR 239 Ca 0.01 0.52 -0.16 0.00 3.31 0.00 0.00 57.90 61.57 2sbl n TYR 239 Cb 0.48 -2.34 -0.11 0.00 0.49 0.00 0.00 39.34 37.85 2sbl n TYR 239 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2sbl s VAL 240 N -1.20 1.24 0.44 2.97 -7.23 -1.26 -4.80 120.40 110.56 2sbl s VAL 240 Ca 0.61 -1.80 -0.25 0.00 -1.81 0.00 0.00 61.98 58.73 2sbl s VAL 240 Cb -0.53 -1.59 -0.09 0.00 0.56 0.00 0.00 36.38 34.73 2sbl s VAL 240 CO 0.58 -0.52 1.25 -2.65 -0.31 0.00 0.00 175.10 173.44 2sbl n PRO 241 N 0.33 1.84 -0.27 4.82 -0.02 -1.26 -4.80 135.00 135.64 2sbl n PRO 241 Ca -0.14 0.66 0.04 0.00 -2.02 0.00 0.00 63.50 62.04 2sbl n PRO 241 Cb 0.58 -2.37 0.13 0.00 -0.02 0.00 0.00 33.50 31.83 2sbl n PRO 241 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2sbl h ARG 242 N 1.95 0.04 0.00 -0.52 9.65 -1.11 0.16 114.38 124.55 2sbl h ARG 242 Ca -0.48 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 2sbl h ARG 242 Cb 1.30 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 2sbl h ARG 242 CO 0.59 0.02 0.00 -0.25 2.80 0.00 0.00 179.97 183.14 2sbl n ASP 243 N -5.45 0.00 0.02 -3.80 8.00 -1.26 -1.98 116.55 112.08 2sbl n ASP 243 Ca 0.13 -1.53 0.11 0.00 0.71 0.00 0.00 54.79 54.21 2sbl n ASP 243 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.52 2sbl n ASP 243 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2sbl n GLU 244 N -0.68 0.34 -2.94 -1.24 -0.58 0.57 -4.71 120.64 111.40 2sbl n GLU 244 Ca 0.08 -0.03 -0.44 0.00 -0.42 0.00 0.00 57.16 56.35 2sbl n GLU 244 Cb 0.04 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 29.30 2sbl n GLU 244 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2sbl s ASN 245 N -4.01 6.60 -0.02 1.62 3.04 -0.84 -4.13 114.94 117.20 2sbl s ASN 245 Ca 0.02 -2.01 -0.30 0.00 0.04 0.00 0.00 52.86 50.61 2sbl s ASN 245 Cb 0.14 -2.39 -0.06 0.00 -1.54 0.00 0.00 41.25 37.40 2sbl s ASN 245 CO 0.83 -1.06 1.53 -0.76 -3.04 0.00 0.00 177.10 174.60 2sbl s LEU 246 N 2.65 4.32 0.73 3.21 1.02 -1.26 -5.03 118.68 124.31 2sbl s LEU 246 Ca 0.31 2.20 -0.11 0.00 0.02 0.00 0.00 54.13 56.55 2sbl s LEU 246 Cb -0.06 -3.55 0.03 0.00 0.02 0.00 0.00 46.19 42.63 2sbl s LEU 246 CO -0.08 -0.83 1.10 -0.83 0.02 0.00 0.00 176.35 175.73 2sbl s GLY 247 N 2.51 1.62 -0.09 -3.19 0.00 -1.26 -5.07 107.32 101.83 2sbl s GLY 247 Ca 0.68 -0.46 -0.06 0.00 0.00 0.00 0.00 44.72 44.89 2sbl s GLY 247 CO 0.28 -0.06 0.23 0.30 0.00 0.00 0.00 173.10 173.84 2sbl s HIS 248 N -3.39 -0.28 0.35 1.90 3.76 -0.74 -5.02 115.29 111.86 2sbl s HIS 248 Ca 0.59 0.69 0.21 0.00 -0.15 0.00 0.00 55.06 56.40 2sbl s HIS 248 Cb -0.11 0.04 1.07 0.00 1.11 0.00 0.00 32.58 34.70 2sbl s HIS 248 CO 0.50 -0.19 1.94 1.25 -0.85 0.00 0.00 174.74 177.39 2sbl h LEU 249 N 6.78 0.00 -8.18 0.89 5.85 -1.83 -3.40 115.31 115.41 2sbl h LEU 249 Ca -0.36 0.00 -0.65 0.00 0.84 0.00 0.00 57.88 57.71 2sbl h LEU 249 Cb 1.17 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 41.86 2sbl h LEU 249 CO 0.38 0.23 -0.86 -0.54 -0.34 0.00 0.00 178.44 177.31 2sbl s LYS 250 N -4.13 2.77 0.46 1.25 1.02 -1.26 -4.93 119.74 114.93 2sbl s LYS 250 Ca -0.02 -0.77 0.15 0.00 0.02 0.00 0.00 55.97 55.35 2sbl s LYS 250 Cb 0.13 -2.21 1.11 0.00 -0.52 0.00 0.00 37.83 36.34 2sbl s LYS 250 CO 0.65 0.03 2.02 0.77 -0.92 0.00 0.00 175.35 177.90 2sbl h SER 251 N 7.16 0.26 -0.95 2.83 0.02 -1.95 -1.22 113.55 119.69 2sbl h SER 251 Ca -0.28 0.00 0.27 0.00 -0.84 0.00 0.00 61.79 60.93 2sbl h SER 251 Cb 1.20 -0.05 -0.14 0.00 0.14 0.00 0.00 62.40 63.55 2sbl h SER 251 CO 0.51 0.16 0.47 0.50 -1.14 0.00 0.00 176.83 177.33 2sbl h LYS 252 N 0.29 0.36 -0.00 3.45 3.64 -1.95 -1.05 116.57 121.30 2sbl h LYS 252 Ca 0.21 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2sbl h LYS 252 Cb 0.44 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2sbl h LYS 252 CO -0.04 0.24 0.00 -0.25 -2.27 0.00 0.00 179.45 177.12 2sbl n ASP 253 N -5.05 0.04 -3.19 4.20 8.00 -0.46 -4.25 116.55 115.84 2sbl n ASP 253 Ca 0.26 -1.33 -0.36 0.00 0.71 0.00 0.00 54.79 54.08 2sbl n ASP 253 Cb 0.80 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.88 2sbl n ASP 253 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2sbl n ALA 254 N -0.81 6.73 -0.34 2.24 0.00 -0.40 -4.70 120.51 123.23 2sbl n ALA 254 Ca 0.16 -3.76 0.04 0.00 0.00 0.00 0.00 53.44 49.89 2sbl n ALA 254 Cb 0.08 -2.61 0.19 0.00 0.00 0.00 0.00 19.45 17.11 2sbl n ALA 254 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2sbl h LEU 255 N 5.17 0.89 -0.86 0.00 3.38 -1.84 -0.93 115.31 121.12 2sbl h LEU 255 Ca 0.62 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.79 2sbl h LEU 255 Cb 0.43 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 2sbl h LEU 255 CO 1.30 0.52 0.42 -0.33 0.09 0.00 0.00 178.44 180.44 2sbl h GLU 256 N 1.00 0.52 0.00 1.13 3.07 -1.90 0.49 114.58 118.90 2sbl h GLU 256 Ca 0.44 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 2sbl h GLU 256 Cb 0.33 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 2sbl h GLU 256 CO -0.22 0.35 0.00 -0.84 -1.40 0.00 0.00 179.01 176.89 2sbl h ILE 257 N 0.54 0.00 -0.41 3.13 3.07 -1.56 -2.89 117.51 119.38 2sbl h ILE 257 Ca 0.49 -0.52 -0.02 0.00 1.55 0.00 0.00 64.86 66.36 2sbl h ILE 257 Cb 0.79 1.44 -0.02 0.00 -0.27 0.00 0.00 36.82 38.76 2sbl h ILE 257 CO -0.42 0.00 0.15 1.23 -1.05 0.00 0.00 178.15 178.06 2sbl h GLY 258 N 3.06 0.63 1.30 0.16 0.00 -0.86 -0.14 103.07 107.22 2sbl h GLY 258 Ca 0.00 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 2sbl h GLY 258 CO 0.00 0.29 -0.04 -0.91 0.00 0.00 0.00 176.54 175.88 2sbl h THR 259 N 0.58 1.25 -0.16 4.70 1.35 -1.51 0.10 112.91 119.23 2sbl h THR 259 Ca 0.14 -1.10 -0.03 0.00 -0.55 0.00 0.00 66.41 64.87 2sbl h THR 259 Cb 0.14 0.92 -0.01 0.00 -1.73 0.00 0.00 68.15 67.48 2sbl h THR 259 CO -0.01 0.38 -0.03 0.50 -0.25 0.00 0.00 175.52 176.12 2sbl h LYS 260 N 0.78 0.30 -0.64 4.72 3.64 -1.50 -1.92 116.57 121.95 2sbl h LYS 260 Ca 0.14 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2sbl h LYS 260 Cb 0.52 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.29 2sbl h LYS 260 CO 0.03 0.56 0.42 0.77 -2.27 0.00 0.00 179.45 178.96 2sbl h SER 261 N 0.02 0.73 -0.44 4.20 0.02 -0.74 -0.19 113.55 117.15 2sbl h SER 261 Ca 0.04 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.88 2sbl h SER 261 Cb 0.44 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 2sbl h SER 261 CO 0.01 0.53 -0.05 0.25 -1.14 0.00 0.00 176.83 176.44 2sbl h LEU 262 N 0.86 0.85 0.24 5.07 5.85 -0.75 0.20 115.31 127.64 2sbl h LEU 262 Ca 0.23 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2sbl h LEU 262 Cb -0.10 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.71 2sbl h LEU 262 CO -0.05 0.95 -0.11 -1.28 -0.34 0.00 0.00 178.44 177.60 2sbl h SER 263 N 0.80 -0.27 1.44 1.25 0.87 -0.99 0.70 113.55 117.36 2sbl h SER 263 Ca 0.14 -0.26 -0.08 0.00 -1.23 0.00 0.00 61.79 60.36 2sbl h SER 263 Cb 0.55 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.57 2sbl h SER 263 CO 0.03 0.19 -0.39 1.56 -0.53 0.00 0.00 176.83 177.69 2sbl h GLN 264 N -0.81 0.00 0.00 2.24 4.20 -0.95 -3.36 115.11 116.42 2sbl h GLN 264 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2sbl h GLN 264 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 2sbl h GLN 264 CO 0.05 0.39 -0.33 -0.89 -0.67 0.00 0.00 178.83 177.38 2sbl n ILE 265 N -3.25 0.72 -0.07 2.54 5.41 0.67 -4.75 119.36 120.63 2sbl n ILE 265 Ca 0.02 0.24 -0.14 0.00 1.00 0.00 0.00 62.75 63.86 2sbl n ILE 265 Cb 0.65 -1.46 -0.05 0.00 -0.71 0.00 0.00 39.64 38.07 2sbl n ILE 265 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2sbl h VAL 266 N 0.00 1.30 -0.19 1.39 2.07 -1.43 -2.94 116.25 116.46 2sbl h VAL 266 Ca 0.00 -1.62 -0.00 0.00 0.82 0.00 0.00 66.70 65.90 2sbl h VAL 266 Cb 0.33 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 2sbl h VAL 266 CO 0.00 0.52 0.12 -0.61 0.02 0.00 0.00 177.57 177.61 2sbl h GLN 267 N 0.45 0.26 -0.66 1.57 4.15 -1.00 -1.48 115.11 118.40 2sbl h GLN 267 Ca 0.02 -0.02 0.11 0.00 0.77 0.00 0.00 58.65 59.53 2sbl h GLN 267 Cb 1.02 -0.06 -0.12 0.00 0.21 0.00 0.00 27.48 28.53 2sbl h GLN 267 CO 0.10 0.20 -0.34 -1.35 -1.93 0.00 0.00 178.83 175.51 2sbl h PRO 268 N 0.24 -0.13 -0.38 -2.39 0.11 -1.74 -0.91 132.00 126.81 2sbl h PRO 268 Ca 0.07 0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.26 2sbl h PRO 268 Cb 0.01 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.09 2sbl h PRO 268 CO -0.01 -0.08 0.01 0.00 -0.21 0.00 0.00 178.00 177.70 2sbl h ALA 269 N 1.09 0.35 -0.06 -0.75 0.00 -1.26 0.48 119.26 119.11 2sbl h ALA 269 Ca 0.26 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 2sbl h ALA 269 Cb 0.56 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2sbl h ALA 269 CO -0.73 -0.39 0.04 0.74 0.00 0.00 0.00 179.25 178.91 2sbl h PHE 270 N 0.11 0.08 -0.89 0.00 0.04 -0.92 -2.38 116.94 112.98 2sbl h PHE 270 Ca 0.18 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.01 2sbl h PHE 270 Cb 0.25 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.32 2sbl h PHE 270 CO -0.25 0.09 0.56 0.93 -0.60 0.00 0.00 178.31 179.04 2sbl h GLU 271 N 0.05 1.00 -0.40 1.51 5.08 -0.24 -1.00 114.58 120.58 2sbl h GLU 271 Ca 0.02 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2sbl h GLU 271 Cb 0.03 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 2sbl h GLU 271 CO -0.00 0.66 0.20 0.66 -1.00 0.00 0.00 179.01 179.53 2sbl h SER 272 N 1.03 0.51 -0.80 1.42 4.64 -0.77 -1.24 113.55 118.33 2sbl h SER 272 Ca 0.38 -0.11 0.12 0.00 -0.47 0.00 0.00 61.79 61.71 2sbl h SER 272 Cb 0.14 -0.13 -0.06 0.00 -0.31 0.00 0.00 62.40 62.05 2sbl h SER 272 CO -0.16 0.47 0.53 0.00 -0.87 0.00 0.00 176.83 176.79 2sbl h ALA 273 N 1.06 1.84 0.02 5.18 0.00 -0.67 0.68 119.26 127.36 2sbl h ALA 273 Ca 0.14 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2sbl h ALA 273 Cb 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2sbl h ALA 273 CO -0.02 -0.03 -0.95 0.74 0.00 0.00 0.00 179.25 178.99 2sbl h PHE 274 N 0.66 0.44 -0.09 0.00 -1.00 -1.00 -2.60 116.94 113.35 2sbl h PHE 274 Ca 0.38 -0.25 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 2sbl h PHE 274 Cb 0.58 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.09 2sbl h PHE 274 CO -0.00 1.08 -0.10 -0.44 -1.61 0.00 0.00 178.31 177.24 2sbl h ASP 275 N 0.15 0.12 -0.14 2.17 3.32 0.25 -2.18 116.42 120.10 2sbl h ASP 275 Ca -0.07 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2sbl h ASP 275 Cb 1.60 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.12 2sbl h ASP 275 CO 0.15 0.24 0.00 0.18 -1.72 0.00 0.00 179.24 178.10 2sbl n LEU 276 N -4.35 0.98 -3.63 1.55 4.77 -0.03 -4.91 117.00 111.38 2sbl n LEU 276 Ca -0.01 -0.45 -0.26 0.00 -0.03 0.00 0.00 56.01 55.26 2sbl n LEU 276 Cb 0.22 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2sbl n LEU 276 CO 0.37 0.22 -0.06 0.29 -1.33 0.00 0.00 177.39 176.88 2sbl n LYS 277 N -0.06 -2.69 0.20 3.23 4.76 -0.82 -4.81 118.16 117.95 2sbl n LYS 277 Ca 0.11 0.31 0.08 0.00 -2.87 0.00 0.00 58.31 55.95 2sbl n LYS 277 Cb 0.19 -4.97 0.27 0.00 -1.84 0.00 0.00 35.03 28.68 2sbl n LYS 277 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2sbl h SER 278 N -0.88 0.00 -5.10 4.39 4.64 -1.74 -3.44 113.55 111.42 2sbl h SER 278 Ca -0.43 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 2sbl h SER 278 Cb 1.28 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.20 2sbl h SER 278 CO 0.57 0.25 -0.69 0.28 -0.87 0.00 0.00 176.83 176.37 2sbl s THR 279 N -3.32 0.22 0.23 2.95 -1.32 -1.26 -4.93 115.64 108.21 2sbl s THR 279 Ca 0.03 -1.48 -0.31 0.00 -1.21 0.00 0.00 61.69 58.72 2sbl s THR 279 Cb 0.08 -1.06 -0.14 0.00 -1.51 0.00 0.00 72.50 69.87 2sbl s THR 279 CO 0.67 -0.80 1.32 -2.65 -2.21 0.00 0.00 174.62 170.95 2sbl n PRO 280 N 0.67 1.80 -0.06 7.08 -0.02 -1.26 -4.89 135.00 138.32 2sbl n PRO 280 Ca -0.18 0.64 0.10 0.00 -2.02 0.00 0.00 63.50 62.04 2sbl n PRO 280 Cb 0.59 -2.24 0.41 0.00 -0.02 0.00 0.00 33.50 32.24 2sbl n PRO 280 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2sbl n ILE 281 N 1.60 0.15 -3.80 4.25 -5.35 -1.26 -4.84 119.36 110.11 2sbl n ILE 281 Ca 0.12 -0.23 -0.13 0.00 -0.27 0.00 0.00 62.75 62.24 2sbl n ILE 281 Cb 0.30 0.13 -0.14 0.00 -1.74 0.00 0.00 39.64 38.20 2sbl n ILE 281 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2sbl s GLU 282 N -1.85 0.11 0.26 6.28 2.56 -1.26 -3.88 118.70 120.91 2sbl s GLU 282 Ca 0.29 0.24 -0.29 0.00 0.00 0.00 0.00 54.97 55.21 2sbl s GLU 282 Cb 0.15 -0.05 -0.09 0.00 2.00 0.00 0.00 34.13 36.14 2sbl s GLU 282 CO 0.23 -0.08 1.00 -0.06 -0.56 0.00 0.00 175.26 175.79 2sbl s PHE 283 N 0.55 3.80 -0.09 5.30 0.08 -1.26 -4.96 117.98 121.40 2sbl s PHE 283 Ca -0.04 1.82 0.12 0.00 0.12 0.00 0.00 56.93 58.95 2sbl s PHE 283 Cb -0.06 -3.09 -0.17 0.00 -0.57 0.00 0.00 43.02 39.13 2sbl s PHE 283 CO -0.02 0.04 0.12 0.72 -0.10 0.00 0.00 175.22 175.97 2sbl n HIS 284 N 1.27 0.00 -4.11 0.36 8.25 -1.26 -4.84 115.22 114.90 2sbl n HIS 284 Ca -0.01 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.37 2sbl n HIS 284 Cb 0.46 -0.51 -0.10 0.00 1.12 0.00 0.00 29.99 30.96 2sbl n HIS 284 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2sbl s SER 285 N -4.21 0.44 0.49 0.41 1.04 -1.26 -3.75 113.70 106.86 2sbl s SER 285 Ca -0.06 -1.07 0.21 0.00 0.48 0.00 0.00 55.95 55.51 2sbl s SER 285 Cb 0.05 0.23 1.27 0.00 0.10 0.00 0.00 66.02 67.67 2sbl s SER 285 CO 0.52 -0.64 1.99 -0.26 0.98 0.00 0.00 173.24 175.82 2sbl h PHE 286 N 3.05 0.16 -0.03 5.02 0.04 -1.96 -1.00 116.94 122.22 2sbl h PHE 286 Ca -0.34 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.38 2sbl h PHE 286 Cb 1.16 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 39.25 2sbl h PHE 286 CO 0.50 0.07 -0.21 1.96 -0.60 0.00 0.00 178.31 180.02 2sbl h GLN 287 N 0.14 0.04 -0.05 1.51 1.08 -1.98 -0.59 115.11 115.26 2sbl h GLN 287 Ca 0.27 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.44 2sbl h GLN 287 Cb 0.86 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.28 2sbl h GLN 287 CO -0.04 0.25 -0.04 -0.44 -0.95 0.00 0.00 178.83 177.61 2sbl h ASP 288 N 0.04 0.07 0.02 1.46 5.19 -1.58 0.23 116.42 121.84 2sbl h ASP 288 Ca 0.01 -0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 2sbl h ASP 288 Cb 0.40 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 39.89 2sbl h ASP 288 CO 0.03 0.13 -0.24 0.58 -3.12 0.00 0.00 179.24 176.61 2sbl h VAL 289 N 0.08 1.67 -0.39 -1.35 2.07 -1.23 -3.24 116.25 113.85 2sbl h VAL 289 Ca 0.02 -2.36 0.11 0.00 0.82 0.00 0.00 66.70 65.29 2sbl h VAL 289 Cb 0.13 3.26 -0.02 0.00 -1.52 0.00 0.00 31.29 33.14 2sbl h VAL 289 CO 0.01 0.60 0.30 0.45 0.02 0.00 0.00 177.57 178.95 2sbl h HIS 290 N -0.91 0.00 -0.67 1.57 3.86 -0.75 -0.91 115.15 117.34 2sbl h HIS 290 Ca -0.06 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.27 2sbl h HIS 290 Cb 1.12 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.55 2sbl h HIS 290 CO 0.25 0.00 0.45 -0.44 0.86 0.00 0.00 177.93 179.05 2sbl h ASP 291 N 0.00 0.40 -0.99 2.45 5.19 -0.58 -2.52 116.42 120.37 2sbl h ASP 291 Ca 0.19 0.01 0.18 0.00 -0.62 0.00 0.00 57.03 56.79 2sbl h ASP 291 Cb 0.79 -0.07 -0.10 0.00 0.18 0.00 0.00 39.33 40.13 2sbl h ASP 291 CO -0.00 0.23 0.61 -0.07 -3.12 0.00 0.00 179.24 176.89 2sbl h LEU 292 N 0.43 0.75 -0.10 1.55 4.07 -1.28 0.20 115.31 120.93 2sbl h LEU 292 Ca 0.31 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.36 2sbl h LEU 292 Cb 0.64 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.32 2sbl h LEU 292 CO -0.09 0.29 -0.94 0.00 -1.08 0.00 0.00 178.44 176.62 2sbl n TYR 293 N -4.70 0.00 0.00 1.13 0.18 -0.98 -0.98 117.16 111.81 2sbl n TYR 293 Ca 0.22 0.00 0.00 0.00 1.88 0.00 0.00 57.90 60.00 2sbl n TYR 293 Cb 0.56 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.52 2sbl n TYR 293 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2sbl n GLU 294 N -1.34 0.00 0.05 -3.48 1.02 -0.26 -4.65 120.64 111.98 2sbl n GLU 294 Ca 0.04 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.31 2sbl n GLU 294 Cb 0.34 0.00 0.49 0.00 -0.02 0.00 0.00 31.44 32.26 2sbl n GLU 294 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2sbl n GLY 295 N 3.50 -1.49 3.65 0.62 0.00 -0.93 -4.99 105.19 105.56 2sbl n GLY 295 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2sbl n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sbl n GLY 296 N 1.09 -1.99 3.08 -0.02 0.00 0.54 -4.86 105.19 103.02 2sbl n GLY 296 Ca 0.06 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.13 2sbl n GLY 296 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2sbl s ILE 297 N -0.06 1.11 -0.44 -0.61 2.07 0.36 -4.37 121.20 119.27 2sbl s ILE 297 Ca 0.00 -0.55 -0.23 0.00 -1.41 0.00 0.00 60.65 58.46 2sbl s ILE 297 Cb 0.00 -0.96 0.02 0.00 0.13 0.00 0.00 42.46 41.65 2sbl s ILE 297 CO 0.00 0.33 0.75 -0.75 -1.91 0.00 0.00 174.94 173.36 2sbl s LYS 298 N 0.04 3.40 0.21 3.50 2.20 -1.26 -1.59 119.74 126.25 2sbl s LYS 298 Ca -0.02 -0.14 0.07 0.00 -0.36 0.00 0.00 55.97 55.52 2sbl s LYS 298 Cb -0.09 -3.93 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 2sbl s LYS 298 CO 0.01 -1.08 0.11 -0.51 -0.36 0.00 0.00 175.35 173.52 2sbl s LEU 299 N 3.17 3.61 0.38 5.43 2.01 0.47 -4.75 118.68 129.00 2sbl s LEU 299 Ca 0.28 -0.31 -0.25 0.00 0.01 0.00 0.00 54.13 53.87 2sbl s LEU 299 Cb -0.13 -2.19 -0.12 0.00 0.01 0.00 0.00 46.19 43.76 2sbl s LEU 299 CO 0.22 0.03 0.86 -0.81 1.01 0.00 0.00 176.35 177.66 2sbl n PRO 300 N -0.66 1.08 -0.19 1.29 -0.04 -1.26 -4.52 135.00 130.69 2sbl n PRO 300 Ca -0.08 0.38 -0.01 0.00 -0.04 0.00 0.00 63.50 63.76 2sbl n PRO 300 Cb 0.57 -1.80 0.09 0.00 -0.04 0.00 0.00 33.50 32.32 2sbl n PRO 300 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2sbl h ARG 301 N 1.42 0.32 -0.88 0.54 3.08 -1.93 -0.59 114.38 116.35 2sbl h ARG 301 Ca -0.41 -0.02 0.16 0.00 0.07 0.00 0.00 59.98 59.78 2sbl h ARG 301 Cb 1.36 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 31.27 2sbl h ARG 301 CO 0.56 0.21 0.57 0.38 -1.07 0.00 0.00 179.97 180.63 2sbl h ASP 302 N 0.33 0.55 -0.13 7.04 2.03 -1.91 -0.02 116.42 124.32 2sbl h ASP 302 Ca 0.29 0.04 -0.05 0.00 -0.73 0.00 0.00 57.03 56.58 2sbl h ASP 302 Cb 0.37 -0.07 -0.00 0.00 -0.83 0.00 0.00 39.33 38.80 2sbl h ASP 302 CO -0.32 0.26 -0.11 0.58 -1.03 0.00 0.00 179.24 178.62 2sbl h VAL 303 N 0.58 1.34 -0.74 4.15 2.07 -1.48 -2.03 116.25 120.14 2sbl h VAL 303 Ca 0.45 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 2sbl h VAL 303 Cb 0.86 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.48 2sbl h VAL 303 CO -0.19 0.36 0.35 0.40 0.02 0.00 0.00 177.57 178.51 2sbl h ILE 304 N -0.07 1.24 0.00 4.57 1.08 -0.81 0.29 117.51 123.80 2sbl h ILE 304 Ca 0.02 -0.66 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 2sbl h ILE 304 Cb 0.62 0.28 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 2sbl h ILE 304 CO 0.03 0.28 0.00 0.77 -0.69 0.00 0.00 178.15 178.54 2sbl h SER 305 N 1.06 0.00 0.08 1.72 4.64 -1.00 -1.49 113.55 118.57 2sbl h SER 305 Ca 0.26 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.35 2sbl h SER 305 Cb 0.11 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 2sbl h SER 305 CO -0.03 0.00 -0.95 0.74 -0.87 0.00 0.00 176.83 175.71 2sbl h THR 306 N 0.00 1.37 0.24 2.95 2.02 -0.22 -3.39 112.91 115.89 2sbl h THR 306 Ca 0.00 -2.35 -0.01 0.00 0.77 0.00 0.00 66.41 64.82 2sbl h THR 306 Cb 0.60 2.75 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 2sbl h THR 306 CO 0.00 0.70 -0.12 0.40 0.37 0.00 0.00 175.52 176.87 2sbl h ILE 307 N 0.04 0.74 0.00 3.11 2.04 -0.95 -3.38 117.51 119.11 2sbl h ILE 307 Ca -0.14 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2sbl h ILE 307 Cb 1.67 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2sbl h ILE 307 CO 0.18 0.16 0.00 2.30 0.00 0.00 0.00 178.15 180.79 2sbl n ILE 308 N -5.04 0.36 0.17 -0.67 -5.35 -0.59 -1.72 119.36 106.52 2sbl n ILE 308 Ca -0.09 0.09 0.05 0.00 -0.27 0.00 0.00 62.75 62.53 2sbl n ILE 308 Cb 0.26 -0.76 0.19 0.00 -1.74 0.00 0.00 39.64 37.60 2sbl n ILE 308 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 2sbl h PRO 309 N 0.00 0.00 -6.26 6.28 0.11 -1.77 -3.45 132.00 126.92 2sbl h PRO 309 Ca 0.00 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.55 2sbl h PRO 309 Cb 0.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 2sbl h PRO 309 CO 0.00 0.42 1.13 -0.51 -0.21 0.00 0.00 178.00 178.83 2sbl s LEU 310 N -6.69 3.99 0.31 2.35 1.43 -0.70 -4.94 118.68 114.44 2sbl s LEU 310 Ca 0.02 1.80 0.01 0.00 -1.03 0.00 0.00 54.13 54.93 2sbl s LEU 310 Cb 0.09 -3.53 0.56 0.00 0.03 0.00 0.00 46.19 43.34 2sbl s LEU 310 CO 0.71 -1.19 1.93 1.55 0.23 0.00 0.00 176.35 179.58 2sbl h PRO 311 N 10.55 0.96 0.08 1.29 0.13 -1.90 0.27 132.00 143.38 2sbl h PRO 311 Ca -0.35 -0.06 -0.34 0.00 -0.87 0.00 0.00 66.00 64.38 2sbl h PRO 311 Cb 1.16 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 32.04 2sbl h PRO 311 CO 0.99 0.64 -1.92 0.28 -0.23 0.00 0.00 178.00 177.75 2sbl n VAL 312 N -4.47 1.71 -0.24 1.56 0.31 -1.26 -4.38 118.33 111.55 2sbl n VAL 312 Ca 0.12 -0.71 -0.08 0.00 -0.01 0.00 0.00 64.34 63.67 2sbl n VAL 312 Cb 0.17 -1.45 0.04 0.00 -0.91 0.00 0.00 33.84 31.69 2sbl n VAL 312 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2sbl h ILE 313 N 0.04 1.26 -0.06 2.52 1.08 -1.75 -2.05 117.51 118.56 2sbl h ILE 313 Ca -0.38 -1.02 0.02 0.00 -0.39 0.00 0.00 64.86 63.08 2sbl h ILE 313 Cb 2.03 0.62 -0.00 0.00 -3.07 0.00 0.00 36.82 36.39 2sbl h ILE 313 CO 0.08 0.39 0.06 0.07 -0.69 0.00 0.00 178.15 178.06 2sbl h LYS 314 N 1.04 0.00 0.00 2.37 2.10 -1.13 -0.69 116.57 120.26 2sbl h LYS 314 Ca 0.21 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.86 2sbl h LYS 314 Cb 0.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 2sbl h LYS 314 CO 0.01 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 177.85 2sbl n GLU 315 N -3.88 0.38 0.09 0.07 4.71 -0.77 -3.54 120.64 117.70 2sbl n GLU 315 Ca -0.02 0.04 0.12 0.00 -0.01 0.00 0.00 57.16 57.29 2sbl n GLU 315 Cb 0.15 -1.50 0.20 0.00 -1.01 0.00 0.00 31.44 29.28 2sbl n GLU 315 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2sbl h LEU 316 N 0.00 0.00 -8.38 -4.62 3.38 -1.20 -3.48 115.31 101.01 2sbl h LEU 316 Ca 0.00 -0.12 -0.17 0.00 0.09 0.00 0.00 57.88 57.67 2sbl h LEU 316 Cb 0.25 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.85 2sbl h LEU 316 CO 0.00 0.06 -0.60 -0.31 0.09 0.00 0.00 178.44 177.68 2sbl s TYR 317 N -3.18 0.80 -0.06 1.13 2.02 -1.23 -4.53 117.35 112.30 2sbl s TYR 317 Ca 0.06 -1.17 -0.03 0.00 -0.37 0.00 0.00 57.07 55.57 2sbl s TYR 317 Cb 0.12 -0.42 -0.04 0.00 -0.40 0.00 0.00 41.96 41.22 2sbl s TYR 317 CO 0.70 -0.55 0.08 1.03 -1.57 0.00 0.00 175.55 175.23 2sbl s ARG 318 N -4.04 3.15 0.06 -0.62 1.81 -0.35 -4.93 118.95 114.03 2sbl s ARG 318 Ca 0.23 -0.37 -0.03 0.00 -1.72 0.00 0.00 55.73 53.85 2sbl s ARG 318 Cb 0.07 -2.93 -0.03 0.00 -0.45 0.00 0.00 34.95 31.61 2sbl s ARG 318 CO 0.02 0.70 0.02 -0.08 -0.68 0.00 0.00 175.30 175.28 2sbl s THR 319 N -1.06 0.20 -0.97 0.02 -1.32 -1.26 -1.04 115.64 110.21 2sbl s THR 319 Ca 0.18 -1.66 0.16 0.00 -1.21 0.00 0.00 61.69 59.16 2sbl s THR 319 Cb -0.12 -1.49 0.71 0.00 -1.51 0.00 0.00 72.50 70.09 2sbl s THR 319 CO 0.08 -0.90 1.61 -0.90 -2.21 0.00 0.00 174.62 172.30 2sbl n ASP 320 N 0.06 4.77 0.00 8.08 5.75 -1.19 -4.95 116.55 129.07 2sbl n ASP 320 Ca -0.14 -2.53 0.00 0.00 -0.01 0.00 0.00 54.79 52.11 2sbl n ASP 320 Cb 0.61 -0.59 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2sbl n ASP 320 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2sbl n GLY 321 N 0.99 2.75 0.00 6.12 0.00 -1.26 -4.62 105.19 109.17 2sbl n GLY 321 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2sbl n GLY 321 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2sbl n GLN 322 N -0.73 0.01 0.00 1.61 6.02 -1.26 -4.74 117.38 118.29 2sbl n GLN 322 Ca 0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 57.00 56.72 2sbl n GLN 322 Cb 0.00 -0.61 0.00 0.00 1.02 0.00 0.00 30.24 30.65 2sbl n GLN 322 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2sbl n HIS 323 N -0.03 0.00 -5.14 1.08 8.25 -1.26 -4.06 115.22 114.05 2sbl n HIS 323 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 2sbl n HIS 323 Cb 0.26 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.22 2sbl n HIS 323 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2sbl s ILE 324 N -0.09 2.44 -0.05 1.59 -1.09 -1.26 -0.39 121.20 122.35 2sbl s ILE 324 Ca 0.00 -0.97 0.03 0.00 -2.23 0.00 0.00 60.65 57.48 2sbl s ILE 324 Cb 0.00 -1.89 0.01 0.00 -1.58 0.00 0.00 42.46 39.00 2sbl s ILE 324 CO 0.00 0.58 -0.12 -0.22 -1.23 0.00 0.00 174.94 173.95 2sbl s LEU 325 N -0.67 1.73 0.03 2.97 2.96 -0.62 -3.19 118.68 121.89 2sbl s LEU 325 Ca 0.11 -0.27 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2sbl s LEU 325 Cb -0.10 -0.76 -0.02 0.00 0.50 0.00 0.00 46.19 45.80 2sbl s LEU 325 CO -0.00 0.07 -0.05 -1.59 -1.32 0.00 0.00 176.35 173.45 2sbl s LYS 326 N 0.39 0.41 0.18 1.98 -2.85 -0.21 -0.49 119.74 119.16 2sbl s LYS 326 Ca -0.09 -0.64 0.03 0.00 -1.00 0.00 0.00 55.97 54.27 2sbl s LYS 326 Cb -0.13 -0.11 -0.03 0.00 -2.06 0.00 0.00 37.83 35.50 2sbl s LYS 326 CO 0.02 0.01 0.31 -0.06 0.10 0.00 0.00 175.35 175.73 2sbl s PHE 327 N -1.32 3.48 0.53 1.78 0.40 -0.15 -1.21 117.98 121.49 2sbl s PHE 327 Ca -0.12 0.10 -0.22 0.00 -0.60 0.00 0.00 56.93 56.09 2sbl s PHE 327 Cb -0.09 -1.66 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 2sbl s PHE 327 CO -0.00 0.48 1.37 -0.35 0.70 0.00 0.00 175.22 177.42 2sbl n PRO 328 N -0.79 1.76 -2.25 0.24 -0.04 -1.26 -4.18 135.00 128.49 2sbl n PRO 328 Ca -0.07 0.65 -0.42 0.00 -0.04 0.00 0.00 63.50 63.61 2sbl n PRO 328 Cb 0.55 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.40 2sbl n PRO 328 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2sbl s GLN 329 N -2.83 4.28 0.43 0.54 0.74 -1.26 -4.83 119.66 116.72 2sbl s GLN 329 Ca 0.70 1.93 -0.26 0.00 0.05 0.00 0.00 55.36 57.78 2sbl s GLN 329 Cb -0.42 -3.60 -0.09 0.00 1.10 0.00 0.00 33.01 29.99 2sbl s GLN 329 CO 0.50 -0.59 1.46 -1.25 -0.55 0.00 0.00 175.29 174.86 2sbl s PRO 330 N 2.53 3.83 0.38 1.67 0.04 -1.26 -4.94 135.00 137.25 2sbl s PRO 330 Ca 0.63 2.49 0.13 0.00 0.04 0.00 0.00 61.00 64.29 2sbl s PRO 330 Cb -0.30 -2.77 0.94 0.00 0.04 0.00 0.00 34.50 32.41 2sbl s PRO 330 CO 0.25 -0.73 1.84 0.45 0.04 0.00 0.00 177.00 178.86 2sbl h HIS 331 N 2.56 0.72 0.00 0.56 3.86 -1.80 -2.24 115.15 118.81 2sbl h HIS 331 Ca -0.51 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 58.72 2sbl h HIS 331 Cb 1.26 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 29.50 2sbl h HIS 331 CO 0.51 0.21 -0.01 -0.24 0.86 0.00 0.00 177.93 179.26 2sbl h VAL 332 N 0.56 0.06 -0.01 2.45 3.04 -1.50 -2.30 116.25 118.54 2sbl h VAL 332 Ca 0.48 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.98 2sbl h VAL 332 Cb 0.98 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 31.44 2sbl h VAL 332 CO -0.22 0.01 -0.42 1.33 -1.01 0.00 0.00 177.57 177.26 2sbl n VAL 333 N -3.15 0.00 0.30 1.51 0.24 -0.85 -4.62 118.33 111.76 2sbl n VAL 333 Ca -0.02 -0.29 0.12 0.00 -2.04 0.00 0.00 64.34 62.11 2sbl n VAL 333 Cb 0.15 1.18 0.66 0.00 -1.47 0.00 0.00 33.84 34.36 2sbl n VAL 333 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2sbl h GLN 334 N 1.65 0.00 0.00 7.34 4.20 -1.35 -3.13 115.11 123.82 2sbl h GLN 334 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2sbl h GLN 334 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2sbl h GLN 334 CO 0.00 0.00 -0.95 0.28 -0.67 0.00 0.00 178.83 177.49 2sbl n VAL 335 N -2.69 0.04 -4.36 -0.54 0.31 -1.26 -5.01 118.33 104.82 2sbl n VAL 335 Ca -0.02 0.01 -0.27 0.00 -0.01 0.00 0.00 64.34 64.06 2sbl n VAL 335 Cb 0.42 -1.48 -0.17 0.00 -0.91 0.00 0.00 33.84 31.70 2sbl n VAL 335 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2sbl s SER 336 N -5.03 2.11 -0.05 4.52 0.15 -1.18 -5.01 113.70 109.21 2sbl s SER 336 Ca 0.00 -0.35 0.11 0.00 0.70 0.00 0.00 55.95 56.41 2sbl s SER 336 Cb 0.00 -0.92 0.39 0.00 -1.71 0.00 0.00 66.02 63.78 2sbl s SER 336 CO 0.00 -0.01 1.26 0.00 1.20 0.00 0.00 173.24 175.69 2sbl n GLN 337 N 4.24 2.39 0.00 5.44 -0.00 -1.24 -3.70 117.38 124.52 2sbl n GLN 337 Ca -0.19 -1.56 0.00 0.00 -0.00 0.00 0.00 57.00 55.25 2sbl n GLN 337 Cb 0.51 -1.54 0.00 0.00 -0.00 0.00 0.00 30.24 29.21 2sbl n GLN 337 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2sbl n SER 338 N 0.56 1.05 0.28 2.61 7.64 -1.26 -4.87 113.62 119.64 2sbl n SER 338 Ca 0.14 -0.18 0.14 0.00 1.01 0.00 0.00 58.87 59.98 2sbl n SER 338 Cb 0.50 0.57 0.83 0.00 -1.01 0.00 0.00 64.21 65.10 2sbl n SER 338 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2sbl h ALA 339 N 0.00 1.43 -0.13 -0.43 0.00 -1.89 -0.89 119.26 117.35 2sbl h ALA 339 Ca 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.90 2sbl h ALA 339 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2sbl h ALA 339 CO 0.00 0.07 0.25 0.11 0.00 0.00 0.00 179.25 179.67 2sbl h TRP 340 N 0.00 0.00 0.00 0.00 5.08 -1.87 -0.78 115.95 118.38 2sbl h TRP 340 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2sbl h TRP 340 Cb 0.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.30 2sbl h TRP 340 CO 0.00 0.00 0.00 -1.33 -1.28 0.00 0.00 178.44 175.83 2sbl n MET 341 N -3.41 0.05 -2.73 0.12 2.81 -0.34 -4.49 117.12 109.14 2sbl n MET 341 Ca 0.01 0.09 -0.40 0.00 -1.81 0.00 0.00 57.70 55.58 2sbl n MET 341 Cb 0.35 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.30 2sbl n MET 341 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2sbl s THR 342 N -2.94 4.02 0.49 2.03 -4.23 -0.30 -4.91 115.64 109.80 2sbl s THR 342 Ca 0.13 2.02 0.20 0.00 -1.18 0.00 0.00 61.69 62.87 2sbl s THR 342 Cb 0.16 -4.28 0.36 0.00 1.34 0.00 0.00 72.50 70.08 2sbl s THR 342 CO 0.42 0.47 2.00 0.44 -0.54 0.00 0.00 174.62 177.42 2sbl h ASP 343 N 4.08 0.13 -0.30 3.99 5.19 -1.89 -0.55 116.42 127.07 2sbl h ASP 343 Ca -0.45 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 55.97 2sbl h ASP 343 Cb 1.20 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.67 2sbl h ASP 343 CO 0.68 0.08 0.19 -0.33 -3.12 0.00 0.00 179.24 176.73 2sbl h GLU 344 N 0.15 0.38 -0.33 3.56 3.07 -1.91 -1.83 114.58 117.66 2sbl h GLU 344 Ca 0.25 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 58.96 2sbl h GLU 344 Cb 0.78 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.59 2sbl h GLU 344 CO -0.03 0.25 -0.25 1.49 -1.40 0.00 0.00 179.01 179.06 2sbl h GLU 345 N 0.39 0.76 -0.40 2.33 4.57 -1.38 0.13 114.58 120.98 2sbl h GLU 345 Ca 0.11 -0.37 0.08 0.00 -1.18 0.00 0.00 59.36 58.00 2sbl h GLU 345 Cb -0.03 -0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.47 2sbl h GLU 345 CO -0.03 1.00 -0.16 0.35 -1.18 0.00 0.00 179.01 178.98 2sbl h PHE 346 N 0.54 -0.39 -0.23 0.92 3.57 -1.26 0.25 116.94 120.33 2sbl h PHE 346 Ca 0.06 0.04 -0.18 0.00 3.53 0.00 0.00 57.97 61.42 2sbl h PHE 346 Cb 0.82 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 2sbl h PHE 346 CO 0.07 -0.24 -0.58 0.00 -2.23 0.00 0.00 178.31 175.32 2sbl h ALA 347 N 1.25 0.53 -0.67 2.41 0.00 -1.15 -3.28 119.26 118.35 2sbl h ALA 347 Ca 0.20 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2sbl h ALA 347 Cb 0.38 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2sbl h ALA 347 CO -0.46 0.69 0.34 -0.09 0.00 0.00 0.00 179.25 179.73 2sbl h ARG 348 N 0.56 0.96 0.00 0.00 2.43 -0.05 -0.72 114.38 117.57 2sbl h ARG 348 Ca 0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2sbl h ARG 348 Cb 1.17 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2sbl h ARG 348 CO 0.12 0.75 0.00 0.93 -1.51 0.00 0.00 179.97 180.26 2sbl h GLU 349 N 0.93 0.00 0.00 0.20 5.08 -1.03 -0.59 114.58 119.18 2sbl h GLU 349 Ca 0.23 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 2sbl h GLU 349 Cb 0.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2sbl h GLU 349 CO -0.03 0.00 -0.03 0.52 -1.00 0.00 0.00 179.01 178.46 2sbl h MET 350 N 0.00 0.00 -0.00 2.33 2.86 -1.19 0.16 114.93 119.09 2sbl h MET 350 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2sbl h MET 350 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2sbl h MET 350 CO 0.00 0.03 -0.18 0.44 1.06 0.00 0.00 176.91 178.26 2sbl n ILE 351 N -3.15 0.00 -1.62 -1.22 -5.35 -0.56 -4.34 119.36 103.12 2sbl n ILE 351 Ca 0.00 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 2sbl n ILE 351 Cb 0.31 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 2sbl n ILE 351 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2sbl n ALA 352 N -0.68 1.55 -2.19 -1.28 0.00 -0.34 -2.79 120.51 114.77 2sbl n ALA 352 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2sbl n ALA 352 Cb 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.33 2sbl n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2sbl n GLY 353 N 0.00 2.52 0.33 0.00 0.00 0.56 -4.86 105.19 103.72 2sbl n GLY 353 Ca 0.00 -2.05 0.11 0.00 0.00 0.00 0.00 46.02 44.08 2sbl n GLY 353 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2sbl h VAL 354 N 0.01 0.93 -2.19 1.61 -1.51 -1.84 -3.27 116.25 109.99 2sbl h VAL 354 Ca 0.00 -0.09 -0.58 0.00 -1.23 0.00 0.00 66.70 64.80 2sbl h VAL 354 Cb 0.00 0.65 -0.42 0.00 -2.13 0.00 0.00 31.29 29.39 2sbl h VAL 354 CO 0.00 0.05 -0.73 -3.20 -1.23 0.00 0.00 177.57 172.46 2sbl n ASN 355 N -4.47 3.43 -0.49 4.19 5.15 -1.26 -4.27 115.26 117.54 2sbl n ASN 355 Ca 0.05 -3.43 0.02 0.00 -0.60 0.00 0.00 54.58 50.62 2sbl n ASN 355 Cb 0.29 -0.61 0.07 0.00 -0.53 0.00 0.00 39.78 39.00 2sbl n ASN 355 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2sbl n PRO 356 N 0.37 1.53 -1.71 1.20 -0.04 -1.23 -4.12 135.00 130.99 2sbl n PRO 356 Ca 0.29 -0.57 -0.04 0.00 -0.04 0.00 0.00 63.50 63.14 2sbl n PRO 356 Cb 0.44 -1.35 0.08 0.00 -0.04 0.00 0.00 33.50 32.63 2sbl n PRO 356 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2sbl n VAL 358 N -0.51 0.00 -2.02 0.00 0.31 -1.26 -5.05 118.33 109.80 2sbl n VAL 358 Ca 0.20 -0.12 -0.40 0.00 -0.01 0.00 0.00 64.34 64.01 2sbl n VAL 358 Cb 0.90 0.43 -0.01 0.00 -0.91 0.00 0.00 33.84 34.24 2sbl n VAL 358 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2sbl s ILE 359 N -2.27 2.52 0.18 2.52 2.07 -1.26 -4.80 121.20 120.16 2sbl s ILE 359 Ca -0.01 0.51 0.07 0.00 -1.41 0.00 0.00 60.65 59.81 2sbl s ILE 359 Cb 0.03 -3.32 -0.04 0.00 0.13 0.00 0.00 42.46 39.26 2sbl s ILE 359 CO 0.19 0.11 -0.15 -0.13 -1.91 0.00 0.00 174.94 173.06 2sbl s ARG 360 N -1.97 1.26 -0.04 3.50 0.52 -0.43 -4.81 118.95 116.97 2sbl s ARG 360 Ca 0.52 -1.50 -0.25 0.00 -0.52 0.00 0.00 55.73 53.98 2sbl s ARG 360 Cb -0.41 -1.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.93 2sbl s ARG 360 CO 0.55 0.19 0.75 0.20 0.02 0.00 0.00 175.30 177.01 2sbl s GLY 361 N -3.08 2.69 -0.10 -3.53 0.00 0.72 -0.35 107.32 103.67 2sbl s GLY 361 Ca 0.19 0.21 -0.19 0.00 0.00 0.00 0.00 44.72 44.93 2sbl s GLY 361 CO 0.06 1.24 0.53 -2.27 0.00 0.00 0.00 173.10 172.66 2sbl s LEU 362 N 0.72 4.30 0.00 0.66 2.96 -0.27 -4.81 118.68 122.23 2sbl s LEU 362 Ca 0.40 0.92 0.02 0.00 -0.22 0.00 0.00 54.13 55.24 2sbl s LEU 362 Cb -0.19 -2.79 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 2sbl s LEU 362 CO 0.20 -0.01 0.25 -0.62 -1.32 0.00 0.00 176.35 174.85 2sbl n GLU 363 N 3.62 3.75 -3.88 1.98 1.02 -1.26 -4.67 120.64 121.19 2sbl n GLU 363 Ca -0.06 -0.23 -0.10 0.00 -0.02 0.00 0.00 57.16 56.75 2sbl n GLU 363 Cb 0.52 -0.75 -0.09 0.00 -0.02 0.00 0.00 31.44 31.10 2sbl n GLU 363 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2sbl s GLU 364 N -0.78 0.65 -0.00 3.49 -1.05 -1.26 -5.03 118.70 114.71 2sbl s GLU 364 Ca 0.01 -0.69 0.01 0.00 -0.15 0.00 0.00 54.97 54.15 2sbl s GLU 364 Cb 0.01 0.26 -0.00 0.00 -0.44 0.00 0.00 34.13 33.97 2sbl s GLU 364 CO 0.05 -0.18 -0.04 0.12 0.95 0.00 0.00 175.26 176.16 2sbl s PHE 365 N -2.62 0.38 0.86 4.83 5.36 -1.26 -4.24 117.98 121.29 2sbl s PHE 365 Ca -0.05 -0.07 -0.10 0.00 -0.96 0.00 0.00 56.93 55.75 2sbl s PHE 365 Cb -0.01 -0.25 0.11 0.00 -0.34 0.00 0.00 43.02 42.53 2sbl s PHE 365 CO -0.04 -0.01 1.13 -2.14 -1.46 0.00 0.00 175.22 172.70 2sbl s PRO 366 N -0.05 1.46 0.31 10.12 0.02 -1.26 -5.10 135.00 140.51 2sbl s PRO 366 Ca 0.01 1.45 -0.29 0.00 0.02 0.00 0.00 61.00 62.19 2sbl s PRO 366 Cb -0.02 -1.79 -0.13 0.00 0.02 0.00 0.00 34.50 32.58 2sbl s PRO 366 CO -0.00 -2.29 1.25 -0.35 -0.33 0.00 0.00 177.00 175.29 2sbl n PRO 367 N -3.93 1.95 -3.94 5.54 -0.04 -1.26 -4.95 135.00 128.37 2sbl n PRO 367 Ca 0.11 0.69 -0.26 0.00 -0.04 0.00 0.00 63.50 63.99 2sbl n PRO 367 Cb 0.52 -2.24 -0.03 0.00 -0.04 0.00 0.00 33.50 31.71 2sbl n PRO 367 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2sbl s LYS 368 N -1.56 3.43 0.15 0.54 -0.14 -1.26 -3.17 119.74 117.72 2sbl s LYS 368 Ca 0.58 -0.59 0.06 0.00 -1.36 0.00 0.00 55.97 54.67 2sbl s LYS 368 Cb -0.61 -2.97 -0.04 0.00 -1.68 0.00 0.00 37.83 32.53 2sbl s LYS 368 CO 0.60 0.53 0.01 0.45 -0.76 0.00 0.00 175.35 176.18 2sbl s SER 369 N -3.17 4.92 0.00 2.83 0.15 -1.25 -4.99 113.70 112.18 2sbl s SER 369 Ca 0.34 -0.30 0.10 0.00 0.70 0.00 0.00 55.95 56.80 2sbl s SER 369 Cb -0.11 -1.11 0.28 0.00 -1.71 0.00 0.00 66.02 63.37 2sbl s SER 369 CO 0.28 0.12 1.22 0.59 1.20 0.00 0.00 173.24 176.65 2sbl n ASN 370 N 0.09 2.84 -4.78 5.45 4.13 -1.26 -5.00 115.26 116.72 2sbl n ASN 370 Ca -0.10 -1.96 -0.35 0.00 1.68 0.00 0.00 54.58 53.85 2sbl n ASN 370 Cb 0.54 -0.21 -0.02 0.00 -1.54 0.00 0.00 39.78 38.55 2sbl n ASN 370 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2sbl s LEU 371 N -0.99 3.85 -0.10 3.41 1.43 -1.26 -4.94 118.68 120.08 2sbl s LEU 371 Ca 0.22 2.10 -0.29 0.00 -1.03 0.00 0.00 54.13 55.12 2sbl s LEU 371 Cb 0.12 -4.49 -0.05 0.00 0.03 0.00 0.00 46.19 41.79 2sbl s LEU 371 CO 0.15 -0.97 1.70 -0.62 0.23 0.00 0.00 176.35 176.84 2sbl s ASP 372 N -1.77 6.52 0.27 2.29 2.15 -1.26 -4.91 116.67 119.96 2sbl s ASP 372 Ca 0.68 2.10 0.01 0.00 0.43 0.00 0.00 52.55 55.77 2sbl s ASP 372 Cb -0.22 -2.53 0.63 0.00 -0.30 0.00 0.00 42.92 40.50 2sbl s ASP 372 CO 0.26 -1.07 1.71 -0.65 -0.17 0.00 0.00 175.17 175.24 2sbl h PRO 373 N 10.20 0.41 0.00 4.34 0.11 -1.92 0.35 132.00 145.49 2sbl h PRO 373 Ca -0.39 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 2sbl h PRO 373 Cb 1.18 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2sbl h PRO 373 CO 0.96 0.27 -0.04 0.00 -0.21 0.00 0.00 178.00 178.98 2sbl h ALA 374 N 1.66 1.51 0.00 -0.75 0.00 -1.91 0.14 119.26 119.91 2sbl h ALA 374 Ca 0.51 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 55.14 2sbl h ALA 374 Cb 0.90 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 2sbl h ALA 374 CO -0.49 0.06 -1.89 -0.89 0.00 0.00 0.00 179.25 176.04 2sbl n ILE 375 N -3.89 0.89 0.37 0.00 5.41 -0.40 -4.76 119.36 116.98 2sbl n ILE 375 Ca -0.03 -0.49 0.04 0.00 1.00 0.00 0.00 62.75 63.27 2sbl n ILE 375 Cb 0.13 -0.78 -0.03 0.00 -0.71 0.00 0.00 39.64 38.25 2sbl n ILE 375 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2sbl n TYR 376 N -2.61 0.00 -4.46 1.39 4.01 -0.02 -4.99 117.16 110.47 2sbl n TYR 376 Ca -0.23 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 2sbl n TYR 376 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.91 2sbl n TYR 376 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2sbl n GLY 377 N 1.09 0.06 3.72 2.72 0.00 0.47 -3.33 105.19 109.93 2sbl n GLY 377 Ca 0.02 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 2sbl n GLY 377 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2sbl s ASP 378 N -4.00 7.30 -0.44 1.61 2.15 -1.26 -4.43 116.67 117.59 2sbl s ASP 378 Ca 0.00 1.81 0.06 0.00 0.43 0.00 0.00 52.55 54.84 2sbl s ASP 378 Cb 0.00 -2.58 0.20 0.00 -0.30 0.00 0.00 42.92 40.24 2sbl s ASP 378 CO 0.00 -0.29 0.44 0.00 -0.17 0.00 0.00 175.17 175.15 2sbl n GLN 379 N 3.64 0.65 -4.46 4.34 1.13 -1.26 -2.67 117.38 118.74 2sbl n GLN 379 Ca 0.06 -3.39 -0.25 0.00 -1.94 0.00 0.00 57.00 51.48 2sbl n GLN 379 Cb 0.49 -1.60 -0.13 0.00 0.11 0.00 0.00 30.24 29.11 2sbl n GLN 379 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2sbl s SER 380 N -0.65 2.48 0.17 1.08 0.01 -1.26 -3.81 113.70 111.72 2sbl s SER 380 Ca 0.33 -0.60 -0.31 0.00 1.31 0.00 0.00 55.95 56.68 2sbl s SER 380 Cb 0.08 -0.17 -0.10 0.00 0.21 0.00 0.00 66.02 66.04 2sbl s SER 380 CO -0.16 0.11 1.55 -0.55 0.41 0.00 0.00 173.24 174.61 2sbl s SER 381 N -1.53 6.60 0.00 2.44 0.15 -1.19 -4.87 113.70 115.30 2sbl s SER 381 Ca 0.07 2.61 0.17 0.00 0.70 0.00 0.00 55.95 59.49 2sbl s SER 381 Cb -0.09 -2.59 0.51 0.00 -1.71 0.00 0.00 66.02 62.13 2sbl s SER 381 CO 0.03 -0.81 1.40 0.29 1.20 0.00 0.00 173.24 175.35 2sbl n LYS 382 N 3.89 1.94 -2.26 5.44 5.02 -1.26 -4.91 118.16 126.02 2sbl n LYS 382 Ca 0.13 -1.44 -0.42 0.00 -2.02 0.00 0.00 58.31 54.56 2sbl n LYS 382 Cb 0.39 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 2sbl n LYS 382 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2sbl s ILE 383 N -1.56 3.38 -0.16 -0.18 1.01 -1.26 -4.97 121.20 117.46 2sbl s ILE 383 Ca 0.31 1.09 -0.06 0.00 0.00 0.00 0.00 60.65 61.99 2sbl s ILE 383 Cb 0.16 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 2sbl s ILE 383 CO 0.23 0.14 0.04 -0.89 0.00 0.00 0.00 174.94 174.46 2sbl s THR 384 N 0.38 4.60 0.39 2.92 2.01 -1.26 -4.82 115.64 119.86 2sbl s THR 384 Ca 0.58 -0.11 0.09 0.00 0.31 0.00 0.00 61.69 62.56 2sbl s THR 384 Cb -0.35 -3.04 0.31 0.00 0.01 0.00 0.00 72.50 69.43 2sbl s THR 384 CO 0.35 0.50 1.97 0.00 -0.69 0.00 0.00 174.62 176.75 2sbl h ALA 385 N 6.30 1.84 0.00 7.40 0.00 -1.98 -2.80 119.26 130.03 2sbl h ALA 385 Ca -0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2sbl h ALA 385 Cb 1.18 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2sbl h ALA 385 CO 0.66 0.03 -0.07 0.38 0.00 0.00 0.00 179.25 180.25 2sbl h ASP 386 N 0.60 0.00 0.71 0.00 2.03 -2.03 -1.63 116.42 116.10 2sbl h ASP 386 Ca 0.30 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.60 2sbl h ASP 386 Cb 0.39 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.89 2sbl h ASP 386 CO -0.10 0.07 -0.05 -1.54 -1.03 0.00 0.00 179.24 176.59 2sbl n SER 387 N -3.31 0.09 -4.66 4.15 3.41 -1.05 -4.84 113.62 107.40 2sbl n SER 387 Ca -0.01 0.05 -0.40 0.00 -0.26 0.00 0.00 58.87 58.25 2sbl n SER 387 Cb 0.25 -0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 2sbl n SER 387 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2sbl s LEU 388 N -2.76 4.15 -0.94 1.04 1.02 -0.61 -4.99 118.68 115.59 2sbl s LEU 388 Ca 0.22 0.81 -0.21 0.00 0.02 0.00 0.00 54.13 54.96 2sbl s LEU 388 Cb 0.20 -2.85 0.08 0.00 0.02 0.00 0.00 46.19 43.64 2sbl s LEU 388 CO 0.51 -0.24 1.27 -0.62 0.02 0.00 0.00 176.35 177.29 2sbl s ASP 389 N 1.16 6.51 -0.54 2.29 2.15 -1.26 -4.86 116.67 122.11 2sbl s ASP 389 Ca 0.28 -1.60 -0.04 0.00 0.43 0.00 0.00 52.55 51.62 2sbl s ASP 389 Cb -0.16 -2.49 0.11 0.00 -0.30 0.00 0.00 42.92 40.08 2sbl s ASP 389 CO 0.10 -1.34 2.65 0.18 -0.17 0.00 0.00 175.17 176.60 2sbl n LEU 390 N 7.86 6.67 -2.69 -1.34 7.99 -1.26 -4.86 117.00 129.38 2sbl n LEU 390 Ca 0.25 -4.21 -0.09 0.00 -0.01 0.00 0.00 56.01 51.95 2sbl n LEU 390 Cb 0.50 -1.21 -0.01 0.00 -0.11 0.00 0.00 43.42 42.59 2sbl n LEU 390 CO 0.60 1.75 -0.06 0.47 -1.51 0.00 0.00 177.39 178.63 2sbl n ASP 391 N 0.69 -2.21 0.00 -1.43 8.00 -1.26 -0.67 116.55 119.68 2sbl n ASP 391 Ca 0.50 0.22 0.00 0.00 0.71 0.00 0.00 54.79 56.22 2sbl n ASP 391 Cb 0.49 -1.95 0.00 0.00 -0.02 0.00 0.00 41.12 39.64 2sbl n ASP 391 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2sbl n GLY 392 N -0.69 2.29 3.81 0.44 0.00 -1.26 -5.08 105.19 104.70 2sbl n GLY 392 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2sbl n GLY 392 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2sbl s TYR 393 N -2.47 3.05 0.35 1.61 1.51 0.16 -5.07 117.35 116.49 2sbl s TYR 393 Ca 0.00 1.53 0.02 0.00 -1.01 0.00 0.00 57.07 57.61 2sbl s TYR 393 Cb 0.00 -3.00 -0.02 0.00 -0.11 0.00 0.00 41.96 38.83 2sbl s TYR 393 CO 0.00 -0.90 0.53 0.95 -1.11 0.00 0.00 175.55 175.02 2sbl s THR 394 N -2.30 4.76 0.20 -0.71 -4.23 -1.26 -4.46 115.64 107.65 2sbl s THR 394 Ca 0.64 -0.64 -0.11 0.00 -1.18 0.00 0.00 61.69 60.40 2sbl s THR 394 Cb -0.15 -3.72 0.14 0.00 1.34 0.00 0.00 72.50 70.11 2sbl s THR 394 CO 0.30 -0.42 1.71 -0.03 -0.54 0.00 0.00 174.62 175.63 2sbl h MET 395 N 0.77 0.23 -0.62 3.99 4.05 -1.96 0.55 114.93 121.94 2sbl h MET 395 Ca -0.49 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 58.94 2sbl h MET 395 Cb 1.23 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.94 2sbl h MET 395 CO 0.59 0.15 0.39 -0.44 0.23 0.00 0.00 176.91 177.84 2sbl h ASP 396 N 0.24 0.65 0.54 1.39 5.19 -1.99 0.10 116.42 122.55 2sbl h ASP 396 Ca 0.29 -0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.67 2sbl h ASP 396 Cb 0.42 -0.15 0.01 0.00 0.18 0.00 0.00 39.33 39.78 2sbl h ASP 396 CO -0.38 0.46 -0.26 -0.33 -3.12 0.00 0.00 179.24 175.61 2sbl h GLU 397 N 0.78 -0.70 -0.83 3.56 5.08 -1.54 -0.96 114.58 119.97 2sbl h GLU 397 Ca 0.24 0.05 0.09 0.00 -1.00 0.00 0.00 59.36 58.74 2sbl h GLU 397 Cb -0.02 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 2sbl h GLU 397 CO -0.08 -0.44 0.48 0.00 -1.00 0.00 0.00 179.01 177.97 2sbl h ALA 398 N -0.36 1.18 -0.11 3.43 0.00 -0.72 0.83 119.26 123.52 2sbl h ALA 398 Ca -0.07 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2sbl h ALA 398 Cb 0.58 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2sbl h ALA 398 CO 0.12 0.13 -0.05 1.25 0.00 0.00 0.00 179.25 180.70 2sbl h LEU 399 N 0.82 0.23 -0.96 0.00 5.85 -0.95 0.12 115.31 120.42 2sbl h LEU 399 Ca 0.40 -0.42 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2sbl h LEU 399 Cb 0.34 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2sbl h LEU 399 CO -0.24 0.60 0.37 1.23 -0.34 0.00 0.00 178.44 180.06 2sbl h GLY 400 N -0.13 1.19 0.63 3.75 0.00 -0.47 -0.34 103.07 107.70 2sbl h GLY 400 Ca 0.02 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2sbl h GLY 400 CO 0.02 0.55 0.00 -1.14 0.00 0.00 0.00 176.54 175.97 2sbl n SER 401 N -4.32 0.19 -3.45 0.19 3.41 0.22 -4.90 113.62 104.96 2sbl n SER 401 Ca 0.08 -1.25 -0.18 0.00 -0.26 0.00 0.00 58.87 57.26 2sbl n SER 401 Cb 0.14 -0.01 0.09 0.00 -0.26 0.00 0.00 64.21 64.17 2sbl n SER 401 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2sbl n ARG 402 N -0.76 -6.88 -0.27 4.33 5.12 -0.14 -4.94 116.66 113.12 2sbl n ARG 402 Ca 0.19 0.84 0.07 0.00 -1.93 0.00 0.00 57.85 57.02 2sbl n ARG 402 Cb 0.12 -5.86 0.19 0.00 -1.16 0.00 0.00 32.46 25.75 2sbl n ARG 402 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2sbl n ARG 403 N -4.29 2.87 -4.82 5.56 1.74 0.36 -4.94 116.66 113.13 2sbl n ARG 403 Ca -0.23 -2.35 -0.33 0.00 -0.77 0.00 0.00 57.85 54.17 2sbl n ARG 403 Cb 0.65 -1.49 -0.16 0.00 -1.02 0.00 0.00 32.46 30.44 2sbl n ARG 403 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2sbl s LEU 404 N -1.77 2.35 0.14 0.55 2.96 -1.25 -0.11 118.68 121.56 2sbl s LEU 404 Ca 0.30 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2sbl s LEU 404 Cb 0.21 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 2sbl s LEU 404 CO 0.12 0.12 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.83 2sbl s PHE 405 N 0.57 1.21 0.05 5.38 0.40 0.09 -1.12 117.98 124.55 2sbl s PHE 405 Ca -0.11 -0.81 -0.12 0.00 -0.60 0.00 0.00 56.93 55.30 2sbl s PHE 405 Cb -0.16 -0.63 0.01 0.00 0.51 0.00 0.00 43.02 42.75 2sbl s PHE 405 CO 0.04 0.02 0.25 0.00 0.70 0.00 0.00 175.22 176.23 2sbl s MET 406 N -3.78 0.77 -0.41 0.44 0.23 0.53 -0.36 119.30 116.72 2sbl s MET 406 Ca 0.17 -0.60 -0.00 0.00 -1.03 0.00 0.00 55.69 54.23 2sbl s MET 406 Cb 0.03 0.33 0.11 0.00 -1.53 0.00 0.00 34.83 33.77 2sbl s MET 406 CO 0.00 -0.24 0.17 -1.17 -2.03 0.00 0.00 175.02 171.75 2sbl s LEU 407 N -2.15 5.03 -0.36 0.18 1.98 -0.45 -1.32 118.68 121.60 2sbl s LEU 407 Ca -0.04 -2.19 -0.06 0.00 -2.89 0.00 0.00 54.13 48.94 2sbl s LEU 407 Cb -0.00 -1.75 0.05 0.00 0.66 0.00 0.00 46.19 45.15 2sbl s LEU 407 CO -0.04 -0.46 0.13 -0.62 -1.89 0.00 0.00 176.35 173.47 2sbl s ASP 408 N 1.30 5.33 -0.01 3.68 2.15 -1.26 -1.15 116.67 126.70 2sbl s ASP 408 Ca 0.10 -1.31 0.12 0.00 0.43 0.00 0.00 52.55 51.90 2sbl s ASP 408 Cb -0.21 -1.87 0.35 0.00 -0.30 0.00 0.00 42.92 40.88 2sbl s ASP 408 CO -0.05 -0.38 1.29 -1.22 -0.17 0.00 0.00 175.17 174.64 2sbl n TYR 409 N 4.79 0.54 0.37 -5.34 4.01 0.21 -4.78 117.16 116.95 2sbl n TYR 409 Ca -0.11 -0.52 -0.19 0.00 -0.16 0.00 0.00 57.90 56.92 2sbl n TYR 409 Cb 0.44 -0.04 -0.10 0.00 -0.31 0.00 0.00 39.34 39.33 2sbl n TYR 409 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2sbl h HIS 410 N 2.20 -1.34 0.00 -0.72 2.76 -1.74 -1.34 115.15 114.97 2sbl h HIS 410 Ca 0.00 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.12 2sbl h HIS 410 Cb 0.79 0.50 -0.01 0.00 1.55 0.00 0.00 27.41 30.24 2sbl h HIS 410 CO 0.27 -0.70 -0.24 -0.44 -1.30 0.00 0.00 177.93 175.52 2sbl h ASP 411 N -1.11 0.00 -0.03 3.26 3.32 -1.92 -0.31 116.42 119.64 2sbl h ASP 411 Ca -0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2sbl h ASP 411 Cb 0.92 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.47 2sbl h ASP 411 CO 0.03 0.24 -0.03 0.40 -1.72 0.00 0.00 179.24 178.16 2sbl h ILE 412 N 0.00 1.39 0.00 0.35 2.04 -1.84 -3.37 117.51 116.09 2sbl h ILE 412 Ca -0.00 -1.21 -0.26 0.00 1.00 0.00 0.00 64.86 64.38 2sbl h ILE 412 Cb 0.53 2.15 -0.05 0.00 -0.74 0.00 0.00 36.82 38.72 2sbl h ILE 412 CO 0.03 0.32 -1.64 0.49 0.00 0.00 0.00 178.15 177.35 2sbl n PHE 413 N -4.79 1.00 -0.27 1.37 3.01 -0.52 -4.52 117.46 112.74 2sbl n PHE 413 Ca -0.08 0.36 -0.01 0.00 1.01 0.00 0.00 57.45 58.73 2sbl n PHE 413 Cb 0.28 -1.17 0.11 0.00 -0.01 0.00 0.00 39.48 38.70 2sbl n PHE 413 CO 0.00 0.00 0.00 1.98 1.01 0.00 0.00 176.76 179.75 2sbl h MET 414 N 0.00 0.81 -0.05 -1.08 4.05 -1.20 0.14 114.93 117.59 2sbl h MET 414 Ca -0.26 -0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.13 2sbl h MET 414 Cb 1.92 -0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 32.54 2sbl h MET 414 CO 0.07 0.53 0.18 -1.00 0.23 0.00 0.00 176.91 176.93 2sbl h PRO 415 N 0.83 0.00 0.00 0.39 0.13 -1.79 -3.05 132.00 128.51 2sbl h PRO 415 Ca 0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.46 2sbl h PRO 415 Cb 0.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.29 2sbl h PRO 415 CO -0.17 0.00 -1.54 0.66 -0.23 0.00 0.00 178.00 176.72 2sbl n TYR 416 N -3.20 0.00 -0.25 1.56 4.01 0.33 -4.71 117.16 114.90 2sbl n TYR 416 Ca -0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.74 2sbl n TYR 416 Cb 0.26 -0.30 0.14 0.00 -0.31 0.00 0.00 39.34 39.13 2sbl n TYR 416 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2sbl h VAL 417 N 0.00 0.85 -0.40 -0.72 2.07 -1.05 -1.17 116.25 115.83 2sbl h VAL 417 Ca 0.00 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 2sbl h VAL 417 Cb 0.70 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 2sbl h VAL 417 CO 0.00 0.11 -0.03 -0.09 0.02 0.00 0.00 177.57 177.58 2sbl h ARG 418 N 0.62 0.66 -0.08 1.57 2.43 -1.84 -0.68 114.38 117.06 2sbl h ARG 418 Ca 0.36 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 59.24 2sbl h ARG 418 Cb 0.37 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2sbl h ARG 418 CO -0.27 0.70 -0.41 1.96 -1.51 0.00 0.00 179.97 180.43 2sbl h GLN 419 N 0.62 0.42 -0.48 0.20 4.20 -1.69 -3.00 115.11 115.38 2sbl h GLN 419 Ca 0.12 -0.35 0.02 0.00 0.06 0.00 0.00 58.65 58.50 2sbl h GLN 419 Cb 0.43 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.25 2sbl h GLN 419 CO 0.02 0.98 0.29 0.82 -0.67 0.00 0.00 178.83 180.28 2sbl h ILE 420 N -0.04 1.07 0.00 2.54 2.04 -0.98 -1.95 117.51 120.20 2sbl h ILE 420 Ca -0.03 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2sbl h ILE 420 Cb 1.07 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2sbl h ILE 420 CO 0.09 0.11 0.00 0.59 0.00 0.00 0.00 178.15 178.93 2sbl n ASN 421 N -4.80 0.57 -0.08 1.72 4.13 -0.29 -0.92 115.26 115.60 2sbl n ASN 421 Ca 0.03 0.68 0.13 0.00 1.68 0.00 0.00 54.58 57.09 2sbl n ASN 421 Cb 0.05 -0.78 0.43 0.00 -1.54 0.00 0.00 39.78 37.94 2sbl n ASN 421 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2sbl n GLN 422 N -2.17 0.35 -2.62 3.52 6.02 -0.74 -4.82 117.38 116.92 2sbl n GLN 422 Ca 0.01 -0.16 -0.37 0.00 -0.01 0.00 0.00 57.00 56.47 2sbl n GLN 422 Cb 0.16 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 29.88 2sbl n GLN 422 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2sbl s LEU 423 N -2.76 4.23 0.23 1.08 1.43 -0.09 -4.98 118.68 117.80 2sbl s LEU 423 Ca 0.19 1.98 -0.30 0.00 -1.03 0.00 0.00 54.13 54.97 2sbl s LEU 423 Cb 0.19 -4.10 -0.09 0.00 0.03 0.00 0.00 46.19 42.21 2sbl s LEU 423 CO 0.58 -0.33 1.36 0.21 0.23 0.00 0.00 176.35 178.40 2sbl s ASN 424 N -1.55 6.79 -1.17 2.29 2.47 -1.26 -3.06 114.94 119.45 2sbl s ASN 424 Ca 0.54 2.53 -0.02 0.00 0.42 0.00 0.00 52.86 56.33 2sbl s ASN 424 Cb -0.21 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 36.97 2sbl s ASN 424 CO 0.27 -0.60 0.26 -1.20 -3.72 0.00 0.00 177.10 172.11 2sbl n SER 425 N 2.42 -4.68 -3.71 -4.21 7.64 -1.26 -5.01 113.62 104.80 2sbl n SER 425 Ca 0.06 -0.13 -0.17 0.00 1.01 0.00 0.00 58.87 59.64 2sbl n SER 425 Cb 0.42 -3.66 -0.17 0.00 -1.01 0.00 0.00 64.21 59.79 2sbl n SER 425 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2sbl s ALA 426 N -2.89 0.09 -0.16 -0.43 0.00 -1.17 -4.49 121.76 112.70 2sbl s ALA 426 Ca 0.13 0.32 -0.07 0.00 0.00 0.00 0.00 51.96 52.33 2sbl s ALA 426 Cb -0.06 -0.49 0.06 0.00 0.00 0.00 0.00 23.12 22.63 2sbl s ALA 426 CO 0.16 -0.33 0.36 0.21 0.00 0.00 0.00 175.76 176.16 2sbl s LYS 427 N 1.70 0.31 0.26 0.00 2.47 -0.77 -4.22 119.74 119.48 2sbl s LYS 427 Ca -0.02 0.79 -0.01 0.00 -1.56 0.00 0.00 55.97 55.18 2sbl s LYS 427 Cb -0.12 0.03 -0.03 0.00 -1.46 0.00 0.00 37.83 36.26 2sbl s LYS 427 CO -0.04 -0.20 0.28 -0.08 0.16 0.00 0.00 175.35 175.47 2sbl s THR 428 N 1.79 0.00 0.13 3.43 -1.32 -1.26 -3.82 115.64 114.59 2sbl s THR 428 Ca -0.06 -1.84 0.06 0.00 -1.21 0.00 0.00 61.69 58.63 2sbl s THR 428 Cb -0.10 -2.48 -0.04 0.00 -1.51 0.00 0.00 72.50 68.37 2sbl s THR 428 CO -0.11 0.00 -0.13 -0.31 -2.21 0.00 0.00 174.62 171.85 2sbl s TYR 429 N -3.77 1.38 -0.03 9.09 1.51 -1.26 -4.94 117.35 119.33 2sbl s TYR 429 Ca 0.36 -0.59 -0.21 0.00 -1.01 0.00 0.00 57.07 55.61 2sbl s TYR 429 Cb 0.03 -0.71 -0.05 0.00 -0.11 0.00 0.00 41.96 41.12 2sbl s TYR 429 CO 0.17 0.14 0.62 0.00 -1.11 0.00 0.00 175.55 175.37 2sbl s ALA 430 N -2.41 3.44 0.23 3.71 0.00 -0.41 -4.88 121.76 121.45 2sbl s ALA 430 Ca 0.11 0.05 0.10 0.00 0.00 0.00 0.00 51.96 52.22 2sbl s ALA 430 Cb -0.03 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.25 2sbl s ALA 430 CO 0.03 0.08 -0.09 0.95 0.00 0.00 0.00 175.76 176.73 2sbl s THR 431 N 0.12 3.10 -0.03 0.00 -4.23 -1.26 -1.38 115.64 111.96 2sbl s THR 431 Ca 0.32 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.93 2sbl s THR 431 Cb -0.18 -2.60 -0.00 0.00 1.34 0.00 0.00 72.50 71.06 2sbl s THR 431 CO 0.17 -0.27 -0.12 -0.13 -0.54 0.00 0.00 174.62 173.73 2sbl s ARG 432 N -3.29 1.18 -0.06 3.99 0.52 -0.38 -0.62 118.95 120.29 2sbl s ARG 432 Ca 0.28 -0.40 0.04 0.00 -0.52 0.00 0.00 55.73 55.12 2sbl s ARG 432 Cb -0.07 -1.08 0.00 0.00 0.52 0.00 0.00 34.95 34.32 2sbl s ARG 432 CO 0.17 0.17 -0.16 0.99 0.02 0.00 0.00 175.30 176.49 2sbl s THR 433 N 0.08 1.38 -0.11 0.02 2.01 -0.30 -0.43 115.64 118.29 2sbl s THR 433 Ca -0.02 -0.66 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 2sbl s THR 433 Cb -0.09 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 2sbl s THR 433 CO 0.01 0.40 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.71 2sbl s ILE 434 N 0.27 4.24 -0.01 1.82 -1.09 0.05 -1.34 121.20 125.14 2sbl s ILE 434 Ca -0.09 -0.26 0.06 0.00 -2.23 0.00 0.00 60.65 58.13 2sbl s ILE 434 Cb -0.13 -2.81 -0.01 0.00 -1.58 0.00 0.00 42.46 37.92 2sbl s ILE 434 CO 0.03 0.56 -0.18 -0.76 -1.23 0.00 0.00 174.94 173.37 2sbl s LEU 435 N -0.44 2.04 -0.07 2.97 1.43 0.51 -0.69 118.68 124.43 2sbl s LEU 435 Ca 0.08 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2sbl s LEU 435 Cb -0.12 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 2sbl s LEU 435 CO 0.02 0.21 -0.12 0.12 0.23 0.00 0.00 176.35 176.82 2sbl s PHE 436 N -0.44 2.79 -0.36 0.29 5.36 0.10 -0.73 117.98 124.98 2sbl s PHE 436 Ca 0.07 -0.18 -0.18 0.00 -0.96 0.00 0.00 56.93 55.68 2sbl s PHE 436 Cb -0.07 -1.69 0.00 0.00 -0.34 0.00 0.00 43.02 40.92 2sbl s PHE 436 CO -0.01 0.17 0.52 -1.17 -1.46 0.00 0.00 175.22 173.27 2sbl s LEU 437 N -0.58 4.39 0.74 6.12 2.96 0.85 -0.23 118.68 132.94 2sbl s LEU 437 Ca 0.08 -0.10 -0.11 0.00 -0.22 0.00 0.00 54.13 53.79 2sbl s LEU 437 Cb -0.11 -2.59 0.03 0.00 0.50 0.00 0.00 46.19 44.02 2sbl s LEU 437 CO 0.01 -0.52 1.07 -0.13 -1.32 0.00 0.00 176.35 175.47 2sbl s ARG 438 N 2.42 2.58 0.61 1.98 0.52 0.09 -4.89 118.95 122.26 2sbl s ARG 438 Ca 0.19 0.92 0.29 0.00 -0.52 0.00 0.00 55.73 56.61 2sbl s ARG 438 Cb -0.15 -1.95 1.54 0.00 0.52 0.00 0.00 34.95 34.90 2sbl s ARG 438 CO 0.14 -1.34 1.93 0.93 0.02 0.00 0.00 175.30 176.98 2sbl h GLU 439 N -0.89 0.00 -0.47 3.54 4.39 -1.97 0.13 114.58 119.31 2sbl h GLU 439 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 2sbl h GLU 439 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 2sbl h GLU 439 CO 0.56 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 178.01 2sbl n ASP 440 N -3.54 2.37 0.00 1.42 5.75 -1.26 -4.94 116.55 116.35 2sbl n ASP 440 Ca 0.05 -2.09 0.00 0.00 -0.01 0.00 0.00 54.79 52.73 2sbl n ASP 440 Cb 0.55 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2sbl n ASP 440 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2sbl n GLY 441 N 0.97 0.89 3.97 6.12 0.00 0.45 -5.03 105.19 112.56 2sbl n GLY 441 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 2sbl n GLY 441 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2sbl s THR 442 N -3.63 4.53 0.08 2.61 -4.23 -1.26 -4.83 115.64 108.91 2sbl s THR 442 Ca 0.00 -0.82 -0.05 0.00 -1.18 0.00 0.00 61.69 59.65 2sbl s THR 442 Cb 0.00 -3.61 -0.05 0.00 1.34 0.00 0.00 72.50 70.18 2sbl s THR 442 CO 0.00 -0.30 0.31 -0.76 -0.54 0.00 0.00 174.62 173.33 2sbl s LEU 443 N -4.22 4.32 -0.14 4.79 1.43 -1.26 -0.73 118.68 122.87 2sbl s LEU 443 Ca 0.42 0.52 0.01 0.00 -1.03 0.00 0.00 54.13 54.05 2sbl s LEU 443 Cb -0.09 -3.01 0.02 0.00 0.03 0.00 0.00 46.19 43.13 2sbl s LEU 443 CO 0.33 0.15 -0.17 -0.75 0.23 0.00 0.00 176.35 176.14 2sbl s LYS 444 N -2.30 2.49 -0.45 1.70 2.20 0.68 -4.76 119.74 119.31 2sbl s LYS 444 Ca 0.35 -0.65 -0.29 0.00 -0.36 0.00 0.00 55.97 55.03 2sbl s LYS 444 Cb -0.13 -2.15 0.02 0.00 -1.51 0.00 0.00 37.83 34.06 2sbl s LYS 444 CO 0.22 -0.14 1.33 -1.25 -0.36 0.00 0.00 175.35 175.16 2sbl s PRO 445 N 1.17 3.59 0.05 4.03 0.04 -1.26 -0.72 135.00 141.90 2sbl s PRO 445 Ca -0.01 0.78 0.21 0.00 0.04 0.00 0.00 61.00 62.01 2sbl s PRO 445 Cb -0.14 -4.00 -0.18 0.00 0.04 0.00 0.00 34.50 30.22 2sbl s PRO 445 CO -0.06 -1.55 0.69 1.33 0.04 0.00 0.00 177.00 177.45 2sbl n VAL 446 N 7.00 0.59 -3.60 -0.36 0.24 0.13 -4.74 118.33 117.60 2sbl n VAL 446 Ca 0.15 -0.59 -0.14 0.00 -2.04 0.00 0.00 64.34 61.71 2sbl n VAL 446 Cb 0.48 -0.31 -0.07 0.00 -1.47 0.00 0.00 33.84 32.48 2sbl n VAL 446 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2sbl s ALA 447 N -3.24 -1.82 -0.12 2.33 0.00 -1.18 -4.31 121.76 113.42 2sbl s ALA 447 Ca -0.05 1.78 0.03 0.00 0.00 0.00 0.00 51.96 53.72 2sbl s ALA 447 Cb 0.11 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.37 2sbl s ALA 447 CO 0.84 -0.33 -0.21 0.42 0.00 0.00 0.00 175.76 176.48 2sbl s ILE 448 N -0.18 1.93 -0.19 0.00 1.01 -0.73 -0.77 121.20 122.28 2sbl s ILE 448 Ca -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.67 2sbl s ILE 448 Cb -0.03 -1.71 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 2sbl s ILE 448 CO 0.02 0.53 -0.03 -0.70 0.00 0.00 0.00 174.94 174.76 2sbl s GLU 449 N 0.71 3.55 -0.24 2.79 2.12 0.43 -0.52 118.70 127.54 2sbl s GLU 449 Ca -0.10 -0.56 -0.07 0.00 0.36 0.00 0.00 54.97 54.60 2sbl s GLU 449 Cb -0.16 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.24 2sbl s GLU 449 CO 0.01 0.04 0.05 -0.51 -0.54 0.00 0.00 175.26 174.31 2sbl s LEU 450 N 0.88 3.34 0.06 2.70 1.43 -0.12 -1.25 118.68 125.72 2sbl s LEU 450 Ca -0.00 -0.24 0.08 0.00 -1.03 0.00 0.00 54.13 52.94 2sbl s LEU 450 Cb -0.15 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 2sbl s LEU 450 CO 0.01 -0.03 -0.22 -0.44 0.23 0.00 0.00 176.35 175.91 2sbl s SER 451 N 1.55 2.65 0.15 2.29 0.01 -0.48 -1.16 113.70 118.72 2sbl s SER 451 Ca 0.06 -0.58 0.10 0.00 1.31 0.00 0.00 55.95 56.83 2sbl s SER 451 Cb -0.15 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.84 2sbl s SER 451 CO 0.02 0.15 -0.22 -0.76 0.41 0.00 0.00 173.24 172.85 2sbl s LEU 452 N -1.41 2.38 0.27 2.44 1.43 0.22 -1.29 118.68 122.72 2sbl s LEU 452 Ca 0.08 -0.80 -0.29 0.00 -1.03 0.00 0.00 54.13 52.09 2sbl s LEU 452 Cb -0.09 -1.01 -0.10 0.00 0.03 0.00 0.00 46.19 45.02 2sbl s LEU 452 CO 0.03 0.07 1.31 -2.16 0.23 0.00 0.00 176.35 175.83 2sbl s PRO 453 N -2.40 4.38 0.00 1.29 0.04 -1.26 -0.80 135.00 136.24 2sbl s PRO 453 Ca 0.14 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.33 2sbl s PRO 453 Cb -0.08 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2sbl s PRO 453 CO 0.07 -0.21 0.00 0.00 0.04 0.00 0.00 177.00 176.89 2sbl n ALA 461 N 1.69 -0.69 -2.36 8.56 0.00 -1.21 -4.80 120.51 121.70 2sbl n ALA 461 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 2sbl n ALA 461 Cb 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.85 2sbl n ALA 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2sbl s ALA 462 N 0.00 3.51 -0.02 0.00 0.00 -1.09 -4.99 121.76 119.17 2sbl s ALA 462 Ca 0.00 0.36 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 2sbl s ALA 462 Cb 0.00 -3.71 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 2sbl s ALA 462 CO 0.00 -1.48 1.06 0.08 0.00 0.00 0.00 175.76 175.41 2sbl s VAL 463 N 4.03 4.61 0.12 0.00 1.01 0.02 -4.90 120.40 125.28 2sbl s VAL 463 Ca 0.58 1.88 0.05 0.00 0.00 0.00 0.00 61.98 64.48 2sbl s VAL 463 Cb -0.21 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 2sbl s VAL 463 CO 0.20 0.10 -0.11 -0.44 0.00 0.00 0.00 175.10 174.84 2sbl s SER 464 N 1.10 1.71 -0.07 3.32 0.01 -1.26 -0.61 113.70 117.90 2sbl s SER 464 Ca 0.53 -0.86 -0.05 0.00 1.31 0.00 0.00 55.95 56.88 2sbl s SER 464 Cb -0.23 -0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.01 2sbl s SER 464 CO 0.25 -0.24 0.17 0.00 0.41 0.00 0.00 173.24 173.84 2sbl s GLN 465 N -2.99 0.17 -0.20 12.44 -2.07 -0.31 -4.99 119.66 121.71 2sbl s GLN 465 Ca 0.09 0.32 -0.11 0.00 -1.82 0.00 0.00 55.36 53.84 2sbl s GLN 465 Cb -0.02 -0.01 -0.05 0.00 -1.09 0.00 0.00 33.01 31.84 2sbl s GLN 465 CO 0.01 -0.08 0.18 0.08 -1.32 0.00 0.00 175.29 174.16 2sbl s VAL 466 N 0.56 5.37 -0.21 3.63 1.01 -1.26 -0.95 120.40 128.55 2sbl s VAL 466 Ca -0.04 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 2sbl s VAL 466 Cb -0.05 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 2sbl s VAL 466 CO -0.03 0.41 -0.05 -0.69 0.00 0.00 0.00 175.10 174.74 2sbl s VAL 467 N 0.50 3.34 0.28 2.92 1.01 0.32 -4.98 120.40 123.78 2sbl s VAL 467 Ca 0.10 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2sbl s VAL 467 Cb -0.12 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 2sbl s VAL 467 CO 0.00 0.44 0.42 -0.76 0.00 0.00 0.00 175.10 175.20 2sbl s LEU 468 N 1.33 4.21 0.47 3.92 2.01 -1.26 -1.77 118.68 127.58 2sbl s LEU 468 Ca 0.04 0.14 -0.24 0.00 0.01 0.00 0.00 54.13 54.08 2sbl s LEU 468 Cb -0.14 -2.96 -0.08 0.00 0.01 0.00 0.00 46.19 43.01 2sbl s LEU 468 CO -0.03 -0.16 1.30 -2.65 1.01 0.00 0.00 176.35 175.82 2sbl n PRO 469 N -1.53 1.87 -3.74 1.29 -0.02 -1.26 -4.75 135.00 126.86 2sbl n PRO 469 Ca -0.07 0.67 -0.12 0.00 -2.02 0.00 0.00 63.50 61.96 2sbl n PRO 469 Cb 0.57 -2.45 -0.11 0.00 -0.02 0.00 0.00 33.50 31.49 2sbl n PRO 469 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2sbl s ALA 470 N -1.24 -0.86 -0.33 3.55 0.00 -1.26 -5.02 121.76 116.59 2sbl s ALA 470 Ca 0.64 1.11 0.23 0.00 0.00 0.00 0.00 51.96 53.93 2sbl s ALA 470 Cb -0.47 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 2sbl s ALA 470 CO 0.55 -0.19 0.97 1.63 0.00 0.00 0.00 175.76 178.72 2sbl n LYS 471 N 3.37 0.51 -3.65 0.00 5.02 -1.26 -4.06 118.16 118.09 2sbl n LYS 471 Ca -0.17 0.03 -0.11 0.00 -2.02 0.00 0.00 58.31 56.05 2sbl n LYS 471 Cb 0.56 -1.70 -0.05 0.00 -0.02 0.00 0.00 35.03 33.82 2sbl n LYS 471 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2sbl s GLU 472 N -3.33 1.05 0.23 1.97 -1.05 -1.26 -4.87 118.70 111.43 2sbl s GLU 472 Ca -0.00 -0.69 0.00 0.00 -0.15 0.00 0.00 54.97 54.13 2sbl s GLU 472 Cb 0.12 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.27 2sbl s GLU 472 CO 0.81 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 177.03 2sbl n GLY 473 N -0.16 -2.61 0.36 -3.83 0.00 -1.26 -3.40 105.19 94.29 2sbl n GLY 473 Ca -0.16 -1.69 0.09 0.00 0.00 0.00 0.00 46.02 44.26 2sbl n GLY 473 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2sbl h VAL 474 N 0.00 0.87 -0.93 1.61 2.07 -1.95 -1.26 116.25 116.66 2sbl h VAL 474 Ca 0.00 -0.32 0.12 0.00 0.82 0.00 0.00 66.70 67.32 2sbl h VAL 474 Cb 0.00 -0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 29.55 2sbl h VAL 474 CO 0.00 0.17 0.60 -0.33 0.02 0.00 0.00 177.57 178.03 2sbl h GLU 475 N 0.94 0.85 -0.35 1.57 3.07 -1.96 0.22 114.58 118.92 2sbl h GLU 475 Ca 0.51 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 59.20 2sbl h GLU 475 Cb 0.59 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2sbl h GLU 475 CO -0.29 0.56 -0.27 0.66 -1.40 0.00 0.00 179.01 178.27 2sbl h SER 476 N 0.87 0.73 -0.28 1.42 4.64 -1.24 -1.32 113.55 118.37 2sbl h SER 476 Ca 0.45 -0.28 -0.12 0.00 -0.47 0.00 0.00 61.79 61.37 2sbl h SER 476 Cb 0.52 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2sbl h SER 476 CO -0.21 0.97 -0.24 0.74 -0.87 0.00 0.00 176.83 177.22 2sbl h THR 477 N 0.62 1.27 -0.60 2.95 2.02 -0.64 0.04 112.91 118.57 2sbl h THR 477 Ca 0.08 -1.35 -0.05 0.00 0.77 0.00 0.00 66.41 65.86 2sbl h THR 477 Cb 0.78 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 2sbl h THR 477 CO 0.06 0.45 0.19 0.40 0.37 0.00 0.00 175.52 176.99 2sbl h ILE 478 N 0.67 1.24 -0.55 3.11 2.04 -0.93 0.34 117.51 123.43 2sbl h ILE 478 Ca 0.09 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.14 2sbl h ILE 478 Cb 0.75 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2sbl h ILE 478 CO 0.06 0.31 0.34 -0.25 0.00 0.00 0.00 178.15 178.61 2sbl h TRP 479 N 0.85 0.71 -0.54 1.37 2.91 -0.97 0.60 115.95 120.88 2sbl h TRP 479 Ca 0.19 0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.27 2sbl h TRP 479 Cb 0.28 -0.24 -0.05 0.00 -0.51 0.00 0.00 29.16 28.65 2sbl h TRP 479 CO 0.02 0.48 0.28 1.25 -1.03 0.00 0.00 178.44 179.43 2sbl h LEU 480 N 0.74 0.40 -0.53 0.65 5.85 -0.32 -0.84 115.31 121.26 2sbl h LEU 480 Ca 0.20 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2sbl h LEU 480 Cb -0.04 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2sbl h LEU 480 CO -0.04 0.27 0.06 -0.07 -0.34 0.00 0.00 178.44 178.32 2sbl h LEU 481 N 0.53 0.87 -0.90 2.25 3.38 -0.68 -2.53 115.31 118.23 2sbl h LEU 481 Ca 0.24 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 58.02 2sbl h LEU 481 Cb 0.15 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 2sbl h LEU 481 CO -0.17 0.92 0.55 0.00 0.09 0.00 0.00 178.44 179.84 2sbl h ALA 482 N 0.98 1.27 -0.03 1.53 0.00 -0.20 0.70 119.26 123.50 2sbl h ALA 482 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2sbl h ALA 482 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2sbl h ALA 482 CO 0.02 0.25 -0.20 0.87 0.00 0.00 0.00 179.25 180.19 2sbl h LYS 483 N 0.96 0.05 -0.42 0.00 1.57 -0.95 -1.88 116.57 115.92 2sbl h LYS 483 Ca 0.41 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 59.03 2sbl h LYS 483 Cb 0.27 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2sbl h LYS 483 CO -0.21 0.26 -0.32 0.00 -0.57 0.00 0.00 179.45 178.61 2sbl h ALA 484 N 1.75 0.63 -0.32 3.86 0.00 -0.47 -1.01 119.26 123.69 2sbl h ALA 484 Ca 0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2sbl h ALA 484 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2sbl h ALA 484 CO 0.03 0.68 0.15 1.88 0.00 0.00 0.00 179.25 181.98 2sbl h TYR 485 N 0.80 0.47 -0.67 0.00 0.05 -0.93 0.45 116.97 117.14 2sbl h TYR 485 Ca 0.08 -0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.90 2sbl h TYR 485 Cb 0.91 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 38.45 2sbl h TYR 485 CO 0.06 0.43 0.35 0.28 -1.05 0.00 0.00 178.16 178.23 2sbl h VAL 486 N 0.38 0.92 0.00 -2.88 2.07 -1.15 -0.96 116.25 114.63 2sbl h VAL 486 Ca 0.11 -0.22 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 2sbl h VAL 486 Cb 0.14 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2sbl h VAL 486 CO -0.01 0.12 -0.40 0.40 0.02 0.00 0.00 177.57 177.69 2sbl h ILE 487 N 0.63 0.77 -0.24 4.57 1.08 -0.84 0.17 117.51 123.66 2sbl h ILE 487 Ca 0.31 -1.80 -0.02 0.00 -0.39 0.00 0.00 64.86 62.97 2sbl h ILE 487 Cb 0.25 2.17 -0.01 0.00 -3.07 0.00 0.00 36.82 36.16 2sbl h ILE 487 CO -0.22 0.39 0.08 0.58 -0.69 0.00 0.00 178.15 178.30 2sbl h VAL 488 N 0.00 1.18 -0.32 1.67 2.07 -0.01 0.18 116.25 121.02 2sbl h VAL 488 Ca -0.00 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 67.01 2sbl h VAL 488 Cb 1.14 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.97 2sbl h VAL 488 CO 0.05 0.19 -0.05 0.78 0.02 0.00 0.00 177.57 178.56 2sbl h ASN 489 N 0.22 -0.23 -0.35 0.57 -0.26 -0.94 -1.50 115.58 113.09 2sbl h ASN 489 Ca 0.08 0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.88 2sbl h ASN 489 Cb 0.21 0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.63 2sbl h ASN 489 CO -0.00 -0.08 0.12 -0.78 -1.06 0.00 0.00 177.43 175.63 2sbl h ASP 490 N 0.04 0.50 -0.28 5.81 3.58 -0.69 -1.50 116.42 123.88 2sbl h ASP 490 Ca 0.16 -0.19 0.06 0.00 0.42 0.00 0.00 57.03 57.47 2sbl h ASP 490 Cb 0.23 -0.13 -0.06 0.00 1.72 0.00 0.00 39.33 41.09 2sbl h ASP 490 CO -0.30 0.55 -0.08 0.28 -2.88 0.00 0.00 179.24 176.81 2sbl h SER 491 N 0.42 -0.30 -0.32 2.28 0.02 -0.27 0.43 113.55 115.81 2sbl h SER 491 Ca 0.11 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2sbl h SER 491 Cb 0.22 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2sbl h SER 491 CO -0.01 -0.11 0.21 0.00 -1.14 0.00 0.00 176.83 175.78 2sbl h TYR 493 N 0.43 0.98 -0.00 0.00 5.03 -0.71 -1.75 116.97 120.96 2sbl h TYR 493 Ca 0.12 -0.12 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 2sbl h TYR 493 Cb -0.05 -0.27 -0.00 0.00 1.55 0.00 0.00 36.73 37.96 2sbl h TYR 493 CO -0.05 0.84 0.00 1.25 -1.32 0.00 0.00 178.16 178.88 2sbl h HIS 494 N 0.88 0.00 -0.15 -3.82 2.76 0.38 0.11 115.15 115.32 2sbl h HIS 494 Ca 0.18 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 2sbl h HIS 494 Cb 0.40 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 2sbl h HIS 494 CO 0.03 0.18 -0.01 0.37 -1.30 0.00 0.00 177.93 177.19 2sbl h GLN 495 N -0.17 0.27 0.05 5.26 5.75 -0.76 0.16 115.11 125.67 2sbl h GLN 495 Ca 0.00 -0.09 -0.13 0.00 -0.15 0.00 0.00 58.65 58.28 2sbl h GLN 495 Cb 0.18 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 2sbl h GLN 495 CO -0.00 0.52 -0.65 -0.07 -2.65 0.00 0.00 178.83 175.98 2sbl h LEU 496 N -0.01 0.16 0.00 -2.39 3.38 -1.34 0.15 115.31 115.25 2sbl h LEU 496 Ca 0.04 -0.87 -0.02 0.00 0.09 0.00 0.00 57.88 57.12 2sbl h LEU 496 Cb 0.41 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2sbl h LEU 496 CO 0.01 1.28 -0.64 0.23 0.09 0.00 0.00 178.44 179.41 2sbl n MET 497 N -4.36 0.47 -0.12 1.13 2.81 0.30 -1.03 117.12 116.31 2sbl n MET 497 Ca -0.18 0.48 -0.01 0.00 -1.81 0.00 0.00 57.70 56.18 2sbl n MET 497 Cb 0.66 -1.66 0.23 0.00 -0.71 0.00 0.00 33.22 31.74 2sbl n MET 497 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2sbl h SER 498 N -1.00 0.74 0.00 7.83 0.02 -1.21 -1.47 113.55 118.46 2sbl h SER 498 Ca -0.03 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 2sbl h SER 498 Cb 0.63 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2sbl h SER 498 CO -0.02 0.68 -1.11 1.57 -1.14 0.00 0.00 176.83 176.81 2sbl n HIS 499 N -4.32 0.00 0.22 3.45 -0.00 0.55 -4.19 115.22 110.93 2sbl n HIS 499 Ca 0.04 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.63 2sbl n HIS 499 Cb 0.18 -0.53 -0.07 0.00 -0.00 0.00 0.00 29.99 29.56 2sbl n HIS 499 CO 0.00 0.00 0.00 2.35 -0.00 0.00 0.00 176.34 178.69 2sbl h TRP 500 N -0.99 -0.53 0.49 1.57 2.91 -0.53 -3.22 115.95 115.65 2sbl h TRP 500 Ca -0.06 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 59.93 2sbl h TRP 500 Cb 1.04 0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.87 2sbl h TRP 500 CO -0.40 -0.21 -0.24 1.25 -1.03 0.00 0.00 178.44 177.82 2sbl h LEU 501 N -0.93 -0.56 -1.87 0.65 5.85 -1.04 0.28 115.31 117.69 2sbl h LEU 501 Ca -0.06 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2sbl h LEU 501 Cb 0.57 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2sbl h LEU 501 CO 0.10 -0.17 0.00 0.78 -0.34 0.00 0.00 178.44 178.81 2sbl h ASN 502 N -1.12 0.00 0.00 1.25 4.21 -1.44 0.13 115.58 118.61 2sbl h ASN 502 Ca -0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.44 2sbl h ASN 502 Cb 0.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 2sbl h ASN 502 CO 0.11 0.00 -0.08 0.35 -1.29 0.00 0.00 177.43 176.52 2sbl n THR 503 N -2.86 0.70 0.45 2.81 -2.24 -1.23 -4.63 114.28 107.29 2sbl n THR 503 Ca -0.01 0.24 -0.19 0.00 -2.27 0.00 0.00 64.05 61.81 2sbl n THR 503 Cb 0.18 -1.41 -0.10 0.00 -2.10 0.00 0.00 70.33 66.90 2sbl n THR 503 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2sbl h HIS 504 N -0.08 -1.09 -0.40 4.78 3.86 -1.48 -1.64 115.15 119.10 2sbl h HIS 504 Ca 0.00 -0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.06 2sbl h HIS 504 Cb 0.08 0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2sbl h HIS 504 CO -0.03 -0.67 -0.24 0.00 0.86 0.00 0.00 177.93 177.85 2sbl h ALA 505 N -0.99 0.57 -0.09 2.45 0.00 -0.98 -3.08 119.26 117.15 2sbl h ALA 505 Ca -0.11 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2sbl h ALA 505 Cb 0.89 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2sbl h ALA 505 CO 0.18 0.57 -0.26 0.00 0.00 0.00 0.00 179.25 179.74 2sbl h ALA 506 N 0.81 1.40 0.10 0.00 0.00 -0.95 -3.27 119.26 117.34 2sbl h ALA 506 Ca 0.08 -0.28 -0.27 0.00 0.00 0.00 0.00 54.91 54.45 2sbl h ALA 506 Cb 0.81 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2sbl h ALA 506 CO 0.07 0.42 -1.24 1.98 0.00 0.00 0.00 179.25 180.48 2sbl h MET 507 N 0.14 0.21 -0.95 0.00 4.05 -1.30 -3.38 114.93 113.69 2sbl h MET 507 Ca 0.02 -0.36 0.12 0.00 -0.28 0.00 0.00 59.70 59.21 2sbl h MET 507 Cb 0.54 0.13 -0.09 0.00 -0.80 0.00 0.00 31.60 31.39 2sbl h MET 507 CO 0.04 1.15 0.58 1.49 0.23 0.00 0.00 176.91 180.40 2sbl h GLU 508 N 0.06 0.88 -0.87 0.39 4.81 -1.59 -1.30 114.58 116.96 2sbl h GLU 508 Ca -0.13 -0.05 0.18 0.00 -0.13 0.00 0.00 59.36 59.23 2sbl h GLU 508 Cb 1.94 -0.20 -0.11 0.00 0.63 0.00 0.00 28.75 31.01 2sbl h GLU 508 CO 0.18 0.58 0.41 -1.35 -0.73 0.00 0.00 179.01 178.10 2sbl h PRO 509 N 0.90 0.49 -0.04 0.92 0.11 -1.74 -1.51 132.00 131.12 2sbl h PRO 509 Ca 0.48 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.43 2sbl h PRO 509 Cb 0.51 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 2sbl h PRO 509 CO -0.28 0.32 -0.56 0.74 -0.21 0.00 0.00 178.00 178.01 2sbl h PHE 510 N 0.50 0.17 -0.19 0.65 0.04 -1.47 -1.12 116.94 115.51 2sbl h PHE 510 Ca 0.51 -0.06 -0.03 0.00 2.80 0.00 0.00 57.97 61.18 2sbl h PHE 510 Cb 0.85 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.97 2sbl h PHE 510 CO -0.12 0.66 -0.01 0.28 -0.60 0.00 0.00 178.31 178.52 2sbl h VAL 511 N 0.10 1.26 -0.41 -0.55 2.07 -1.01 -1.44 116.25 116.29 2sbl h VAL 511 Ca -0.00 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 2sbl h VAL 511 Cb 1.02 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2sbl h VAL 511 CO 0.08 0.27 0.11 0.40 0.02 0.00 0.00 177.57 178.46 2sbl h ILE 512 N 0.08 1.22 -0.52 4.57 2.04 -1.21 -2.85 117.51 120.84 2sbl h ILE 512 Ca 0.05 -0.75 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 2sbl h ILE 512 Cb 0.42 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2sbl h ILE 512 CO 0.01 0.26 0.25 0.00 0.00 0.00 0.00 178.15 178.68 2sbl h ALA 513 N 0.96 1.47 -0.34 1.87 0.00 -1.09 -1.94 119.26 120.20 2sbl h ALA 513 Ca 0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2sbl h ALA 513 Cb 0.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2sbl h ALA 513 CO -0.00 0.43 0.08 1.15 0.00 0.00 0.00 179.25 180.91 2sbl h THR 514 N 0.73 1.22 -0.19 0.00 2.02 -1.06 -1.40 112.91 114.24 2sbl h THR 514 Ca 0.18 -0.76 -0.19 0.00 0.77 0.00 0.00 66.41 66.41 2sbl h THR 514 Cb 0.07 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2sbl h THR 514 CO -0.03 0.26 -0.65 0.45 0.37 0.00 0.00 175.52 175.92 2sbl h HIS 515 N 0.40 0.91 0.00 3.16 3.86 -1.26 0.09 115.15 122.31 2sbl h HIS 515 Ca 0.11 -0.36 -0.05 0.00 -1.16 0.00 0.00 60.37 58.91 2sbl h HIS 515 Cb 0.31 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 2sbl h HIS 515 CO 0.02 1.16 -0.25 0.00 0.86 0.00 0.00 177.93 179.72 2sbl h ARG 516 N 0.51 0.00 0.00 2.45 3.08 -1.30 -3.39 114.38 115.73 2sbl h ARG 516 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2sbl h ARG 516 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2sbl h ARG 516 CO 0.13 0.25 -0.81 0.72 -1.07 0.00 0.00 179.97 179.18 2sbl n HIS 517 N -4.14 0.00 -3.76 3.04 8.25 -0.53 -4.80 115.22 113.28 2sbl n HIS 517 Ca -0.02 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.07 2sbl n HIS 517 Cb 0.31 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.29 2sbl n HIS 517 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2sbl s LEU 518 N -2.87 3.58 0.74 2.41 2.96 -0.00 -4.70 118.68 120.80 2sbl s LEU 518 Ca 0.00 -0.40 -0.15 0.00 -0.22 0.00 0.00 54.13 53.36 2sbl s LEU 518 Cb 0.00 -1.90 0.03 0.00 0.50 0.00 0.00 46.19 44.82 2sbl s LEU 518 CO 0.00 -0.10 1.11 -0.24 -1.32 0.00 0.00 176.35 175.81 2sbl n SER 519 N 4.90 0.97 -0.09 3.68 2.88 -1.26 -4.58 113.62 120.12 2sbl n SER 519 Ca -0.16 0.66 0.23 0.00 -1.33 0.00 0.00 58.87 58.28 2sbl n SER 519 Cb 0.50 -1.47 0.68 0.00 -0.75 0.00 0.00 64.21 63.17 2sbl n SER 519 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2sbl h VAL 520 N -0.36 0.67 0.00 2.46 -1.51 -1.94 -0.13 116.25 115.43 2sbl h VAL 520 Ca -0.48 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 2sbl h VAL 520 Cb 1.32 0.61 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 2sbl h VAL 520 CO 0.48 0.01 0.00 0.18 -1.23 0.00 0.00 177.57 177.00 2sbl n LEU 521 N -4.35 0.61 -4.71 4.19 4.77 -1.26 -4.62 117.00 111.63 2sbl n LEU 521 Ca 0.14 0.60 -0.42 0.00 -0.03 0.00 0.00 56.01 56.29 2sbl n LEU 521 Cb 0.74 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2sbl n LEU 521 CO 0.37 -0.31 0.74 -2.28 -1.33 0.00 0.00 177.39 174.58 2sbl s HIS 522 N -3.16 3.60 0.21 -1.77 2.46 -0.06 -0.48 115.29 116.08 2sbl s HIS 522 Ca 0.08 1.59 -0.16 0.00 0.47 0.00 0.00 55.06 57.04 2sbl s HIS 522 Cb 0.12 -3.20 0.22 0.00 -0.13 0.00 0.00 32.58 29.58 2sbl s HIS 522 CO 0.49 -0.36 1.60 -1.00 -2.47 0.00 0.00 174.74 172.99 2sbl h PRO 523 N 6.80 -0.07 0.00 2.88 0.13 -1.88 0.77 132.00 140.64 2sbl h PRO 523 Ca -0.41 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 2sbl h PRO 523 Cb 1.22 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2sbl h PRO 523 CO 0.77 -0.04 -0.11 0.82 -0.23 0.00 0.00 178.00 179.21 2sbl h ILE 524 N -0.07 0.45 -0.02 -3.56 1.08 -1.94 0.38 117.51 113.82 2sbl h ILE 524 Ca 0.30 -0.54 -0.01 0.00 -0.39 0.00 0.00 64.86 64.22 2sbl h ILE 524 Cb 0.54 1.37 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 2sbl h ILE 524 CO -0.73 0.10 -0.04 0.22 -0.69 0.00 0.00 178.15 177.02 2sbl h TYR 525 N 0.00 0.08 -0.28 1.37 5.03 -1.13 0.02 116.97 122.06 2sbl h TYR 525 Ca -0.00 -0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.32 2sbl h TYR 525 Cb 0.36 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 2sbl h TYR 525 CO 0.00 0.59 0.19 0.87 -1.32 0.00 0.00 178.16 178.49 2sbl h LYS 526 N -0.45 0.22 0.07 1.82 1.57 -0.84 0.87 116.57 119.82 2sbl h LYS 526 Ca 0.00 -0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.55 2sbl h LYS 526 Cb 0.58 -0.05 0.02 0.00 0.08 0.00 0.00 32.23 32.86 2sbl h LYS 526 CO 0.01 0.15 -0.90 1.25 -0.57 0.00 0.00 179.45 179.38 2sbl h LEU 527 N 0.23 0.68 0.09 2.94 5.85 -0.81 -3.41 115.31 120.87 2sbl h LEU 527 Ca 0.12 -0.82 -0.24 0.00 0.84 0.00 0.00 57.88 57.78 2sbl h LEU 527 Cb 0.20 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2sbl h LEU 527 CO -0.02 1.42 -1.25 -0.07 -0.34 0.00 0.00 178.44 178.18 2sbl h LEU 528 N 0.02 0.31 -1.16 2.25 4.07 -0.55 -3.40 115.31 116.86 2sbl h LEU 528 Ca -0.13 -0.83 0.32 0.00 0.08 0.00 0.00 57.88 57.32 2sbl h LEU 528 Cb 1.62 -0.10 -0.13 0.00 1.08 0.00 0.00 40.66 43.13 2sbl h LEU 528 CO 0.17 1.54 0.65 0.74 -1.08 0.00 0.00 178.44 180.46 2sbl h THR 529 N -0.45 0.36 -0.62 0.22 2.02 -1.06 -0.04 112.91 113.34 2sbl h THR 529 Ca -0.28 -0.12 0.18 0.00 0.77 0.00 0.00 66.41 66.97 2sbl h THR 529 Cb 1.64 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 2sbl h THR 529 CO 0.03 0.06 0.47 -0.65 0.37 0.00 0.00 175.52 175.79 2sbl h PRO 530 N 0.34 0.00 -0.50 6.66 0.11 -1.81 -1.57 132.00 135.24 2sbl h PRO 530 Ca 0.70 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.81 2sbl h PRO 530 Cb 1.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.84 2sbl h PRO 530 CO -0.48 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.03 2sbl n HIS 531 N -4.25 0.69 0.32 0.65 8.25 -0.03 -3.76 115.22 117.10 2sbl n HIS 531 Ca 0.12 -0.30 0.03 0.00 -0.26 0.00 0.00 57.72 57.31 2sbl n HIS 531 Cb 0.71 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.71 2sbl n HIS 531 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2sbl n TYR 532 N 0.59 0.00 -1.68 4.41 4.01 -0.59 -4.32 117.16 119.59 2sbl n TYR 532 Ca 0.14 0.00 -0.48 0.00 -0.16 0.00 0.00 57.90 57.39 2sbl n TYR 532 Cb 0.45 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.43 2sbl n TYR 532 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2sbl n ARG 533 N -1.01 2.07 -0.85 -0.72 0.63 -1.25 -1.90 116.66 113.63 2sbl n ARG 533 Ca 0.02 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.70 2sbl n ARG 533 Cb 0.11 -2.56 0.00 0.00 0.45 0.00 0.00 32.46 30.46 2sbl n ARG 533 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2sbl n ASN 534 N 5.55 -1.93 -0.08 6.15 5.15 -1.26 -3.96 115.26 124.88 2sbl n ASN 534 Ca 0.21 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 54.09 2sbl n ASN 534 Cb 0.28 -1.63 -0.04 0.00 -0.53 0.00 0.00 39.78 37.87 2sbl n ASN 534 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 2sbl h ASN 535 N 0.00 0.34 0.18 1.20 -0.00 -1.17 -1.59 115.58 114.54 2sbl h ASN 535 Ca 0.00 -0.17 -0.14 0.00 -0.00 0.00 0.00 56.30 55.99 2sbl h ASN 535 Cb 0.22 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.44 2sbl h ASN 535 CO 0.00 0.42 -0.52 0.24 -0.00 0.00 0.00 177.43 177.57 2sbl h MET 536 N 0.25 0.38 0.15 6.67 2.86 -1.87 -2.32 114.93 121.04 2sbl h MET 536 Ca 0.08 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 2sbl h MET 536 Cb 0.19 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.87 2sbl h MET 536 CO -0.01 0.81 -0.07 -0.97 1.06 0.00 0.00 176.91 177.73 2sbl h ASN 537 N 0.30 -0.17 -0.20 1.22 -1.24 -1.68 -1.87 115.58 111.94 2sbl h ASN 537 Ca 0.01 -0.23 -0.04 0.00 0.71 0.00 0.00 56.30 56.74 2sbl h ASN 537 Cb 1.01 0.04 -0.02 0.00 0.73 0.00 0.00 38.32 40.09 2sbl h ASN 537 CO 0.09 0.15 0.01 0.16 -1.29 0.00 0.00 177.43 176.54 2sbl h ILE 538 N -0.50 1.18 -0.45 2.57 3.07 -1.28 -1.58 117.51 120.51 2sbl h ILE 538 Ca -0.02 -0.71 -0.05 0.00 1.55 0.00 0.00 64.86 65.63 2sbl h ILE 538 Cb 0.39 0.94 -0.02 0.00 -0.27 0.00 0.00 36.82 37.87 2sbl h ILE 538 CO 0.03 0.24 0.08 0.78 -1.05 0.00 0.00 178.15 178.23 2sbl h ASN 539 N 0.45 0.72 -0.40 2.16 4.21 -1.31 0.19 115.58 121.60 2sbl h ASN 539 Ca 0.10 -0.26 -0.02 0.00 1.21 0.00 0.00 56.30 57.33 2sbl h ASN 539 Cb 0.29 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 2sbl h ASN 539 CO 0.01 0.79 0.16 0.00 -1.29 0.00 0.00 177.43 177.10 2sbl h ALA 540 N 0.95 0.52 -0.90 -0.83 0.00 -0.76 0.44 119.26 118.68 2sbl h ALA 540 Ca 0.14 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2sbl h ALA 540 Cb 0.37 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 2sbl h ALA 540 CO 0.01 0.12 0.58 -0.07 0.00 0.00 0.00 179.25 179.89 2sbl h LEU 541 N 0.50 0.94 -0.66 0.00 -0.00 -1.17 -1.74 115.31 113.18 2sbl h LEU 541 Ca 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.01 2sbl h LEU 541 Cb 0.19 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 40.62 2sbl h LEU 541 CO -0.01 0.62 0.39 0.00 -0.00 0.00 0.00 178.44 179.44 2sbl h ALA 542 N 1.40 0.84 -0.35 1.53 0.00 0.22 0.74 119.26 123.63 2sbl h ALA 542 Ca 0.38 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 2sbl h ALA 542 Cb 0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2sbl h ALA 542 CO -0.15 0.32 -0.09 0.00 0.00 0.00 0.00 179.25 179.34 2sbl h ARG 543 N 0.90 0.60 -0.12 0.00 3.08 -0.64 0.21 114.38 118.40 2sbl h ARG 543 Ca 0.24 -0.17 -0.20 0.00 0.07 0.00 0.00 59.98 59.91 2sbl h ARG 543 Cb -0.01 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2sbl h ARG 543 CO -0.04 0.69 -0.76 0.37 -1.07 0.00 0.00 179.97 179.16 2sbl h GLN 544 N 0.55 0.61 0.00 0.04 4.15 -0.92 -3.30 115.11 116.24 2sbl h GLN 544 Ca 0.10 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 59.03 2sbl h GLN 544 Cb 0.49 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.29 2sbl h GLN 544 CO 0.03 1.12 -0.40 0.43 -1.93 0.00 0.00 178.83 178.08 2sbl n SER 545 N -3.89 1.99 -0.07 -0.69 7.64 0.22 -4.73 113.62 114.10 2sbl n SER 545 Ca -0.06 -0.08 -0.10 0.00 1.01 0.00 0.00 58.87 59.64 2sbl n SER 545 Cb 0.73 0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 64.45 2sbl n SER 545 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2sbl n LEU 546 N -0.76 1.67 -1.61 -3.43 4.77 0.56 -2.58 117.00 115.63 2sbl n LEU 546 Ca 0.00 0.28 0.09 0.00 -0.03 0.00 0.00 56.01 56.34 2sbl n LEU 546 Cb 0.00 -0.63 0.36 0.00 -2.33 0.00 0.00 43.42 40.82 2sbl n LEU 546 CO 0.00 -0.21 0.82 2.30 -1.33 0.00 0.00 177.39 178.98 2sbl n ILE 547 N -4.15 2.05 -2.04 -0.08 -5.35 -0.27 -1.27 119.36 108.25 2sbl n ILE 547 Ca -0.17 -1.27 -0.29 0.00 -0.27 0.00 0.00 62.75 60.75 2sbl n ILE 547 Cb 0.48 0.03 0.06 0.00 -1.74 0.00 0.00 39.64 38.46 2sbl n ILE 547 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2sbl s ASN 548 N -0.93 5.19 0.14 7.28 4.22 -1.24 -4.92 114.94 124.66 2sbl s ASN 548 Ca 0.51 0.87 -0.31 0.00 -2.14 0.00 0.00 52.86 51.80 2sbl s ASN 548 Cb 0.35 -1.63 -0.10 0.00 1.28 0.00 0.00 41.25 41.15 2sbl s ASN 548 CO 0.22 -1.44 1.74 0.00 -2.04 0.00 0.00 177.10 175.58 2sbl s ALA 549 N -3.31 3.79 -1.48 3.54 0.00 0.03 -1.01 121.76 123.32 2sbl s ALA 549 Ca 0.58 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.97 2sbl s ALA 549 Cb -0.11 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2sbl s ALA 549 CO 0.49 -1.08 0.00 -1.71 0.00 0.00 0.00 175.76 173.46 2sbl n ASN 550 N 5.08 -4.80 -2.01 0.00 5.15 -1.26 -4.94 115.26 112.48 2sbl n ASN 550 Ca 0.16 0.14 0.00 0.00 -0.60 0.00 0.00 54.58 54.28 2sbl n ASN 550 Cb 0.38 -3.84 0.00 0.00 -0.53 0.00 0.00 39.78 35.79 2sbl n ASN 550 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2sbl n GLY 551 N -1.02 -0.25 0.19 8.20 0.00 -0.18 -4.77 105.19 107.37 2sbl n GLY 551 Ca -0.18 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 2sbl n GLY 551 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2sbl h ILE 552 N -0.68 1.16 -0.29 -0.61 2.04 -1.39 -0.83 117.51 116.90 2sbl h ILE 552 Ca 0.00 -0.41 -0.15 0.00 1.00 0.00 0.00 64.86 65.30 2sbl h ILE 552 Cb 0.00 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2sbl h ILE 552 CO 0.00 0.17 -0.42 0.40 0.00 0.00 0.00 178.15 178.30 2sbl h ILE 553 N 0.56 1.29 -0.30 -0.67 1.08 -1.47 -0.02 117.51 117.98 2sbl h ILE 553 Ca 0.15 -1.60 -0.11 0.00 -0.39 0.00 0.00 64.86 62.91 2sbl h ILE 553 Cb 0.06 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.31 2sbl h ILE 553 CO -0.02 0.52 -0.27 -0.33 -0.69 0.00 0.00 178.15 177.35 2sbl h GLU 554 N 0.58 0.61 -0.28 2.37 5.08 -1.69 0.23 114.58 121.47 2sbl h GLU 554 Ca 0.04 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 2sbl h GLU 554 Cb 0.96 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2sbl h GLU 554 CO 0.09 0.82 -0.01 1.15 -1.00 0.00 0.00 179.01 180.06 2sbl h THR 555 N 0.53 1.26 0.00 1.13 2.02 -0.82 -3.37 112.91 113.66 2sbl h THR 555 Ca 0.07 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.29 2sbl h THR 555 Cb 0.74 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2sbl h THR 555 CO 0.06 0.30 -1.49 0.35 0.37 0.00 0.00 175.52 175.12 2sbl n THR 556 N -4.58 0.15 -4.05 3.16 -2.24 -0.05 -4.93 114.28 101.75 2sbl n THR 556 Ca -0.03 -0.39 -0.31 0.00 -2.27 0.00 0.00 64.05 61.05 2sbl n THR 556 Cb 0.26 0.11 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 2sbl n THR 556 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2sbl s PHE 557 N -3.36 3.26 0.22 4.78 0.40 0.05 -4.50 117.98 118.84 2sbl s PHE 557 Ca -0.02 0.14 -0.17 0.00 -0.60 0.00 0.00 56.93 56.27 2sbl s PHE 557 Cb 0.14 -1.67 0.22 0.00 0.51 0.00 0.00 43.02 42.21 2sbl s PHE 557 CO 0.86 0.54 1.50 -0.11 0.70 0.00 0.00 175.22 178.71 2sbl n LEU 558 N 0.65 -0.65 0.09 -0.37 7.94 -0.16 -2.48 117.00 122.02 2sbl n LEU 558 Ca -0.09 1.69 0.10 0.00 -1.11 0.00 0.00 56.01 56.60 2sbl n LEU 558 Cb 0.52 -0.38 0.42 0.00 0.53 0.00 0.00 43.42 44.51 2sbl n LEU 558 CO 0.43 -1.51 0.80 -2.65 -1.11 0.00 0.00 177.39 173.35 2sbl n PRO 559 N -5.42 0.12 0.00 1.96 -0.02 -1.26 -4.93 135.00 125.46 2sbl n PRO 559 Ca 0.10 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2sbl n PRO 559 Cb 0.38 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 2sbl n PRO 559 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2sbl n SER 560 N -1.99 0.00 0.31 2.55 2.88 -1.04 -0.96 113.62 115.37 2sbl n SER 560 Ca 0.02 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.74 2sbl n SER 560 Cb 0.18 0.00 1.00 0.00 -0.75 0.00 0.00 64.21 64.64 2sbl n SER 560 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 2sbl h LYS 561 N 0.00 0.00 0.00 -1.46 2.10 -1.92 -2.35 116.57 112.95 2sbl h LYS 561 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2sbl h LYS 561 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2sbl h LYS 561 CO 0.00 0.02 0.00 0.66 -2.00 0.00 0.00 179.45 178.13 2sbl n TYR 562 N -3.50 0.00 0.16 0.07 4.01 -0.14 -4.42 117.16 113.35 2sbl n TYR 562 Ca -0.03 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.55 2sbl n TYR 562 Cb 0.11 -0.36 -0.10 0.00 -0.31 0.00 0.00 39.34 38.68 2sbl n TYR 562 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2sbl h SER 563 N 0.00 -1.51 0.74 7.72 0.02 -1.52 -1.41 113.55 117.59 2sbl h SER 563 Ca 0.00 0.15 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 2sbl h SER 563 Cb 0.34 0.54 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 2sbl h SER 563 CO 0.00 -0.58 -0.59 0.58 -1.14 0.00 0.00 176.83 175.10 2sbl h VAL 564 N -0.82 1.31 -0.61 2.27 2.07 -1.85 -2.79 116.25 115.84 2sbl h VAL 564 Ca -0.02 -2.10 0.07 0.00 0.82 0.00 0.00 66.70 65.47 2sbl h VAL 564 Cb 0.79 2.17 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 2sbl h VAL 564 CO -0.22 0.58 0.29 -0.08 0.02 0.00 0.00 177.57 178.16 2sbl h GLU 565 N 0.00 0.52 -0.64 1.57 4.81 -1.75 -1.24 114.58 117.85 2sbl h GLU 565 Ca -0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2sbl h GLU 565 Cb 1.12 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.35 2sbl h GLU 565 CO 0.08 0.34 0.35 0.52 -0.73 0.00 0.00 179.01 179.57 2sbl h MET 566 N 0.54 0.88 0.00 1.92 2.86 -0.98 -1.74 114.93 118.40 2sbl h MET 566 Ca 0.28 -0.09 -0.09 0.00 -2.06 0.00 0.00 59.70 57.75 2sbl h MET 566 Cb 0.25 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2sbl h MET 566 CO -0.22 0.64 -0.42 0.66 1.06 0.00 0.00 176.91 178.64 2sbl h SER 567 N 0.89 0.00 -0.18 1.22 4.64 -1.20 -1.81 113.55 117.11 2sbl h SER 567 Ca 0.23 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2sbl h SER 567 Cb 0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2sbl h SER 567 CO -0.04 0.42 0.10 -1.28 -0.87 0.00 0.00 176.83 175.16 2sbl h SER 568 N 0.00 0.22 -0.93 4.97 0.87 -0.92 0.16 113.55 117.92 2sbl h SER 568 Ca -0.00 -0.08 0.11 0.00 -1.23 0.00 0.00 61.79 60.59 2sbl h SER 568 Cb 0.81 -0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 62.63 2sbl h SER 568 CO 0.05 0.24 0.56 0.00 -0.53 0.00 0.00 176.83 177.16 2sbl h ALA 569 N 0.99 1.39 -0.10 6.23 0.00 -0.94 0.15 119.26 126.98 2sbl h ALA 569 Ca 0.06 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2sbl h ALA 569 Cb 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2sbl h ALA 569 CO -0.01 0.16 -0.64 0.28 0.00 0.00 0.00 179.25 179.04 2sbl h VAL 570 N 0.90 1.37 -0.10 0.00 2.07 -0.96 -3.15 116.25 116.39 2sbl h VAL 570 Ca 0.46 -2.01 -0.01 0.00 0.82 0.00 0.00 66.70 65.96 2sbl h VAL 570 Cb 0.46 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 2sbl h VAL 570 CO -0.27 0.60 0.02 0.22 0.02 0.00 0.00 177.57 178.16 2sbl h TYR 571 N 0.27 0.13 -1.03 1.57 3.20 0.21 -0.99 116.97 120.33 2sbl h TYR 571 Ca -0.01 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.16 2sbl h TYR 571 Cb 1.18 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 39.37 2sbl h TYR 571 CO 0.04 0.13 0.84 0.87 -1.64 0.00 0.00 178.16 178.39 2sbl h LYS 572 N 0.13 0.00 -0.35 1.82 1.57 -1.31 0.16 116.57 118.59 2sbl h LYS 572 Ca 0.03 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2sbl h LYS 572 Cb 0.07 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.32 2sbl h LYS 572 CO -0.00 0.00 0.02 0.09 -0.57 0.00 0.00 179.45 178.99 2sbl n ASN 573 N -3.92 3.46 -4.76 0.86 3.02 -0.38 -5.00 115.26 108.55 2sbl n ASN 573 Ca 0.22 -3.31 -0.40 0.00 -0.03 0.00 0.00 54.58 51.06 2sbl n ASN 573 Cb 1.18 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 39.70 2sbl n ASN 573 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2sbl s TRP 574 N -3.00 3.84 -0.19 3.10 -0.00 0.54 -5.03 118.94 118.20 2sbl s TRP 574 Ca 0.44 1.61 -0.01 0.00 -0.00 0.00 0.00 56.10 58.14 2sbl s TRP 574 Cb 0.38 -2.83 0.05 0.00 -0.00 0.00 0.00 33.47 31.07 2sbl s TRP 574 CO 0.06 0.39 -0.01 0.08 -0.00 0.00 0.00 176.95 177.47 2sbl s VAL 575 N -0.62 0.92 0.24 5.86 1.01 -1.26 -5.03 120.40 121.52 2sbl s VAL 575 Ca 0.38 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.60 2sbl s VAL 575 Cb -0.22 -1.26 0.23 0.00 0.00 0.00 0.00 36.38 35.13 2sbl s VAL 575 CO 0.26 -0.06 1.67 0.15 0.00 0.00 0.00 175.10 177.12 2sbl h PHE 576 N 8.14 0.18 0.00 5.22 3.57 -1.96 -1.37 116.94 130.73 2sbl h PHE 576 Ca -0.19 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.35 2sbl h PHE 576 Cb 1.11 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.88 2sbl h PHE 576 CO 0.39 -0.12 0.00 1.79 -2.23 0.00 0.00 178.31 178.14 2sbl h THR 577 N 0.22 0.00 0.00 4.41 1.35 -1.96 -1.42 112.91 115.50 2sbl h THR 577 Ca 0.40 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2sbl h THR 577 Cb 0.68 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 2sbl h THR 577 CO -0.53 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.21 2sbl n ASP 578 N -3.00 0.05 0.00 5.36 9.92 -0.52 -3.01 116.55 125.35 2sbl n ASP 578 Ca 0.01 0.51 0.13 0.00 -0.53 0.00 0.00 54.79 54.91 2sbl n ASP 578 Cb 0.33 -0.52 0.73 0.00 -0.64 0.00 0.00 41.12 41.02 2sbl n ASP 578 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2sbl n GLN 579 N -1.55 0.59 -2.52 -1.24 1.13 -0.54 -3.16 117.38 110.10 2sbl n GLN 579 Ca 0.06 0.02 -0.41 0.00 -1.94 0.00 0.00 57.00 54.73 2sbl n GLN 579 Cb 0.30 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.12 2sbl n GLN 579 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2sbl s ALA 580 N -2.31 3.35 0.20 -1.58 0.00 -1.16 -4.86 121.76 115.39 2sbl s ALA 580 Ca 0.32 0.78 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 2sbl s ALA 580 Cb 0.18 -3.37 0.23 0.00 0.00 0.00 0.00 23.12 20.16 2sbl s ALA 580 CO 0.36 -0.27 1.73 1.25 0.00 0.00 0.00 175.76 178.83 2sbl h LEU 581 N 5.80 0.10 -0.58 0.00 5.85 -1.92 0.06 115.31 124.61 2sbl h LEU 581 Ca -0.43 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.42 2sbl h LEU 581 Cb 1.21 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 2sbl h LEU 581 CO 0.75 0.07 0.32 -0.65 -0.34 0.00 0.00 178.44 178.59 2sbl h PRO 582 N 0.31 0.59 -0.36 5.25 0.11 -1.94 -1.50 132.00 134.45 2sbl h PRO 582 Ca 0.27 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.34 2sbl h PRO 582 Cb 0.35 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 2sbl h PRO 582 CO -0.32 0.39 0.21 0.00 -0.21 0.00 0.00 178.00 178.07 2sbl h ALA 583 N 1.30 0.46 0.06 -0.75 0.00 -1.64 -1.15 119.26 117.55 2sbl h ALA 583 Ca 0.26 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2sbl h ALA 583 Cb 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2sbl h ALA 583 CO -0.16 -0.03 -0.16 0.22 0.00 0.00 0.00 179.25 179.13 2sbl h ASP 584 N 0.47 -0.44 -0.58 0.00 3.58 -0.59 0.11 116.42 118.95 2sbl h ASP 584 Ca 0.13 0.06 0.04 0.00 0.42 0.00 0.00 57.03 57.67 2sbl h ASP 584 Cb 0.03 0.18 -0.04 0.00 1.72 0.00 0.00 39.33 41.21 2sbl h ASP 584 CO -0.02 -0.23 0.33 -0.07 -2.88 0.00 0.00 179.24 176.37 2sbl h LEU 585 N -0.30 0.52 -0.24 2.28 3.38 -1.02 -0.43 115.31 119.50 2sbl h LEU 585 Ca 0.03 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2sbl h LEU 585 Cb 0.33 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2sbl h LEU 585 CO -0.11 0.35 0.03 0.40 0.09 0.00 0.00 178.44 179.21 2sbl h ILE 586 N 0.64 1.23 -0.91 1.22 2.04 -1.02 -1.91 117.51 118.80 2sbl h ILE 586 Ca 0.25 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2sbl h ILE 586 Cb 0.09 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 2sbl h ILE 586 CO -0.13 0.25 0.58 0.50 0.00 0.00 0.00 178.15 179.34 2sbl h LYS 587 N 0.20 1.22 0.00 2.37 3.64 -0.44 -0.13 116.57 123.42 2sbl h LYS 587 Ca 0.07 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2sbl h LYS 587 Cb 0.34 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2sbl h LYS 587 CO 0.01 0.83 0.00 0.54 -2.27 0.00 0.00 179.45 178.56 2sbl n ARG 588 N -4.42 0.62 -1.61 1.90 1.74 -0.20 -4.89 116.66 109.81 2sbl n ARG 588 Ca 0.10 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 57.09 2sbl n ARG 588 Cb 0.03 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 2sbl n ARG 588 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2sbl n GLY 589 N 0.87 0.75 1.03 -0.13 0.00 -0.06 -0.20 105.19 107.45 2sbl n GLY 589 Ca 0.17 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.78 2sbl n GLY 589 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2sbl n VAL 590 N -3.15 0.29 -3.59 1.61 0.24 -0.76 -3.61 118.33 109.36 2sbl n VAL 590 Ca -0.11 -0.64 -0.13 0.00 -2.04 0.00 0.00 64.34 61.41 2sbl n VAL 590 Cb 0.43 1.20 -0.05 0.00 -1.47 0.00 0.00 33.84 33.94 2sbl n VAL 590 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2sbl s ALA 591 N -1.65 -1.23 0.20 2.33 0.00 -1.11 -1.53 121.76 118.76 2sbl s ALA 591 Ca 0.33 0.46 0.11 0.00 0.00 0.00 0.00 51.96 52.86 2sbl s ALA 591 Cb 0.21 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 2sbl s ALA 591 CO 0.30 -0.53 -0.24 0.96 0.00 0.00 0.00 175.76 176.25 2sbl s ILE 592 N -2.68 2.34 0.21 0.00 -5.25 -0.44 -4.25 121.20 111.12 2sbl s ILE 592 Ca -0.04 -2.04 -0.30 0.00 -0.99 0.00 0.00 60.65 57.28 2sbl s ILE 592 Cb -0.00 -2.12 -0.09 0.00 2.95 0.00 0.00 42.46 43.19 2sbl s ILE 592 CO -0.04 -0.13 1.35 -0.54 -1.79 0.00 0.00 174.94 173.78 2sbl s LYS 593 N -2.71 4.36 -0.28 0.37 1.02 -1.26 -1.11 119.74 120.12 2sbl s LYS 593 Ca 0.21 2.12 0.01 0.00 0.02 0.00 0.00 55.97 58.33 2sbl s LYS 593 Cb -0.08 -3.17 0.15 0.00 -0.52 0.00 0.00 37.83 34.21 2sbl s LYS 593 CO 0.10 -0.30 0.38 0.34 -0.92 0.00 0.00 175.35 174.95 2sbl s ASP 594 N 0.35 0.65 0.49 2.83 -1.08 0.01 -4.78 116.67 115.15 2sbl s ASP 594 Ca 0.57 -0.40 0.16 0.00 -0.52 0.00 0.00 52.55 52.36 2sbl s ASP 594 Cb -0.38 0.97 1.19 0.00 -1.46 0.00 0.00 42.92 43.25 2sbl s ASP 594 CO 0.39 -0.36 2.08 1.55 0.52 0.00 0.00 175.17 179.36 2sbl h PRO 595 N 8.19 0.15 -0.04 4.34 0.13 -1.95 -2.61 132.00 140.20 2sbl h PRO 595 Ca -0.11 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2sbl h PRO 595 Cb 1.11 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2sbl h PRO 595 CO 0.28 0.10 0.00 0.43 -0.23 0.00 0.00 178.00 178.58 2sbl n SER 596 N -4.49 0.04 -4.62 1.44 7.64 -1.26 -4.66 113.62 107.72 2sbl n SER 596 Ca 0.02 -1.39 -0.26 0.00 1.01 0.00 0.00 58.87 58.26 2sbl n SER 596 Cb 0.23 -0.02 -0.08 0.00 -1.01 0.00 0.00 64.21 63.33 2sbl n SER 596 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2sbl s THR 597 N -1.94 3.44 0.65 0.44 -4.23 -0.99 -5.01 115.64 108.00 2sbl s THR 597 Ca 0.00 -1.64 0.31 0.00 -1.18 0.00 0.00 61.69 59.18 2sbl s THR 597 Cb 0.00 -2.75 0.33 0.00 1.34 0.00 0.00 72.50 71.42 2sbl s THR 597 CO 0.00 -0.18 1.98 1.55 -0.54 0.00 0.00 174.62 177.44 2sbl h PRO 598 N 2.58 0.00 0.00 3.99 0.13 -1.89 -1.97 132.00 134.84 2sbl h PRO 598 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2sbl h PRO 598 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2sbl h PRO 598 CO 0.57 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.06 2sbl n HIS 599 N -3.06 0.00 -1.23 1.56 8.25 -1.26 -4.99 115.22 114.48 2sbl n HIS 599 Ca -0.01 -0.35 -0.08 0.00 -0.26 0.00 0.00 57.72 57.02 2sbl n HIS 599 Cb 0.37 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 2sbl n HIS 599 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2sbl n GLY 600 N -0.35 0.99 3.14 -1.41 0.00 -0.74 -4.99 105.19 101.82 2sbl n GLY 600 Ca 0.00 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.34 2sbl n GLY 600 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sbl s VAL 601 N -2.25 -0.02 -0.23 1.61 0.11 -1.21 -0.81 120.40 117.61 2sbl s VAL 601 Ca 0.00 0.06 -0.03 0.00 -2.93 0.00 0.00 61.98 59.08 2sbl s VAL 601 Cb 0.00 -0.41 0.00 0.00 -1.53 0.00 0.00 36.38 34.44 2sbl s VAL 601 CO 0.00 0.03 -0.04 -0.60 -3.33 0.00 0.00 175.10 171.15 2sbl s ARG 602 N 0.68 3.22 0.10 1.54 3.52 -0.27 -4.80 118.95 122.95 2sbl s ARG 602 Ca -0.04 -0.73 -0.30 0.00 -0.13 0.00 0.00 55.73 54.52 2sbl s ARG 602 Cb -0.06 -3.02 -0.07 0.00 -1.56 0.00 0.00 34.95 30.25 2sbl s ARG 602 CO -0.04 -0.27 1.21 -0.51 -0.81 0.00 0.00 175.30 174.88 2sbl s LEU 603 N 1.44 4.40 0.18 -0.88 1.43 -1.26 -1.33 118.68 122.66 2sbl s LEU 603 Ca 0.04 2.10 0.12 0.00 -1.03 0.00 0.00 54.13 55.36 2sbl s LEU 603 Cb -0.15 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.40 2sbl s LEU 603 CO -0.03 -0.45 1.29 -0.07 0.23 0.00 0.00 176.35 177.32 2sbl h LEU 604 N 6.31 0.00 -7.88 1.79 4.07 -1.63 -3.31 115.31 114.67 2sbl h LEU 604 Ca -0.43 0.00 -0.74 0.00 0.08 0.00 0.00 57.88 56.80 2sbl h LEU 604 Cb 1.21 0.00 -0.29 0.00 1.08 0.00 0.00 40.66 42.66 2sbl h LEU 604 CO 0.79 0.74 -0.28 -0.63 -1.08 0.00 0.00 178.44 177.98 2sbl s ILE 605 N -2.84 4.47 0.21 1.22 1.01 -1.26 -4.96 121.20 119.06 2sbl s ILE 605 Ca 0.02 -2.09 -0.12 0.00 0.00 0.00 0.00 60.65 58.45 2sbl s ILE 605 Cb 0.09 -3.89 0.21 0.00 0.01 0.00 0.00 42.46 38.88 2sbl s ILE 605 CO 0.79 -0.85 1.64 -0.33 0.00 0.00 0.00 174.94 176.19 2sbl h GLU 606 N 8.12 0.05 -3.06 2.79 4.39 -1.92 -3.03 114.58 121.92 2sbl h GLU 606 Ca -0.13 -0.00 -0.72 0.00 0.34 0.00 0.00 59.36 58.85 2sbl h GLU 606 Cb 1.05 -0.01 -0.34 0.00 -0.10 0.00 0.00 28.75 29.35 2sbl h GLU 606 CO 0.83 0.03 0.10 -3.47 -1.16 0.00 0.00 179.01 175.34 2sbl n ASP 607 N -5.36 4.82 -4.40 1.42 2.03 -1.26 -4.89 116.55 108.91 2sbl n ASP 607 Ca 0.08 -3.24 -0.44 0.00 0.52 0.00 0.00 54.79 51.70 2sbl n ASP 607 Cb 0.34 -1.08 -0.07 0.00 -0.72 0.00 0.00 41.12 39.59 2sbl n ASP 607 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2sbl s TYR 608 N -1.90 3.20 0.12 -0.67 6.14 -1.15 -4.88 117.35 118.22 2sbl s TYR 608 Ca 0.31 -0.83 -0.21 0.00 0.64 0.00 0.00 57.07 56.98 2sbl s TYR 608 Cb -0.01 -3.22 -0.04 0.00 0.42 0.00 0.00 41.96 39.11 2sbl s TYR 608 CO -0.05 -0.84 1.70 -1.35 0.64 0.00 0.00 175.55 175.66 2sbl h PRO 609 N 8.80 -0.02 -0.40 4.97 0.11 -1.88 -0.79 132.00 142.79 2sbl h PRO 609 Ca -0.28 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.87 2sbl h PRO 609 Cb 1.11 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 2sbl h PRO 609 CO 0.89 -0.02 0.16 -0.92 -0.21 0.00 0.00 178.00 177.91 2sbl h TYR 610 N -0.02 0.29 -0.10 0.65 3.20 -1.88 -1.86 116.97 117.25 2sbl h TYR 610 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 2sbl h TYR 610 Cb 0.15 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.35 2sbl h TYR 610 CO -0.21 0.13 -0.08 0.00 -1.64 0.00 0.00 178.16 176.37 2sbl h ALA 611 N 1.24 0.14 0.02 1.82 0.00 -1.72 0.13 119.26 120.88 2sbl h ALA 611 Ca 0.18 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2sbl h ALA 611 Cb 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2sbl h ALA 611 CO -0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 179.25 179.00 2sbl h ALA 612 N 0.60 -0.06 -0.36 0.00 0.00 -1.12 0.91 119.26 119.22 2sbl h ALA 612 Ca 0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2sbl h ALA 612 Cb 0.57 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2sbl h ALA 612 CO 0.02 -0.54 -0.34 -0.44 0.00 0.00 0.00 179.25 177.95 2sbl h ASP 613 N -0.08 0.86 -0.84 0.00 5.19 -1.39 -3.14 116.42 117.01 2sbl h ASP 613 Ca 0.01 -0.37 0.04 0.00 -0.62 0.00 0.00 57.03 56.09 2sbl h ASP 613 Cb 0.09 -0.24 -0.05 0.00 0.18 0.00 0.00 39.33 39.31 2sbl h ASP 613 CO -0.02 1.11 0.54 1.23 -3.12 0.00 0.00 179.24 178.98 2sbl h GLY 614 N 0.90 1.24 2.00 2.75 0.00 -0.32 -1.18 103.07 108.46 2sbl h GLY 614 Ca 0.07 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2sbl h GLY 614 CO 0.08 0.33 -0.24 1.41 0.00 0.00 0.00 176.54 178.11 2sbl h LEU 615 N 1.03 0.00 -0.03 3.11 -0.00 -0.78 0.96 115.31 119.60 2sbl h LEU 615 Ca 0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.21 2sbl h LEU 615 Cb 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.71 2sbl h LEU 615 CO -0.13 0.24 -0.03 -0.08 -0.00 0.00 0.00 178.44 178.44 2sbl h GLU 616 N 0.00 0.07 -0.50 1.13 4.57 -1.23 -2.30 114.58 116.31 2sbl h GLU 616 Ca -0.00 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2sbl h GLU 616 Cb 0.48 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 2sbl h GLU 616 CO 0.03 0.55 0.26 0.82 -1.18 0.00 0.00 179.01 179.49 2sbl h ILE 617 N -0.41 1.18 0.09 2.32 1.08 -0.96 -2.57 117.51 118.25 2sbl h ILE 617 Ca 0.00 -0.50 0.02 0.00 -0.39 0.00 0.00 64.86 64.00 2sbl h ILE 617 Cb 0.54 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 2sbl h ILE 617 CO 0.01 0.20 -0.35 -0.25 -0.69 0.00 0.00 178.15 177.07 2sbl h TRP 618 N 0.66 -0.95 -0.75 1.37 2.91 -0.88 -1.62 115.95 116.69 2sbl h TRP 618 Ca 0.17 0.02 0.08 0.00 1.13 0.00 0.00 58.89 60.30 2sbl h TRP 618 Cb 0.09 0.41 -0.05 0.00 -0.51 0.00 0.00 29.16 29.10 2sbl h TRP 618 CO -0.01 -0.45 0.49 0.00 -1.03 0.00 0.00 178.44 177.44 2sbl h ALA 619 N 0.07 1.77 -0.10 2.65 0.00 -1.28 0.09 119.26 122.45 2sbl h ALA 619 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2sbl h ALA 619 Cb 0.60 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2sbl h ALA 619 CO -0.22 0.09 0.02 0.00 0.00 0.00 0.00 179.25 179.14 2sbl h ALA 620 N 1.61 0.13 -0.73 0.00 0.00 -1.01 -1.34 119.26 117.93 2sbl h ALA 620 Ca 0.34 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2sbl h ALA 620 Cb 0.39 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2sbl h ALA 620 CO -0.12 -0.24 0.36 0.82 0.00 0.00 0.00 179.25 180.08 2sbl h ILE 621 N -0.04 1.23 -0.41 0.00 2.04 -0.46 -2.33 117.51 117.53 2sbl h ILE 621 Ca 0.03 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 2sbl h ILE 621 Cb 0.25 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2sbl h ILE 621 CO 0.00 0.27 0.21 0.50 0.00 0.00 0.00 178.15 179.12 2sbl h LYS 622 N 1.03 0.59 -0.73 2.37 3.64 -0.68 -0.69 116.57 122.10 2sbl h LYS 622 Ca 0.25 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 2sbl h LYS 622 Cb 0.08 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2sbl h LYS 622 CO -0.04 0.51 0.33 1.15 -2.27 0.00 0.00 179.45 179.13 2sbl h THR 623 N 0.53 1.24 0.40 1.00 2.02 -0.99 0.16 112.91 117.27 2sbl h THR 623 Ca 0.14 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.60 2sbl h THR 623 Cb 0.10 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2sbl h THR 623 CO -0.02 0.29 -0.19 -0.25 0.37 0.00 0.00 175.52 175.72 2sbl h TRP 624 N 1.04 -0.50 -0.66 3.16 -0.00 -1.04 0.07 115.95 118.01 2sbl h TRP 624 Ca 0.25 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 59.09 2sbl h TRP 624 Cb 0.14 0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 29.44 2sbl h TRP 624 CO 0.01 -0.27 0.28 0.28 -0.00 0.00 0.00 178.44 178.74 2sbl h VAL 625 N -0.62 1.23 0.00 2.65 2.07 -0.99 -0.23 116.25 120.36 2sbl h VAL 625 Ca -0.06 -0.70 -0.10 0.00 0.82 0.00 0.00 66.70 66.67 2sbl h VAL 625 Cb 0.46 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2sbl h VAL 625 CO 0.09 0.28 -0.45 1.56 0.02 0.00 0.00 177.57 179.07 2sbl h GLN 626 N 0.95 0.00 0.02 1.57 4.20 -0.56 -2.00 115.11 119.30 2sbl h GLN 626 Ca 0.23 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.73 2sbl h GLN 626 Cb 0.16 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.96 2sbl h GLN 626 CO -0.02 0.45 -0.82 0.93 -0.67 0.00 0.00 178.83 178.70 2sbl h GLU 627 N 0.00 0.52 0.29 1.46 5.08 -0.29 -3.39 114.58 118.24 2sbl h GLU 627 Ca -0.00 -0.59 -0.01 0.00 -1.00 0.00 0.00 59.36 57.75 2sbl h GLU 627 Cb 0.84 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2sbl h GLU 627 CO 0.06 1.21 -0.14 -0.92 -1.00 0.00 0.00 179.01 178.22 2sbl h TYR 628 N 0.07 -0.36 -0.52 4.33 3.20 -0.92 -3.34 116.97 119.43 2sbl h TYR 628 Ca -0.11 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.81 2sbl h TYR 628 Cb 1.52 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.86 2sbl h TYR 628 CO 0.13 -0.04 0.25 0.28 -1.64 0.00 0.00 178.16 177.15 2sbl h VAL 629 N -0.71 0.92 -0.02 1.81 2.07 -1.56 -1.48 116.25 117.27 2sbl h VAL 629 Ca -0.04 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2sbl h VAL 629 Cb 0.49 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2sbl h VAL 629 CO 0.07 0.09 0.10 1.55 0.02 0.00 0.00 177.57 179.40 2sbl h PRO 630 N 0.48 0.00 0.00 1.57 0.13 -1.71 -0.72 132.00 131.75 2sbl h PRO 630 Ca 0.24 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.36 2sbl h PRO 630 Cb 0.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.30 2sbl h PRO 630 CO -0.18 0.00 -0.03 -0.07 -0.23 0.00 0.00 178.00 177.49 2sbl h LEU 631 N 0.00 0.00 0.00 1.56 3.38 -1.38 -3.28 115.31 115.58 2sbl h LEU 631 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2sbl h LEU 631 Cb 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2sbl h LEU 631 CO -0.00 0.03 -1.04 -1.22 0.09 0.00 0.00 178.44 176.29 2sbl n TYR 632 N -3.15 0.00 -3.95 1.13 4.01 -0.73 -4.93 117.16 109.54 2sbl n TYR 632 Ca -0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.43 2sbl n TYR 632 Cb 0.28 -0.02 -0.15 0.00 -0.31 0.00 0.00 39.34 39.13 2sbl n TYR 632 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2sbl s TYR 633 N -2.06 2.50 0.05 -0.72 2.02 -0.36 -4.97 117.35 113.81 2sbl s TYR 633 Ca -0.00 -1.83 -0.16 0.00 -0.37 0.00 0.00 57.07 54.71 2sbl s TYR 633 Cb 0.01 -1.63 -0.24 0.00 -0.40 0.00 0.00 41.96 39.69 2sbl s TYR 633 CO 0.04 -0.79 1.15 0.00 -1.57 0.00 0.00 175.55 174.38 2sbl h ALA 634 N 7.93 0.09 -2.36 3.71 0.00 -1.86 -3.35 119.26 123.43 2sbl h ALA 634 Ca -0.18 -0.68 -0.27 0.00 0.00 0.00 0.00 54.91 53.79 2sbl h ALA 634 Cb 1.07 0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.77 2sbl h ALA 634 CO 0.42 0.60 -0.65 1.03 0.00 0.00 0.00 179.25 180.66 2sbl s ARG 635 N -3.24 1.13 0.36 0.00 0.52 -1.26 -5.05 118.95 111.42 2sbl s ARG 635 Ca -0.11 -1.57 0.04 0.00 -0.52 0.00 0.00 55.73 53.58 2sbl s ARG 635 Cb 0.06 -0.08 0.69 0.00 0.52 0.00 0.00 34.95 36.13 2sbl s ARG 635 CO 0.90 -0.22 1.99 -0.44 0.02 0.00 0.00 175.30 177.55 2sbl h ASP 636 N 2.67 0.69 -0.05 0.23 3.32 -1.93 -1.96 116.42 119.39 2sbl h ASP 636 Ca -0.37 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.69 2sbl h ASP 636 Cb 1.22 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.60 2sbl h ASP 636 CO 0.60 0.48 0.05 0.44 -1.72 0.00 0.00 179.24 179.09 2sbl h ASP 637 N 0.81 0.00 -0.40 6.45 5.19 -1.97 -1.07 116.42 125.43 2sbl h ASP 637 Ca 0.26 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.58 2sbl h ASP 637 Cb 0.05 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.54 2sbl h ASP 637 CO -0.07 0.00 -0.10 0.44 -3.12 0.00 0.00 179.24 176.39 2sbl h ASP 638 N 0.00 0.84 0.04 6.45 3.32 -1.73 0.22 116.42 125.57 2sbl h ASP 638 Ca 0.02 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 2sbl h ASP 638 Cb 0.12 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.44 2sbl h ASP 638 CO -0.00 0.96 -0.02 0.58 -1.72 0.00 0.00 179.24 179.04 2sbl h VAL 639 N 0.76 1.22 -0.84 -1.35 2.07 -1.29 -2.27 116.25 114.55 2sbl h VAL 639 Ca 0.13 -0.86 0.10 0.00 0.82 0.00 0.00 66.70 66.89 2sbl h VAL 639 Cb 0.60 1.78 -0.06 0.00 -1.52 0.00 0.00 31.29 32.10 2sbl h VAL 639 CO 0.04 0.22 0.55 0.11 0.02 0.00 0.00 177.57 178.50 2sbl h LYS 640 N -0.44 0.77 0.00 1.57 1.57 -1.13 -2.28 116.57 116.64 2sbl h LYS 640 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2sbl h LYS 640 Cb 0.40 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2sbl h LYS 640 CO 0.01 0.51 -0.01 0.09 -0.57 0.00 0.00 179.45 179.48 2sbl n ASN 641 N -4.52 0.10 -4.56 0.86 5.03 0.76 -4.70 115.26 108.23 2sbl n ASN 641 Ca 0.14 0.49 -0.41 0.00 0.87 0.00 0.00 54.58 55.67 2sbl n ASN 641 Cb 0.32 -0.51 -0.03 0.00 -1.02 0.00 0.00 39.78 38.54 2sbl n ASN 641 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2sbl s ASP 642 N -3.17 6.13 0.21 6.41 -1.08 -0.86 -4.87 116.67 119.45 2sbl s ASP 642 Ca 0.14 -0.12 -0.10 0.00 -0.52 0.00 0.00 52.55 51.95 2sbl s ASP 642 Cb 0.18 -2.55 0.20 0.00 -1.46 0.00 0.00 42.92 39.29 2sbl s ASP 642 CO 0.54 -1.79 1.86 0.77 0.52 0.00 0.00 175.17 177.07 2sbl h SER 643 N 10.58 0.77 -0.60 -0.34 4.64 -1.88 -0.18 113.55 126.54 2sbl h SER 643 Ca -0.27 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 2sbl h SER 643 Cb 1.07 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.96 2sbl h SER 643 CO 1.24 0.53 0.32 -0.33 -0.87 0.00 0.00 176.83 177.72 2sbl h GLU 644 N 0.91 0.84 -0.61 4.77 5.08 -1.89 0.34 114.58 124.02 2sbl h GLU 644 Ca 0.29 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2sbl h GLU 644 Cb 0.00 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 2sbl h GLU 644 CO -0.10 0.65 -0.01 1.25 -1.00 0.00 0.00 179.01 179.79 2sbl h LEU 645 N 0.81 1.06 -0.67 1.33 5.85 -1.67 0.12 115.31 122.15 2sbl h LEU 645 Ca 0.21 -0.31 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 2sbl h LEU 645 Cb 0.06 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 2sbl h LEU 645 CO -0.03 1.11 -0.46 1.56 -0.34 0.00 0.00 178.44 180.28 2sbl h GLN 646 N 0.98 0.48 0.00 1.25 1.08 -0.93 -1.89 115.11 116.09 2sbl h GLN 646 Ca 0.17 -0.26 -0.19 0.00 -1.45 0.00 0.00 58.65 56.92 2sbl h GLN 646 Cb 0.58 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 2sbl h GLN 646 CO 0.03 0.85 -0.86 0.45 -0.95 0.00 0.00 178.83 178.35 2sbl h HIS 647 N 0.39 0.15 0.87 2.96 3.86 -0.46 -2.15 115.15 120.76 2sbl h HIS 647 Ca 0.02 -0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.11 2sbl h HIS 647 Cb 0.96 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 29.42 2sbl h HIS 647 CO 0.03 0.91 -0.42 2.35 0.86 0.00 0.00 177.93 181.66 2sbl h TRP 648 N 0.05 -1.08 -0.91 2.45 7.01 -0.63 -1.94 115.95 120.90 2sbl h TRP 648 Ca -0.03 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.93 2sbl h TRP 648 Cb 1.50 0.36 -0.04 0.00 -2.10 0.00 0.00 29.16 28.87 2sbl h TRP 648 CO 0.01 -0.67 0.51 2.35 -2.79 0.00 0.00 178.44 177.85 2sbl h TRP 649 N -1.19 1.23 -0.48 2.65 -0.00 -1.43 -0.99 115.95 115.73 2sbl h TRP 649 Ca -0.12 -0.02 0.04 0.00 -0.00 0.00 0.00 58.89 58.79 2sbl h TRP 649 Cb 0.90 -0.40 -0.04 0.00 -0.00 0.00 0.00 29.16 29.62 2sbl h TRP 649 CO 0.03 0.84 0.25 -0.22 -0.00 0.00 0.00 178.44 179.33 2sbl h LYS 650 N 1.26 0.47 -0.12 2.65 3.64 -1.37 -2.31 116.57 120.79 2sbl h LYS 650 Ca 0.32 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.47 2sbl h LYS 650 Cb -0.00 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2sbl h LYS 650 CO -0.05 0.31 -0.76 1.49 -2.27 0.00 0.00 179.45 178.17 2sbl h GLU 651 N 0.49 0.62 -0.55 1.90 4.81 -0.90 -0.02 114.58 120.92 2sbl h GLU 651 Ca 0.21 -0.51 -0.01 0.00 -0.13 0.00 0.00 59.36 58.92 2sbl h GLU 651 Cb 0.11 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 2sbl h GLU 651 CO -0.14 1.13 0.30 0.00 -0.73 0.00 0.00 179.01 179.57 2sbl h ALA 652 N 0.72 1.50 0.00 2.92 0.00 -0.90 0.18 119.26 123.68 2sbl h ALA 652 Ca -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2sbl h ALA 652 Cb 1.37 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2sbl h ALA 652 CO 0.15 0.42 -0.20 0.28 0.00 0.00 0.00 179.25 179.90 2sbl h VAL 653 N 0.76 1.22 -0.21 0.00 2.07 -1.37 0.27 116.25 118.98 2sbl h VAL 653 Ca 0.20 -1.98 -0.21 0.00 0.82 0.00 0.00 66.70 65.53 2sbl h VAL 653 Cb 0.02 2.37 0.01 0.00 -1.52 0.00 0.00 31.29 32.16 2sbl h VAL 653 CO -0.03 0.41 -0.68 -0.33 0.02 0.00 0.00 177.57 176.96 2sbl h GLU 654 N -1.00 0.84 0.00 1.57 5.08 -0.84 -2.78 114.58 117.45 2sbl h GLU 654 Ca -0.05 -0.62 -0.44 0.00 -1.00 0.00 0.00 59.36 57.25 2sbl h GLU 654 Cb 0.81 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 30.10 2sbl h GLU 654 CO -0.03 1.24 -2.48 1.63 -1.00 0.00 0.00 179.01 178.37 2sbl n LYS 655 N -3.97 0.60 0.36 2.33 5.02 0.53 -3.79 118.16 119.24 2sbl n LYS 655 Ca -0.06 0.26 -0.18 0.00 -2.02 0.00 0.00 58.31 56.31 2sbl n LYS 655 Cb 0.70 -1.51 -0.09 0.00 -0.02 0.00 0.00 35.03 34.11 2sbl n LYS 655 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2sbl h GLY 656 N -0.49 -0.91 -4.18 0.72 0.00 -0.92 -2.85 103.07 94.44 2sbl h GLY 656 Ca -0.67 0.34 -0.63 0.00 0.00 0.00 0.00 47.33 46.37 2sbl h GLY 656 CO -0.36 -0.33 -0.05 1.42 0.00 0.00 0.00 176.54 177.22 2sbl n HIS 657 N -5.46 3.06 -0.34 5.60 8.25 0.05 -1.38 115.22 125.01 2sbl n HIS 657 Ca -0.13 -2.65 0.19 0.00 -0.26 0.00 0.00 57.72 54.87 2sbl n HIS 657 Cb 0.35 -0.71 0.43 0.00 1.12 0.00 0.00 29.99 31.18 2sbl n HIS 657 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2sbl h GLY 658 N 2.35 1.60 2.00 -1.41 0.00 -1.24 -0.66 103.07 105.71 2sbl h GLY 658 Ca 0.45 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2sbl h GLY 658 CO 1.11 -0.18 0.00 1.22 0.00 0.00 0.00 176.54 178.69 2sbl n ASP 659 N -4.76 0.20 -0.06 0.19 8.00 -1.26 -1.53 116.55 117.32 2sbl n ASP 659 Ca 0.26 0.56 0.05 0.00 0.71 0.00 0.00 54.79 56.37 2sbl n ASP 659 Cb 0.79 -0.60 0.07 0.00 -0.02 0.00 0.00 41.12 41.36 2sbl n ASP 659 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2sbl n LEU 660 N -1.73 2.00 0.24 0.64 4.32 -0.27 -4.81 117.00 117.39 2sbl n LEU 660 Ca 0.02 -2.42 0.10 0.00 -0.02 0.00 0.00 56.01 53.69 2sbl n LEU 660 Cb 0.14 -0.22 0.60 0.00 -1.62 0.00 0.00 43.42 42.33 2sbl n LEU 660 CO 0.12 0.57 0.90 0.07 -1.22 0.00 0.00 177.39 177.84 2sbl h LYS 661 N 0.00 0.00 -0.84 3.23 2.10 -1.11 -2.83 116.57 117.12 2sbl h LYS 661 Ca 0.00 0.00 -0.27 0.00 -2.00 0.00 0.00 60.65 58.38 2sbl h LYS 661 Cb 0.82 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 31.99 2sbl h LYS 661 CO 0.00 0.18 0.34 -0.25 -2.00 0.00 0.00 179.45 177.73 2sbl n ASP 662 N -3.78 4.36 -4.76 7.07 8.00 -1.26 -4.93 116.55 121.25 2sbl n ASP 662 Ca -0.02 -3.19 -0.39 0.00 0.71 0.00 0.00 54.79 51.90 2sbl n ASP 662 Cb 0.29 -0.75 -0.05 0.00 -0.02 0.00 0.00 41.12 40.59 2sbl n ASP 662 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2sbl s LYS 663 N -2.81 4.43 0.59 -1.24 -0.14 -1.07 -4.95 119.74 114.56 2sbl s LYS 663 Ca 0.50 0.96 0.36 0.00 -1.36 0.00 0.00 55.97 56.44 2sbl s LYS 663 Cb 0.41 -3.34 1.81 0.00 -1.68 0.00 0.00 37.83 35.03 2sbl s LYS 663 CO 0.12 0.37 2.16 -1.00 -0.76 0.00 0.00 175.35 176.24 2sbl h PRO 664 N 5.40 0.00 -0.00 -1.68 0.13 -1.91 -3.05 132.00 130.89 2sbl h PRO 664 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2sbl h PRO 664 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2sbl h PRO 664 CO 0.69 0.03 0.00 -2.67 -0.23 0.00 0.00 178.00 175.83 2sbl n TRP 665 N -3.25 0.00 -2.25 1.56 4.27 -1.26 -4.83 117.44 111.68 2sbl n TRP 665 Ca -0.01 -0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.17 2sbl n TRP 665 Cb 0.19 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.12 2sbl n TRP 665 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2sbl s TRP 666 N -2.00 2.65 0.55 -2.67 0.52 -1.16 -4.72 118.94 112.12 2sbl s TRP 666 Ca 0.34 0.75 -0.20 0.00 0.02 0.00 0.00 56.10 57.01 2sbl s TRP 666 Cb 0.15 -3.66 -0.07 0.00 -1.15 0.00 0.00 33.47 28.75 2sbl s TRP 666 CO 0.26 -2.48 0.88 -0.35 0.02 0.00 0.00 176.95 175.28 2sbl n PRO 667 N 6.21 0.91 -4.81 4.98 -0.04 -1.26 -5.03 135.00 135.96 2sbl n PRO 667 Ca 0.14 0.35 -0.33 0.00 -0.04 0.00 0.00 63.50 63.62 2sbl n PRO 667 Cb 0.44 -2.04 -0.14 0.00 -0.04 0.00 0.00 33.50 31.73 2sbl n PRO 667 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2sbl s LYS 668 N -2.44 3.00 -1.31 0.54 1.02 -1.26 -5.04 119.74 114.26 2sbl s LYS 668 Ca 0.71 -0.68 -0.12 0.00 0.02 0.00 0.00 55.97 55.90 2sbl s LYS 668 Cb -0.45 -2.53 0.13 0.00 -0.52 0.00 0.00 37.83 34.45 2sbl s LYS 668 CO 0.51 0.40 1.86 1.28 -0.92 0.00 0.00 175.35 178.48 2sbl n LEU 669 N 2.97 6.23 -0.00 3.17 4.32 -1.26 -4.49 117.00 127.94 2sbl n LEU 669 Ca -0.18 -4.41 0.07 0.00 -0.02 0.00 0.00 56.01 51.48 2sbl n LEU 669 Cb 0.52 -1.58 -0.10 0.00 -1.62 0.00 0.00 43.42 40.65 2sbl n LEU 669 CO 0.28 1.05 -0.28 0.00 -1.22 0.00 0.00 177.39 177.22 2sbl n GLN 670 N 5.25 1.40 -4.31 3.23 1.13 -1.26 -4.09 117.38 118.72 2sbl n GLN 670 Ca 0.43 -0.05 -0.16 0.00 -1.94 0.00 0.00 57.00 55.27 2sbl n GLN 670 Cb 0.39 -1.28 -0.10 0.00 0.11 0.00 0.00 30.24 29.36 2sbl n GLN 670 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2sbl s THR 671 N -2.69 1.04 0.23 5.09 -4.23 -1.26 -4.42 115.64 109.39 2sbl s THR 671 Ca 0.01 -2.04 -0.07 0.00 -1.18 0.00 0.00 61.69 58.42 2sbl s THR 671 Cb 0.11 -2.25 0.18 0.00 1.34 0.00 0.00 72.50 71.87 2sbl s THR 671 CO 0.64 -0.40 1.80 -0.07 -0.54 0.00 0.00 174.62 176.04 2sbl h LEU 672 N 2.53 0.54 -0.89 4.79 -0.00 -1.87 -2.37 115.31 118.05 2sbl h LEU 672 Ca -0.38 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.55 2sbl h LEU 672 Cb 1.22 -0.05 -0.04 0.00 -0.00 0.00 0.00 40.66 41.78 2sbl h LEU 672 CO 0.64 0.32 0.56 -0.08 -0.00 0.00 0.00 178.44 179.88 2sbl h GLU 673 N 0.68 1.19 -0.43 1.13 4.81 -1.99 -0.21 114.58 119.76 2sbl h GLU 673 Ca 0.35 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2sbl h GLU 673 Cb 0.31 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2sbl h GLU 673 CO -0.24 0.82 0.15 -0.44 -0.73 0.00 0.00 179.01 178.57 2sbl h ASP 674 N 1.21 0.61 -0.63 1.04 3.32 -1.78 -1.61 116.42 118.58 2sbl h ASP 674 Ca 0.32 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2sbl h ASP 674 Cb -0.09 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 2sbl h ASP 674 CO -0.06 0.64 0.29 0.25 -1.72 0.00 0.00 179.24 178.63 2sbl h LEU 675 N 0.56 0.84 -0.35 1.55 5.85 -0.92 -1.73 115.31 121.11 2sbl h LEU 675 Ca 0.14 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2sbl h LEU 675 Cb 0.23 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2sbl h LEU 675 CO -0.01 0.75 0.22 0.58 -0.34 0.00 0.00 178.44 179.64 2sbl h VAL 676 N 0.88 1.06 0.23 1.05 2.07 -0.79 -1.63 116.25 119.13 2sbl h VAL 676 Ca 0.22 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2sbl h VAL 676 Cb 0.14 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2sbl h VAL 676 CO -0.02 0.08 -0.20 -0.08 0.02 0.00 0.00 177.57 177.36 2sbl h GLU 677 N 0.45 -0.44 -0.38 1.57 4.81 -1.08 -0.10 114.58 119.40 2sbl h GLU 677 Ca 0.13 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 2sbl h GLU 677 Cb -0.03 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2sbl h GLU 677 CO -0.05 -0.29 0.20 0.28 -0.73 0.00 0.00 179.01 178.42 2sbl h VAL 678 N -0.46 0.99 -0.80 0.32 2.07 -1.20 -0.48 116.25 116.69 2sbl h VAL 678 Ca -0.01 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2sbl h VAL 678 Cb 0.42 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 2sbl h VAL 678 CO -0.03 0.07 0.41 0.00 0.02 0.00 0.00 177.57 178.04 2sbl h LEU 680 N 1.13 -0.02 -0.77 0.00 5.85 -0.15 -1.16 115.31 120.19 2sbl h LEU 680 Ca 0.28 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2sbl h LEU 680 Cb 0.08 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 2sbl h LEU 680 CO -0.04 0.16 0.46 0.40 -0.34 0.00 0.00 178.44 179.08 2sbl h ILE 681 N -0.21 1.22 -0.53 4.05 2.04 -1.08 0.12 117.51 123.12 2sbl h ILE 681 Ca -0.00 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 2sbl h ILE 681 Cb 0.20 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 2sbl h ILE 681 CO 0.00 0.23 0.20 0.40 0.00 0.00 0.00 178.15 178.98 2sbl h ILE 682 N 1.05 1.22 -0.39 -0.67 2.04 -1.32 -1.92 117.51 117.52 2sbl h ILE 682 Ca 0.27 -0.71 -0.16 0.00 1.00 0.00 0.00 64.86 65.27 2sbl h ILE 682 Cb -0.04 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 2sbl h ILE 682 CO -0.05 0.27 -0.38 0.40 0.00 0.00 0.00 178.15 178.39 2sbl h ILE 683 N 0.72 1.27 -0.16 -0.67 2.04 -0.60 -2.75 117.51 117.37 2sbl h ILE 683 Ca 0.17 -1.55 0.03 0.00 1.00 0.00 0.00 64.86 64.51 2sbl h ILE 683 Cb 0.22 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 2sbl h ILE 683 CO -0.01 0.52 -0.03 -0.25 0.00 0.00 0.00 178.15 178.38 2sbl h TRP 684 N 0.76 -0.06 -0.06 1.37 2.91 -0.49 -2.02 115.95 118.37 2sbl h TRP 684 Ca 0.06 0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.10 2sbl h TRP 684 Cb 0.97 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.66 2sbl h TRP 684 CO 0.06 -0.05 -0.00 0.82 -1.03 0.00 0.00 178.44 178.24 2sbl h ILE 685 N 0.02 0.96 -1.00 2.65 2.04 -1.35 -0.79 117.51 120.03 2sbl h ILE 685 Ca 0.07 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.94 2sbl h ILE 685 Cb 0.11 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 2sbl h ILE 685 CO -0.15 0.00 0.66 0.00 0.00 0.00 0.00 178.15 178.66 2sbl h ALA 686 N 1.05 1.27 -3.00 1.87 0.00 -1.24 -1.66 119.26 117.55 2sbl h ALA 686 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2sbl h ALA 686 Cb 0.03 -0.41 0.00 0.00 0.00 0.00 0.00 17.79 17.41 2sbl h ALA 686 CO -0.05 0.67 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 2sbl n SER 687 N -4.38 0.00 -0.12 0.00 3.41 -0.78 -2.87 113.62 108.88 2sbl n SER 687 Ca 0.12 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.62 2sbl n SER 687 Cb 0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 2sbl n SER 687 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2sbl h ALA 688 N -1.90 0.46 -0.16 7.33 0.00 -1.68 0.12 119.26 123.43 2sbl h ALA 688 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2sbl h ALA 688 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2sbl h ALA 688 CO 0.00 0.23 0.07 1.25 0.00 0.00 0.00 179.25 180.79 2sbl h LEU 689 N 0.41 0.23 -0.98 0.00 5.85 -1.28 -0.36 115.31 119.17 2sbl h LEU 689 Ca 0.10 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 2sbl h LEU 689 Cb 0.47 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2sbl h LEU 689 CO 0.02 0.33 0.32 -0.74 -0.34 0.00 0.00 178.44 178.03 2sbl h HIS 690 N 0.11 1.06 0.25 1.25 2.76 -1.18 -2.59 115.15 116.80 2sbl h HIS 690 Ca 0.05 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 2sbl h HIS 690 Cb 0.17 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 28.80 2sbl h HIS 690 CO -0.01 0.78 -0.16 0.00 -1.30 0.00 0.00 177.93 177.24 2sbl h ALA 691 N 1.31 -0.38 -0.40 5.26 0.00 -0.40 -0.24 119.26 124.41 2sbl h ALA 691 Ca 0.25 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.15 2sbl h ALA 691 Cb 0.15 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 2sbl h ALA 691 CO -0.03 -0.73 0.06 0.00 0.00 0.00 0.00 179.25 178.56 2sbl h ALA 692 N 0.34 0.42 0.00 0.00 0.00 -0.85 -1.84 119.26 117.33 2sbl h ALA 692 Ca -0.02 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2sbl h ALA 692 Cb 0.33 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2sbl h ALA 692 CO 0.02 -0.34 -0.31 -0.39 0.00 0.00 0.00 179.25 178.23 2sbl h VAL 693 N 0.18 0.05 0.00 0.00 -1.51 -1.50 -3.41 116.25 110.06 2sbl h VAL 693 Ca 0.20 -1.07 -0.10 0.00 -1.23 0.00 0.00 66.70 64.49 2sbl h VAL 693 Cb 0.25 1.89 -0.02 0.00 -2.13 0.00 0.00 31.29 31.29 2sbl h VAL 693 CO -0.28 0.03 -0.85 -3.20 -1.23 0.00 0.00 177.57 172.04 2sbl n ASN 694 N -2.99 1.83 0.00 4.19 5.15 -0.10 -4.62 115.26 118.71 2sbl n ASN 694 Ca 0.03 0.54 0.13 0.00 -0.60 0.00 0.00 54.58 54.68 2sbl n ASN 694 Cb 0.55 -0.91 0.75 0.00 -0.53 0.00 0.00 39.78 39.64 2sbl n ASN 694 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2sbl n PHE 695 N -4.53 0.00 1.19 1.20 3.72 -0.76 -2.33 117.46 115.94 2sbl n PHE 695 Ca -0.18 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.34 2sbl n PHE 695 Cb 0.45 -0.02 0.25 0.00 -0.94 0.00 0.00 39.48 39.22 2sbl n PHE 695 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2sbl n GLY 696 N 0.60 0.33 0.38 1.37 0.00 -1.26 -4.38 105.19 102.22 2sbl n GLY 696 Ca 0.19 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 2sbl n GLY 696 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2sbl h GLN 697 N 3.16 -0.81 -0.19 1.61 4.20 -1.73 -1.19 115.11 120.17 2sbl h GLN 697 Ca 0.00 0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.56 2sbl h GLN 697 Cb 0.74 0.18 0.01 0.00 0.30 0.00 0.00 27.48 28.71 2sbl h GLN 697 CO 0.00 -0.54 -0.70 -0.92 -0.67 0.00 0.00 178.83 176.00 2sbl h TYR 698 N -0.84 1.05 -0.95 2.96 5.03 -1.82 0.50 116.97 122.90 2sbl h TYR 698 Ca -0.07 -0.43 0.19 0.00 2.58 0.00 0.00 58.73 61.00 2sbl h TYR 698 Cb 0.69 -0.17 -0.18 0.00 1.55 0.00 0.00 36.73 38.61 2sbl h TYR 698 CO -0.10 1.26 -0.23 -2.30 -1.32 0.00 0.00 178.16 175.47 2sbl n PRO 699 N -3.95 -0.08 -0.06 1.82 -0.02 -1.19 -0.75 135.00 130.76 2sbl n PRO 699 Ca -0.06 1.47 -0.05 0.00 -2.02 0.00 0.00 63.50 62.84 2sbl n PRO 699 Cb 0.71 -2.20 -0.15 0.00 -0.02 0.00 0.00 33.50 31.83 2sbl n PRO 699 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2sbl n TYR 700 N -5.54 0.25 0.39 6.00 4.01 -0.45 -1.22 117.16 120.60 2sbl n TYR 700 Ca 0.15 0.09 0.11 0.00 -0.16 0.00 0.00 57.90 58.09 2sbl n TYR 700 Cb 0.48 -0.96 -0.09 0.00 -0.31 0.00 0.00 39.34 38.46 2sbl n TYR 700 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2sbl n GLY 701 N 1.61 -1.10 0.41 2.72 0.00 0.17 -4.16 105.19 104.84 2sbl n GLY 701 Ca -0.24 -0.48 0.23 0.00 0.00 0.00 0.00 46.02 45.54 2sbl n GLY 701 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2sbl h GLY 702 N 4.38 0.07 -7.20 -0.02 0.00 -1.04 -3.21 103.07 96.05 2sbl h GLY 702 Ca 0.00 -0.02 -0.67 0.00 0.00 0.00 0.00 47.33 46.64 2sbl h GLY 702 CO 0.00 0.00 0.22 -2.27 0.00 0.00 0.00 176.54 174.50 2sbl s LEU 703 N -8.72 4.91 0.42 3.11 1.98 -1.26 -4.90 118.68 114.21 2sbl s LEU 703 Ca -0.05 -1.05 0.14 0.00 -2.89 0.00 0.00 54.13 50.28 2sbl s LEU 703 Cb 0.20 -2.43 1.01 0.00 0.66 0.00 0.00 46.19 45.63 2sbl s LEU 703 CO 0.75 -1.12 1.93 -0.29 -1.89 0.00 0.00 176.35 175.73 2sbl h ILE 704 N 5.92 0.83 0.00 6.68 6.09 -1.87 0.25 117.51 135.41 2sbl h ILE 704 Ca -0.28 -0.16 -0.01 0.00 -1.37 0.00 0.00 64.86 63.04 2sbl h ILE 704 Cb 1.08 0.33 -0.00 0.00 0.47 0.00 0.00 36.82 38.71 2sbl h ILE 704 CO 1.07 0.08 -0.05 0.24 -3.07 0.00 0.00 178.15 176.42 2sbl h MET 705 N 0.46 0.00 0.14 2.19 2.86 -1.91 -1.63 114.93 117.03 2sbl h MET 705 Ca 0.36 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.70 2sbl h MET 705 Cb 0.75 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.42 2sbl h MET 705 CO -0.12 0.05 -1.36 -0.97 1.06 0.00 0.00 176.91 175.57 2sbl h ASN 706 N 0.00 0.47 -2.06 1.22 -1.24 -1.24 -3.40 115.58 109.33 2sbl h ASN 706 Ca -0.00 -0.55 -0.56 0.00 0.71 0.00 0.00 56.30 55.90 2sbl h ASN 706 Cb 0.30 -0.15 -0.40 0.00 0.73 0.00 0.00 38.32 38.80 2sbl h ASN 706 CO 0.01 1.43 -0.96 0.54 -1.29 0.00 0.00 177.43 177.16 2sbl n ARG 707 N -3.53 1.35 -2.27 6.67 5.12 -0.78 -5.01 116.66 118.21 2sbl n ARG 707 Ca -0.12 -3.70 -0.39 0.00 -1.93 0.00 0.00 57.85 51.70 2sbl n ARG 707 Cb 1.04 -1.59 -0.02 0.00 -1.16 0.00 0.00 32.46 30.72 2sbl n ARG 707 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2sbl s PRO 708 N -1.79 4.24 0.00 5.56 0.04 -0.69 -4.82 135.00 137.55 2sbl s PRO 708 Ca 0.38 1.94 0.24 0.00 0.04 0.00 0.00 61.00 63.60 2sbl s PRO 708 Cb 0.19 -2.88 0.21 0.00 0.04 0.00 0.00 34.50 32.06 2sbl s PRO 708 CO -0.08 -0.19 1.21 0.25 0.04 0.00 0.00 177.00 178.23 2sbl n THR 709 N 0.48 0.00 -3.58 1.26 -2.24 -1.26 -3.96 114.28 104.97 2sbl n THR 709 Ca 0.02 -0.12 -0.15 0.00 -2.27 0.00 0.00 64.05 61.53 2sbl n THR 709 Cb 0.45 0.82 -0.06 0.00 -2.10 0.00 0.00 70.33 69.43 2sbl n THR 709 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2sbl s ALA 710 N -2.70 -1.80 0.03 6.98 0.00 -1.26 -0.99 121.76 122.02 2sbl s ALA 710 Ca 0.16 1.71 0.03 0.00 0.00 0.00 0.00 51.96 53.86 2sbl s ALA 710 Cb 0.18 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2sbl s ALA 710 CO 0.65 -0.34 -0.01 -1.54 0.00 0.00 0.00 175.76 174.52 2sbl s SER 711 N -0.34 4.98 0.00 0.00 1.04 -1.26 -1.92 113.70 116.20 2sbl s SER 711 Ca -0.04 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2sbl s SER 711 Cb -0.03 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.85 2sbl s SER 711 CO 0.04 0.25 0.18 0.54 0.98 0.00 0.00 173.24 175.24 2sbl n ARG 712 N 1.19 3.54 -3.79 4.02 1.74 0.38 -1.86 116.66 121.88 2sbl n ARG 712 Ca -0.14 -0.18 -0.13 0.00 -0.77 0.00 0.00 57.85 56.63 2sbl n ARG 712 Cb 0.52 -0.66 -0.11 0.00 -1.02 0.00 0.00 32.46 31.19 2sbl n ARG 712 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2sbl s ARG 713 N -0.56 0.39 0.66 5.56 3.52 -1.26 -4.29 118.95 122.97 2sbl s ARG 713 Ca 0.00 0.17 -0.05 0.00 -0.13 0.00 0.00 55.73 55.72 2sbl s ARG 713 Cb 0.00 0.18 0.14 0.00 -1.56 0.00 0.00 34.95 33.71 2sbl s ARG 713 CO 0.00 -0.07 0.90 1.28 -0.81 0.00 0.00 175.30 176.60 2sbl n LEU 714 N 2.46 0.00 -4.73 -0.88 4.32 -1.26 -4.81 117.00 112.09 2sbl n LEU 714 Ca -0.16 -1.52 -0.41 0.00 -0.02 0.00 0.00 56.01 53.90 2sbl n LEU 714 Cb 0.57 -0.63 -0.04 0.00 -1.62 0.00 0.00 43.42 41.70 2sbl n LEU 714 CO 0.19 -1.03 0.70 -0.22 -1.22 0.00 0.00 177.39 175.82 2sbl s LEU 715 N 0.00 4.51 0.50 2.23 2.96 -1.26 -4.97 118.68 122.65 2sbl s LEU 715 Ca 0.56 1.90 -0.21 0.00 -0.22 0.00 0.00 54.13 56.16 2sbl s LEU 715 Cb -0.03 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 43.01 2sbl s LEU 715 CO 0.38 -0.09 1.17 -2.84 -1.32 0.00 0.00 176.35 173.65 2sbl s PRO 716 N -0.22 3.52 0.19 0.98 0.02 -1.26 -5.03 135.00 133.21 2sbl s PRO 716 Ca 0.47 1.77 -0.09 0.00 0.02 0.00 0.00 61.00 63.17 2sbl s PRO 716 Cb -0.25 -2.24 -0.07 0.00 0.02 0.00 0.00 34.50 31.96 2sbl s PRO 716 CO 0.32 -0.75 0.50 -1.21 -0.33 0.00 0.00 177.00 175.53 2sbl s GLU 717 N -2.94 3.77 0.35 5.54 0.41 -1.26 -4.88 118.70 119.69 2sbl s GLU 717 Ca 0.68 0.20 -0.28 0.00 -0.41 0.00 0.00 54.97 55.15 2sbl s GLU 717 Cb -0.28 -2.74 -0.11 0.00 -1.78 0.00 0.00 34.13 29.22 2sbl s GLU 717 CO 0.33 0.38 1.39 0.21 -0.49 0.00 0.00 175.26 177.08 2sbl s LYS 718 N -2.65 4.24 0.00 1.61 2.20 -1.26 -2.79 119.74 121.08 2sbl s LYS 718 Ca 0.44 2.38 0.00 0.00 -0.36 0.00 0.00 55.97 58.43 2sbl s LYS 718 Cb -0.12 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 2sbl s LYS 718 CO 0.22 -0.35 0.00 0.41 -0.36 0.00 0.00 175.35 175.27 2sbl n GLY 719 N 0.65 0.64 3.88 5.54 0.00 -1.26 -5.07 105.19 109.58 2sbl n GLY 719 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2sbl n GLY 719 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2sbl s THR 720 N -2.41 4.85 0.45 2.61 -4.23 -1.12 -5.03 115.64 110.75 2sbl s THR 720 Ca 0.00 -1.04 0.16 0.00 -1.18 0.00 0.00 61.69 59.63 2sbl s THR 720 Cb 0.00 -3.55 0.35 0.00 1.34 0.00 0.00 72.50 70.64 2sbl s THR 720 CO 0.00 -0.21 1.96 1.55 -0.54 0.00 0.00 174.62 177.38 2sbl h PRO 721 N 1.85 0.34 0.00 3.99 0.13 -1.97 -1.81 132.00 134.53 2sbl h PRO 721 Ca -0.49 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 2sbl h PRO 721 Cb 1.21 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2sbl h PRO 721 CO 0.63 0.23 -0.17 1.05 -0.23 0.00 0.00 178.00 179.51 2sbl h GLU 722 N 0.35 0.00 -0.12 0.86 9.09 -1.96 0.03 114.58 122.83 2sbl h GLU 722 Ca 0.30 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.54 2sbl h GLU 722 Cb 0.71 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.81 2sbl h GLU 722 CO -0.08 0.17 -0.59 -0.92 0.05 0.00 0.00 179.01 177.63 2sbl h TYR 723 N 0.00 0.83 -0.21 2.06 3.20 -1.53 -2.63 116.97 118.70 2sbl h TYR 723 Ca -0.00 -0.37 -0.08 0.00 3.14 0.00 0.00 58.73 61.42 2sbl h TYR 723 Cb 0.79 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 2sbl h TYR 723 CO 0.00 1.16 -0.22 1.49 -1.64 0.00 0.00 178.16 178.95 2sbl h GLU 724 N 0.26 0.37 -0.29 1.82 4.57 -1.34 -2.29 114.58 117.68 2sbl h GLU 724 Ca -0.04 -0.12 -0.07 0.00 -1.18 0.00 0.00 59.36 57.95 2sbl h GLU 724 Cb 1.23 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.78 2sbl h GLU 724 CO 0.12 0.58 -0.11 1.49 -1.18 0.00 0.00 179.01 179.91 2sbl h GLU 725 N 0.33 0.48 -0.53 1.92 4.81 -0.94 0.59 114.58 121.24 2sbl h GLU 725 Ca 0.05 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 2sbl h GLU 725 Cb 0.58 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 2sbl h GLU 725 CO 0.04 0.59 0.28 0.52 -0.73 0.00 0.00 179.01 179.71 2sbl h MET 726 N 0.45 0.52 0.62 1.92 2.86 -1.03 0.52 114.93 120.79 2sbl h MET 726 Ca 0.08 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2sbl h MET 726 Cb 0.47 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.02 2sbl h MET 726 CO 0.03 0.35 -0.30 0.82 1.06 0.00 0.00 176.91 178.86 2sbl h ILE 727 N 0.54 0.30 0.00 -1.22 2.04 -1.31 -2.36 117.51 115.50 2sbl h ILE 727 Ca 0.23 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2sbl h ILE 727 Cb 0.13 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2sbl h ILE 727 CO -0.15 0.03 -0.20 0.59 0.00 0.00 0.00 178.15 178.41 2sbl n ASN 728 N -5.39 0.70 -2.71 1.72 3.02 0.17 -4.38 115.26 108.39 2sbl n ASN 728 Ca -0.12 0.40 -0.08 0.00 -0.03 0.00 0.00 54.58 54.75 2sbl n ASN 728 Cb 0.36 -0.45 0.10 0.00 -0.61 0.00 0.00 39.78 39.18 2sbl n ASN 728 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2sbl n ASN 729 N -2.13 -2.06 -0.58 6.41 2.85 0.18 -5.00 115.26 114.94 2sbl n ASN 729 Ca 0.05 -3.02 0.47 0.00 -0.11 0.00 0.00 54.58 51.97 2sbl n ASN 729 Cb 0.42 1.50 0.73 0.00 1.24 0.00 0.00 39.78 43.66 2sbl n ASN 729 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 2sbl h HIS 730 N 2.48 0.00 -0.04 1.20 2.07 -1.34 -0.22 115.15 119.30 2sbl h HIS 730 Ca -0.20 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.18 2sbl h HIS 730 Cb 1.19 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.18 2sbl h HIS 730 CO 0.21 0.00 -0.51 0.93 -3.07 0.00 0.00 177.93 175.49 2sbl h GLU 731 N 0.00 0.40 -0.39 5.12 5.08 -1.89 -1.03 114.58 121.88 2sbl h GLU 731 Ca 0.82 -0.39 -0.07 0.00 -1.00 0.00 0.00 59.36 58.73 2sbl h GLU 731 Cb 3.55 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 32.88 2sbl h GLU 731 CO -0.01 1.05 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.80 2sbl h LYS 732 N -0.09 0.64 -0.37 2.33 1.63 -1.15 0.64 116.57 120.19 2sbl h LYS 732 Ca -0.05 -0.16 0.04 0.00 -0.85 0.00 0.00 60.65 59.62 2sbl h LYS 732 Cb 1.20 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.71 2sbl h LYS 732 CO 0.10 0.68 0.15 0.00 -3.45 0.00 0.00 179.45 176.93 2sbl h ALA 733 N 1.37 0.44 -0.09 5.00 0.00 -1.28 0.19 119.26 124.89 2sbl h ALA 733 Ca 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2sbl h ALA 733 Cb 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2sbl h ALA 733 CO 0.02 -0.24 -0.02 -0.92 0.00 0.00 0.00 179.25 178.09 2sbl h TYR 734 N 0.31 0.20 0.00 0.00 5.03 -0.61 -2.30 116.97 119.60 2sbl h TYR 734 Ca 0.17 -0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.43 2sbl h TYR 734 Cb 0.13 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.36 2sbl h TYR 734 CO -0.13 0.48 -0.05 -0.07 -1.32 0.00 0.00 178.16 177.06 2sbl h LEU 735 N -0.14 0.00 -0.58 2.82 -0.00 -0.64 -0.98 115.31 115.79 2sbl h LEU 735 Ca 0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.79 2sbl h LEU 735 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.06 2sbl h LEU 735 CO 0.01 0.05 -0.16 0.03 -0.00 0.00 0.00 178.44 178.37 2sbl h ARG 736 N 0.00 0.96 -0.18 1.13 3.08 -0.80 -3.17 114.38 115.40 2sbl h ARG 736 Ca -0.00 -0.38 -0.13 0.00 0.07 0.00 0.00 59.98 59.54 2sbl h ARG 736 Cb 0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2sbl h ARG 736 CO 0.01 1.04 -0.45 1.15 -1.07 0.00 0.00 179.97 180.65 2sbl h THR 737 N 0.85 1.32 -5.88 2.04 2.02 -0.61 -3.42 112.91 109.22 2sbl h THR 737 Ca 0.12 -1.64 -0.37 0.00 0.77 0.00 0.00 66.41 65.29 2sbl h THR 737 Cb 0.72 1.67 0.03 0.00 -1.74 0.00 0.00 68.15 68.83 2sbl h THR 737 CO 0.06 0.51 -0.03 2.30 0.37 0.00 0.00 175.52 178.72 2sbl n ILE 738 N -4.00 0.00 -1.71 3.11 -5.35 -0.89 -0.47 119.36 110.05 2sbl n ILE 738 Ca -0.02 -1.46 -0.67 0.00 -0.27 0.00 0.00 62.75 60.33 2sbl n ILE 738 Cb 0.53 -0.68 -0.10 0.00 -1.74 0.00 0.00 39.64 37.66 2sbl n ILE 738 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 2sbl n THR 739 N -2.06 0.00 -0.58 7.28 -1.04 -0.81 -4.71 114.28 112.37 2sbl n THR 739 Ca 0.13 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.84 2sbl n THR 739 Cb 0.47 -0.50 0.21 0.00 -1.82 0.00 0.00 70.33 68.69 2sbl n THR 739 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2sbl n SER 740 N 4.10 -1.23 -0.05 8.00 2.88 -1.26 -4.76 113.62 121.29 2sbl n SER 740 Ca 0.32 0.05 -0.10 0.00 -1.33 0.00 0.00 58.87 57.80 2sbl n SER 740 Cb -0.06 -1.29 -0.04 0.00 -0.75 0.00 0.00 64.21 62.08 2sbl n SER 740 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2sbl h LYS 741 N -2.32 0.28 0.18 -1.46 3.64 -1.93 -1.73 116.57 113.23 2sbl h LYS 741 Ca -0.54 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.81 2sbl h LYS 741 Cb 1.31 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2sbl h LYS 741 CO 0.44 0.22 -0.09 1.25 -2.27 0.00 0.00 179.45 179.01 2sbl h LEU 742 N 0.25 -0.20 -0.97 5.20 5.85 -1.93 -2.33 115.31 121.17 2sbl h LEU 742 Ca 0.07 -0.15 0.24 0.00 0.84 0.00 0.00 57.88 58.88 2sbl h LEU 742 Cb 0.01 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 40.97 2sbl h LEU 742 CO -0.01 0.04 0.54 -0.65 -0.34 0.00 0.00 178.44 178.02 2sbl h PRO 743 N -0.45 0.53 -0.90 5.25 0.11 -1.91 -1.65 132.00 132.98 2sbl h PRO 743 Ca -0.02 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.06 2sbl h PRO 743 Cb 0.34 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 31.29 2sbl h PRO 743 CO 0.04 0.35 0.60 1.15 -0.21 0.00 0.00 178.00 179.92 2sbl h THR 744 N 0.54 1.23 -0.53 -1.15 2.02 -0.98 0.59 112.91 114.63 2sbl h THR 744 Ca 0.62 -0.42 -0.12 0.00 0.77 0.00 0.00 66.41 67.26 2sbl h THR 744 Cb 1.17 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 2sbl h THR 744 CO -0.48 0.22 -0.14 -0.07 0.37 0.00 0.00 175.52 175.42 2sbl h LEU 745 N 1.22 1.05 0.03 2.58 3.38 -0.76 -0.11 115.31 122.69 2sbl h LEU 745 Ca 0.33 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2sbl h LEU 745 Cb -0.14 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.32 2sbl h LEU 745 CO -0.07 1.17 -0.01 0.40 0.09 0.00 0.00 178.44 180.01 2sbl h ILE 746 N 0.91 1.29 -0.56 1.22 2.04 -1.34 -2.37 117.51 118.71 2sbl h ILE 746 Ca 0.13 -1.02 0.11 0.00 1.00 0.00 0.00 64.86 65.09 2sbl h ILE 746 Cb 0.72 1.97 -0.10 0.00 -0.74 0.00 0.00 36.82 38.67 2sbl h ILE 746 CO 0.06 0.26 -0.07 -1.28 0.00 0.00 0.00 178.15 177.12 2sbl h SER 747 N -0.48 -0.37 -0.30 1.72 0.87 -0.77 -1.95 113.55 112.26 2sbl h SER 747 Ca -0.00 0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 2sbl h SER 747 Cb 0.45 0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 2sbl h SER 747 CO 0.01 -0.14 0.11 -0.07 -0.53 0.00 0.00 176.83 176.21 2sbl h LEU 748 N 0.06 0.43 -1.03 2.23 4.07 -0.98 -1.87 115.31 118.21 2sbl h LEU 748 Ca 0.28 -0.18 0.02 0.00 0.08 0.00 0.00 57.88 58.08 2sbl h LEU 748 Cb 0.44 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 42.01 2sbl h LEU 748 CO -0.52 0.49 0.65 0.28 -1.08 0.00 0.00 178.44 178.26 2sbl h SER 749 N 0.34 1.12 0.08 -0.43 0.02 -0.98 -0.65 113.55 113.05 2sbl h SER 749 Ca 0.10 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2sbl h SER 749 Cb 0.20 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2sbl h SER 749 CO -0.01 0.80 -0.04 0.58 -1.14 0.00 0.00 176.83 177.03 2sbl h VAL 750 N 1.32 1.18 0.00 2.27 2.07 -1.12 -2.43 116.25 119.55 2sbl h VAL 750 Ca 0.37 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2sbl h VAL 750 Cb -0.12 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2sbl h VAL 750 CO -0.09 0.25 -0.03 0.16 0.02 0.00 0.00 177.57 177.87 2sbl h ILE 751 N -0.57 0.14 -0.16 4.57 3.07 -1.22 0.19 117.51 123.53 2sbl h ILE 751 Ca -0.01 -0.38 -0.08 0.00 1.55 0.00 0.00 64.86 65.95 2sbl h ILE 751 Cb 0.48 1.32 -0.00 0.00 -0.27 0.00 0.00 36.82 38.35 2sbl h ILE 751 CO 0.02 0.03 -0.19 -0.08 -1.05 0.00 0.00 178.15 176.88 2sbl h GLU 752 N 0.00 0.41 0.10 0.16 4.81 -1.00 0.05 114.58 119.11 2sbl h GLU 752 Ca -0.00 -0.23 0.02 0.00 -0.13 0.00 0.00 59.36 59.02 2sbl h GLU 752 Cb 0.32 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 2sbl h GLU 752 CO 0.00 0.81 -0.24 0.82 -0.73 0.00 0.00 179.01 179.67 2sbl h ILE 753 N 0.05 0.46 -0.02 2.32 2.04 -0.78 -2.68 117.51 118.90 2sbl h ILE 753 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2sbl h ILE 753 Cb 0.75 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2sbl h ILE 753 CO 0.05 0.00 0.02 -0.07 0.00 0.00 0.00 178.15 178.15 2sbl h LEU 754 N -0.43 0.00 -1.07 1.44 4.07 -0.92 -0.62 115.31 117.78 2sbl h LEU 754 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 2sbl h LEU 754 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 2sbl h LEU 754 CO -0.15 0.00 0.00 -1.20 -1.08 0.00 0.00 178.44 176.01 2sbl n SER 755 N -4.32 1.61 -4.74 -0.43 7.64 -0.00 -4.68 113.62 108.69 2sbl n SER 755 Ca -0.02 -1.68 -0.37 0.00 1.01 0.00 0.00 58.87 57.81 2sbl n SER 755 Cb 0.11 -0.09 -0.07 0.00 -1.01 0.00 0.00 64.21 63.15 2sbl n SER 755 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2sbl s THR 756 N -1.82 5.29 -0.01 0.44 2.01 -0.24 -4.41 115.64 116.90 2sbl s THR 756 Ca 0.33 0.58 -0.22 0.00 0.31 0.00 0.00 61.69 62.69 2sbl s THR 756 Cb 0.18 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 2sbl s THR 756 CO 0.27 0.41 0.64 -1.00 -0.69 0.00 0.00 174.62 174.25 2sbl s HIS 757 N 0.27 3.67 0.51 4.92 3.76 -0.90 -4.89 115.29 122.63 2sbl s HIS 757 Ca 0.18 1.25 -0.14 0.00 -0.15 0.00 0.00 55.06 56.20 2sbl s HIS 757 Cb -0.13 -2.68 -0.07 0.00 1.11 0.00 0.00 32.58 30.81 2sbl s HIS 757 CO 0.05 0.29 0.94 0.00 -0.85 0.00 0.00 174.74 175.17 2sbl s ALA 758 N 0.02 3.15 -0.31 -1.40 0.00 -1.26 -0.98 121.76 120.97 2sbl s ALA 758 Ca 0.33 0.02 0.27 0.00 0.00 0.00 0.00 51.96 52.58 2sbl s ALA 758 Cb -0.18 -3.00 1.08 0.00 0.00 0.00 0.00 23.12 21.02 2sbl s ALA 758 CO 0.18 -0.29 1.80 0.66 0.00 0.00 0.00 175.76 178.11 2sbl h SER 759 N 0.70 0.00 -0.44 0.00 4.64 -1.95 -2.26 113.55 114.25 2sbl h SER 759 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2sbl h SER 759 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2sbl h SER 759 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 2sbl n ASP 760 N -2.53 4.20 -4.76 4.97 5.68 -1.26 -4.95 116.55 117.91 2sbl n ASP 760 Ca 0.02 -2.57 -0.41 0.00 -0.50 0.00 0.00 54.79 51.33 2sbl n ASP 760 Cb 0.27 -0.59 -0.03 0.00 -1.14 0.00 0.00 41.12 39.63 2sbl n ASP 760 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2sbl s GLU 761 N -2.12 4.47 -0.20 0.11 2.56 -0.85 -5.00 118.70 117.65 2sbl s GLU 761 Ca 0.39 2.03 -0.06 0.00 0.00 0.00 0.00 54.97 57.32 2sbl s GLU 761 Cb 0.28 -3.15 -0.03 0.00 2.00 0.00 0.00 34.13 33.24 2sbl s GLU 761 CO 0.14 -0.06 0.03 0.08 -0.56 0.00 0.00 175.26 174.89 2sbl s VAL 762 N -0.83 4.29 0.50 3.70 1.01 -1.26 -5.05 120.40 122.75 2sbl s VAL 762 Ca 0.49 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.29 2sbl s VAL 762 Cb -0.36 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.09 2sbl s VAL 762 CO 0.45 0.42 0.71 -0.31 0.00 0.00 0.00 175.10 176.36 2sbl s TYR 763 N 0.94 2.98 0.19 5.22 1.51 -1.26 -1.68 117.35 125.25 2sbl s TYR 763 Ca 0.03 0.02 -0.32 0.00 -1.01 0.00 0.00 57.07 55.79 2sbl s TYR 763 Cb -0.14 -2.54 -0.11 0.00 -0.11 0.00 0.00 41.96 39.05 2sbl s TYR 763 CO 0.02 -0.63 1.68 -1.17 -1.11 0.00 0.00 175.55 174.35 2sbl s LEU 764 N -4.63 4.37 0.00 -1.29 2.96 0.13 -1.20 118.68 119.01 2sbl s LEU 764 Ca 0.54 2.79 0.00 0.00 -0.22 0.00 0.00 54.13 57.24 2sbl s LEU 764 Cb -0.10 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.99 2sbl s LEU 764 CO 0.37 -0.93 0.00 0.61 -1.32 0.00 0.00 176.35 175.08 2sbl n GLY 765 N 3.93 0.77 3.39 7.98 0.00 -1.26 -4.93 105.19 115.07 2sbl n GLY 765 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 2sbl n GLY 765 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2sbl s GLN 766 N -0.71 1.46 0.12 1.61 -0.21 -0.34 -4.63 119.66 116.96 2sbl s GLN 766 Ca 0.00 -1.70 0.04 0.00 0.02 0.00 0.00 55.36 53.72 2sbl s GLN 766 Cb 0.00 -1.15 -0.04 0.00 1.00 0.00 0.00 33.01 32.82 2sbl s GLN 766 CO 0.00 0.11 -0.11 1.03 -2.12 0.00 0.00 175.29 174.20 2sbl s ARG 767 N -3.69 0.94 0.10 2.91 1.81 -1.26 -4.77 118.95 114.99 2sbl s ARG 767 Ca 0.27 -1.26 -0.05 0.00 -1.72 0.00 0.00 55.73 52.96 2sbl s ARG 767 Cb 0.02 -0.61 -0.19 0.00 -0.45 0.00 0.00 34.95 33.72 2sbl s ARG 767 CO 0.10 0.09 1.22 0.22 -0.68 0.00 0.00 175.30 176.25 2sbl h ASP 768 N 3.30 0.50 -3.54 0.23 3.58 -2.00 -3.43 116.42 115.07 2sbl h ASP 768 Ca -0.37 -0.46 -0.68 0.00 0.42 0.00 0.00 57.03 55.94 2sbl h ASP 768 Cb 1.19 -0.16 -0.30 0.00 1.72 0.00 0.00 39.33 41.78 2sbl h ASP 768 CO 0.56 1.30 -0.84 0.21 -2.88 0.00 0.00 179.24 177.59 2sbl s ASN 769 N -7.14 3.40 0.31 2.28 3.84 -1.26 -5.00 114.94 111.37 2sbl s ASN 769 Ca -0.05 -0.46 0.25 0.00 0.21 0.00 0.00 52.86 52.81 2sbl s ASN 769 Cb 0.08 -1.30 1.07 0.00 -0.55 0.00 0.00 41.25 40.55 2sbl s ASN 769 CO 0.88 0.19 1.75 1.55 -2.79 0.00 0.00 177.10 178.68 2sbl h PRO 770 N 6.47 0.00 -0.88 0.43 0.13 -2.00 -3.08 132.00 133.07 2sbl h PRO 770 Ca -0.26 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.29 2sbl h PRO 770 Cb 1.21 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.03 2sbl h PRO 770 CO 0.50 0.00 0.35 0.72 -0.23 0.00 0.00 178.00 179.34 2sbl n HIS 771 N -2.36 2.90 0.27 1.56 8.25 -1.26 -4.67 115.22 119.90 2sbl n HIS 771 Ca 0.02 -2.57 0.11 0.00 -0.26 0.00 0.00 57.72 55.01 2sbl n HIS 771 Cb 0.22 -1.04 0.72 0.00 1.12 0.00 0.00 29.99 31.01 2sbl n HIS 771 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 2sbl h TRP 772 N 1.83 0.00 -4.19 4.41 5.08 -1.92 -3.42 115.95 117.74 2sbl h TRP 772 Ca 0.52 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 60.36 2sbl h TRP 772 Cb 1.30 0.00 -0.15 0.00 -3.00 0.00 0.00 29.16 27.30 2sbl h TRP 772 CO 1.28 0.07 -0.68 -0.08 -1.28 0.00 0.00 178.44 177.74 2sbl s THR 773 N -4.65 0.25 -1.45 0.12 -1.32 -1.26 -4.91 115.64 102.41 2sbl s THR 773 Ca -0.04 -1.74 0.26 0.00 -1.21 0.00 0.00 61.69 58.95 2sbl s THR 773 Cb 0.15 -1.43 0.16 0.00 -1.51 0.00 0.00 72.50 69.87 2sbl s THR 773 CO 0.62 -0.95 1.49 -1.54 -2.21 0.00 0.00 174.62 172.03 2sbl n SER 774 N 0.22 0.83 -4.58 8.08 3.41 -0.24 -4.83 113.62 116.51 2sbl n SER 774 Ca -0.15 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.40 2sbl n SER 774 Cb 0.60 0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 64.73 2sbl n SER 774 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2sbl s ASP 775 N -2.70 6.19 0.40 4.04 -1.08 -1.26 -4.86 116.67 117.40 2sbl s ASP 775 Ca 0.19 0.45 0.10 0.00 -0.52 0.00 0.00 52.55 52.77 2sbl s ASP 775 Cb 0.18 -2.54 0.85 0.00 -1.46 0.00 0.00 42.92 39.95 2sbl s ASP 775 CO 0.60 -1.62 1.95 0.28 0.52 0.00 0.00 175.17 176.90 2sbl h SER 776 N 10.96 0.21 -0.65 -0.34 0.02 -1.99 -1.37 113.55 120.40 2sbl h SER 776 Ca -0.27 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.59 2sbl h SER 776 Cb 1.10 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.55 2sbl h SER 776 CO 1.15 0.33 0.19 0.11 -1.14 0.00 0.00 176.83 177.47 2sbl h LYS 777 N 0.22 1.04 -0.20 3.45 1.79 -2.00 0.26 116.57 121.14 2sbl h LYS 777 Ca 0.05 -0.23 -0.11 0.00 -2.18 0.00 0.00 60.65 58.18 2sbl h LYS 777 Cb 0.30 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 30.80 2sbl h LYS 777 CO 0.02 0.91 -0.30 0.00 -1.08 0.00 0.00 179.45 179.00 2sbl h ALA 778 N 1.20 0.30 -0.98 3.86 0.00 -1.86 -2.64 119.26 119.15 2sbl h ALA 778 Ca 0.22 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2sbl h ALA 778 Cb 0.32 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 2sbl h ALA 778 CO -0.00 0.32 0.63 -0.07 0.00 0.00 0.00 179.25 180.13 2sbl h LEU 779 N 0.22 1.02 -0.27 0.00 3.38 -0.99 -0.24 115.31 118.43 2sbl h LEU 779 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2sbl h LEU 779 Cb 0.88 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2sbl h LEU 779 CO 0.07 0.67 0.14 1.56 0.09 0.00 0.00 178.44 180.96 2sbl h GLN 780 N 1.17 0.38 -0.36 1.13 4.20 -0.91 -1.00 115.11 119.73 2sbl h GLN 780 Ca 0.41 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 59.04 2sbl h GLN 780 Cb 0.12 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2sbl h GLN 780 CO -0.16 0.36 0.11 0.00 -0.67 0.00 0.00 178.83 178.47 2sbl h ALA 781 N 1.00 1.52 -0.29 3.87 0.00 -1.08 -1.04 119.26 123.25 2sbl h ALA 781 Ca 0.09 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2sbl h ALA 781 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2sbl h ALA 781 CO -0.01 0.37 -0.19 0.35 0.00 0.00 0.00 179.25 179.76 2sbl h PHE 782 N 0.52 0.74 -0.96 0.00 3.57 -0.48 -2.12 116.94 118.21 2sbl h PHE 782 Ca 0.12 -0.20 0.07 0.00 3.53 0.00 0.00 57.97 61.49 2sbl h PHE 782 Cb 0.16 -0.17 -0.07 0.00 2.79 0.00 0.00 35.95 38.67 2sbl h PHE 782 CO 0.01 0.90 0.61 1.96 -2.23 0.00 0.00 178.31 179.56 2sbl h GLN 783 N 0.38 1.08 -0.39 1.11 4.20 -0.34 -0.11 115.11 121.03 2sbl h GLN 783 Ca 0.06 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.72 2sbl h GLN 783 Cb 0.73 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 2sbl h GLN 783 CO 0.05 0.71 0.22 0.87 -0.67 0.00 0.00 178.83 180.02 2sbl h LYS 784 N 1.11 0.44 -0.15 1.46 1.57 -1.09 -1.20 116.57 118.70 2sbl h LYS 784 Ca 0.42 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.18 2sbl h LYS 784 Cb 0.18 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2sbl h LYS 784 CO -0.18 0.29 0.05 0.35 -0.57 0.00 0.00 179.45 179.40 2sbl h PHE 785 N 0.45 0.09 -0.55 -1.35 3.57 -0.39 0.16 116.94 118.94 2sbl h PHE 785 Ca 0.16 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.71 2sbl h PHE 785 Cb 0.02 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 2sbl h PHE 785 CO -0.08 0.05 0.28 0.78 -2.23 0.00 0.00 178.31 177.11 2sbl h GLY 786 N 0.13 0.77 1.48 2.40 0.00 -0.92 -1.34 103.07 105.59 2sbl h GLY 786 Ca 0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 2sbl h GLY 786 CO -0.06 0.12 0.12 3.43 0.00 0.00 0.00 176.54 180.15 2sbl h ASN 787 N 0.54 0.61 -0.16 0.19 -0.26 -0.35 -1.91 115.58 114.24 2sbl h ASN 787 Ca 0.24 -0.09 -0.09 0.00 -0.56 0.00 0.00 56.30 55.81 2sbl h ASN 787 Cb 0.15 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.23 2sbl h ASN 787 CO -0.16 0.60 -0.16 0.50 -1.06 0.00 0.00 177.43 177.14 2sbl h LYS 788 N 0.65 0.56 -0.53 0.81 1.63 0.06 -1.80 116.57 117.94 2sbl h LYS 788 Ca 0.15 -0.18 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 2sbl h LYS 788 Cb 0.23 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 2sbl h LYS 788 CO -0.01 0.71 0.02 -0.07 -3.45 0.00 0.00 179.45 176.65 2sbl h LEU 789 N 0.51 0.85 -0.36 5.20 4.07 -0.50 -0.63 115.31 124.45 2sbl h LEU 789 Ca 0.09 -0.21 -0.02 0.00 0.08 0.00 0.00 57.88 57.82 2sbl h LEU 789 Cb 0.58 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.08 2sbl h LEU 789 CO 0.04 0.90 0.14 0.11 -1.08 0.00 0.00 178.44 178.55 2sbl h LYS 790 N 0.83 0.54 -0.26 1.13 1.57 -0.91 -0.40 116.57 119.07 2sbl h LYS 790 Ca 0.16 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2sbl h LYS 790 Cb 0.46 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 2sbl h LYS 790 CO 0.02 0.53 0.05 0.93 -0.57 0.00 0.00 179.45 180.41 2sbl h GLU 791 N 0.44 0.15 -0.84 3.15 5.08 -1.14 -2.34 114.58 119.07 2sbl h GLU 791 Ca 0.12 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2sbl h GLU 791 Cb 0.19 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 2sbl h GLU 791 CO -0.01 0.10 0.50 0.82 -1.00 0.00 0.00 179.01 179.42 2sbl h ILE 792 N 0.15 1.23 -0.77 3.13 2.04 -0.68 -1.33 117.51 121.30 2sbl h ILE 792 Ca 0.12 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 2sbl h ILE 792 Cb 0.12 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.22 2sbl h ILE 792 CO -0.16 0.25 0.34 -0.08 0.00 0.00 0.00 178.15 178.50 2sbl h GLU 793 N 1.16 1.12 -0.59 2.37 4.81 -0.76 0.05 114.58 122.74 2sbl h GLU 793 Ca 0.30 -0.18 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2sbl h GLU 793 Cb -0.04 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.11 2sbl h GLU 793 CO -0.06 0.89 0.34 0.93 -0.73 0.00 0.00 179.01 180.38 2sbl h GLU 794 N 1.09 0.64 -0.41 1.92 5.08 -0.83 -0.17 114.58 121.90 2sbl h GLU 794 Ca 0.26 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2sbl h GLU 794 Cb 0.16 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2sbl h GLU 794 CO -0.03 0.42 0.27 -0.22 -1.00 0.00 0.00 179.01 178.46 2sbl h LYS 795 N 0.66 0.54 -0.50 2.33 3.64 -0.48 -2.03 116.57 120.73 2sbl h LYS 795 Ca 0.25 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2sbl h LYS 795 Cb 0.08 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2sbl h LYS 795 CO -0.13 0.36 0.01 -0.07 -2.27 0.00 0.00 179.45 177.35 2sbl h LEU 796 N 0.56 0.81 -0.41 5.20 4.07 -0.47 -1.28 115.31 123.78 2sbl h LEU 796 Ca 0.15 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.91 2sbl h LEU 796 Cb -0.06 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.44 2sbl h LEU 796 CO -0.03 0.87 0.27 0.58 -1.08 0.00 0.00 178.44 179.04 2sbl h VAL 797 N 0.78 1.11 -0.96 1.22 2.07 -0.79 0.13 116.25 119.82 2sbl h VAL 797 Ca 0.15 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2sbl h VAL 797 Cb 0.46 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2sbl h VAL 797 CO 0.02 0.11 0.63 0.03 0.02 0.00 0.00 177.57 178.39 2sbl h ARG 798 N 0.55 1.22 -0.64 1.57 3.08 -0.86 0.43 114.38 119.74 2sbl h ARG 798 Ca 0.15 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 2sbl h ARG 798 Cb -0.05 -0.28 -0.03 0.00 0.08 0.00 0.00 29.97 29.70 2sbl h ARG 798 CO -0.03 0.81 0.12 0.00 -1.07 0.00 0.00 179.97 179.80 2sbl h ARG 799 N 1.26 1.04 0.00 0.04 3.08 -0.30 -1.25 114.38 118.26 2sbl h ARG 799 Ca 0.37 -0.27 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2sbl h ARG 799 Cb -0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 2sbl h ARG 799 CO -0.10 0.96 -0.22 -0.91 -1.07 0.00 0.00 179.97 178.64 2sbl h ASN 800 N 0.96 0.00 -0.16 7.04 -0.26 0.17 -1.79 115.58 121.54 2sbl h ASN 800 Ca 0.20 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.94 2sbl h ASN 800 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 2sbl h ASN 800 CO 0.01 0.22 0.00 0.59 -1.06 0.00 0.00 177.43 177.18 2sbl n ASN 801 N -3.79 2.01 -4.64 5.81 5.03 0.03 -4.88 115.26 114.82 2sbl n ASN 801 Ca -0.02 -1.73 -0.43 0.00 0.87 0.00 0.00 54.58 53.28 2sbl n ASN 801 Cb 0.32 -0.10 -0.03 0.00 -1.02 0.00 0.00 39.78 38.95 2sbl n ASN 801 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2sbl s ASP 802 N -1.68 6.89 0.43 6.41 -1.08 -0.57 -4.94 116.67 122.13 2sbl s ASP 802 Ca 0.34 1.01 0.19 0.00 -0.52 0.00 0.00 52.55 53.57 2sbl s ASP 802 Cb 0.19 -2.50 1.12 0.00 -1.46 0.00 0.00 42.92 40.27 2sbl s ASP 802 CO 0.29 -0.76 1.86 1.55 0.52 0.00 0.00 175.17 178.63 2sbl h PRO 803 N 7.96 0.36 0.00 4.34 0.13 -1.90 -0.69 132.00 142.21 2sbl h PRO 803 Ca -0.21 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 64.77 2sbl h PRO 803 Cb 1.07 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 2sbl h PRO 803 CO 0.98 0.24 -0.60 0.66 -0.23 0.00 0.00 178.00 179.05 2sbl h SER 804 N 0.37 0.00 0.80 1.44 4.64 -1.95 -3.22 113.55 115.63 2sbl h SER 804 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2sbl h SER 804 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2sbl h SER 804 CO -0.17 0.60 -0.14 0.18 -0.87 0.00 0.00 176.83 176.43 2sbl n LEU 805 N -3.41 0.16 -0.31 5.97 4.77 -0.29 -4.20 117.00 119.70 2sbl n LEU 805 Ca 0.01 0.32 0.16 0.00 -0.03 0.00 0.00 56.01 56.47 2sbl n LEU 805 Cb 0.71 -0.40 0.41 0.00 -2.33 0.00 0.00 43.42 41.80 2sbl n LEU 805 CO 0.41 0.04 1.21 1.56 -1.33 0.00 0.00 177.39 179.28 2sbl h GLN 806 N 0.04 0.59 -0.41 3.23 1.08 -1.51 -1.25 115.11 116.87 2sbl h GLN 806 Ca 0.00 -0.04 0.08 0.00 -1.45 0.00 0.00 58.65 57.25 2sbl h GLN 806 Cb 0.48 -0.13 -0.08 0.00 -0.05 0.00 0.00 27.48 27.70 2sbl h GLN 806 CO 0.00 0.39 -0.11 0.78 -0.95 0.00 0.00 178.83 178.94 2sbl h GLY 807 N 0.60 0.29 0.26 3.46 0.00 -1.83 0.12 103.07 105.97 2sbl h GLY 807 Ca 0.53 0.14 -0.16 0.00 0.00 0.00 0.00 47.33 47.85 2sbl h GLY 807 CO -0.28 -0.16 -1.95 0.70 0.00 0.00 0.00 176.54 174.85 2sbl n ASN 808 N -5.32 0.23 0.01 0.19 3.02 -1.02 -2.74 115.26 109.63 2sbl n ASN 808 Ca 0.02 0.10 0.12 0.00 -0.03 0.00 0.00 54.58 54.79 2sbl n ASN 808 Cb 0.23 1.19 0.21 0.00 -0.61 0.00 0.00 39.78 40.80 2sbl n ASN 808 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2sbl n ARG 809 N -2.58 0.09 0.00 3.52 1.74 -0.50 -4.57 116.66 114.36 2sbl n ARG 809 Ca -0.15 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2sbl n ARG 809 Cb 0.82 -1.55 0.00 0.00 -1.02 0.00 0.00 32.46 30.71 2sbl n ARG 809 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2sbl n LEU 810 N -1.67 0.35 0.00 0.55 4.32 0.31 -0.89 117.00 119.98 2sbl n LEU 810 Ca 0.05 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.13 2sbl n LEU 810 Cb 0.37 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.14 2sbl n LEU 810 CO 0.36 -0.14 -0.12 0.61 -1.22 0.00 0.00 177.39 176.88 2sbl n GLY 811 N 2.30 -1.67 0.41 -0.72 0.00 -0.58 -2.09 105.19 102.84 2sbl n GLY 811 Ca 0.00 -1.18 0.23 0.00 0.00 0.00 0.00 46.02 45.06 2sbl n GLY 811 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2sbl h PRO 812 N 0.00 0.00 0.00 1.61 0.13 -1.91 0.27 132.00 132.09 2sbl h PRO 812 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2sbl h PRO 812 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 2sbl h PRO 812 CO 0.00 0.00 0.00 -0.39 -0.23 0.00 0.00 178.00 177.38 2sbl h VAL 813 N 0.00 0.00 -4.16 1.56 -1.51 -1.86 -3.45 116.25 106.82 2sbl h VAL 813 Ca 0.29 -0.58 -0.28 0.00 -1.23 0.00 0.00 66.70 64.90 2sbl h VAL 813 Cb 1.22 1.55 0.09 0.00 -2.13 0.00 0.00 31.29 32.02 2sbl h VAL 813 CO -0.00 0.00 -0.47 0.00 -1.23 0.00 0.00 177.57 175.87 2sbl n GLN 814 N -2.53 -5.15 -3.66 5.19 1.13 0.08 -4.40 117.38 108.05 2sbl n GLN 814 Ca 0.04 0.60 -0.39 0.00 -1.94 0.00 0.00 57.00 55.31 2sbl n GLN 814 Cb 0.42 -4.91 -0.10 0.00 0.11 0.00 0.00 30.24 25.76 2sbl n GLN 814 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2sbl s LEU 815 N -5.32 5.19 0.16 1.08 2.96 -0.89 -4.98 118.68 116.88 2sbl s LEU 815 Ca 0.37 -1.70 -0.32 0.00 -0.22 0.00 0.00 54.13 52.27 2sbl s LEU 815 Cb -0.16 -1.93 -0.12 0.00 0.50 0.00 0.00 46.19 44.48 2sbl s LEU 815 CO 0.46 -0.55 1.77 -0.81 -1.32 0.00 0.00 176.35 175.90 2sbl n PRO 816 N 4.81 2.75 -1.76 0.98 -0.04 -1.25 -4.15 135.00 136.34 2sbl n PRO 816 Ca -0.08 1.00 -0.27 0.00 -0.04 0.00 0.00 63.50 64.11 2sbl n PRO 816 Cb 0.42 -2.86 -0.05 0.00 -0.04 0.00 0.00 33.50 30.97 2sbl n PRO 816 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2sbl s TYR 817 N 1.94 1.36 -1.42 0.54 5.04 -0.07 -4.71 117.35 120.03 2sbl s TYR 817 Ca 0.79 1.37 0.15 0.00 -2.44 0.00 0.00 57.07 56.93 2sbl s TYR 817 Cb -0.51 -3.73 0.36 0.00 0.35 0.00 0.00 41.96 38.44 2sbl s TYR 817 CO 0.35 -2.00 1.28 0.25 -1.34 0.00 0.00 175.55 174.09 2sbl n THR 818 N 8.09 0.79 0.26 4.34 -2.24 -1.26 -4.72 114.28 119.54 2sbl n THR 818 Ca 0.38 -0.90 0.08 0.00 -2.27 0.00 0.00 64.05 61.35 2sbl n THR 818 Cb 0.49 0.67 0.65 0.00 -2.10 0.00 0.00 70.33 70.04 2sbl n THR 818 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2sbl h LEU 819 N 2.86 0.00 -3.57 3.22 5.85 -1.81 -1.68 115.31 120.17 2sbl h LEU 819 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2sbl h LEU 819 Cb 0.78 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.74 2sbl h LEU 819 CO 0.00 0.02 0.13 0.18 -0.34 0.00 0.00 178.44 178.42 2sbl n LEU 820 N -4.46 5.43 -4.69 2.25 4.77 -1.26 -4.20 117.00 114.83 2sbl n LEU 820 Ca -0.03 -3.16 -0.42 0.00 -0.03 0.00 0.00 56.01 52.37 2sbl n LEU 820 Cb 0.10 -0.68 -0.03 0.00 -2.33 0.00 0.00 43.42 40.48 2sbl n LEU 820 CO 0.34 0.77 1.02 -0.31 -1.33 0.00 0.00 177.39 177.87 2sbl s TYR 821 N -2.93 3.10 0.25 -1.77 1.51 -0.63 -4.91 117.35 111.97 2sbl s TYR 821 Ca 0.52 1.05 -0.05 0.00 -1.01 0.00 0.00 57.07 57.58 2sbl s TYR 821 Cb 0.41 -3.54 0.33 0.00 -0.11 0.00 0.00 41.96 39.06 2sbl s TYR 821 CO 0.12 -1.84 1.90 -1.00 -1.11 0.00 0.00 175.55 173.62 2sbl h PRO 822 N 7.45 1.18 -6.45 -1.71 0.13 -1.90 0.76 132.00 131.46 2sbl h PRO 822 Ca -0.37 -0.07 -0.47 0.00 -0.87 0.00 0.00 66.00 64.22 2sbl h PRO 822 Cb 1.18 -0.27 0.01 0.00 0.13 0.00 0.00 31.00 32.05 2sbl h PRO 822 CO 0.88 0.78 -0.25 -1.54 -0.23 0.00 0.00 178.00 177.64 2sbl s SER 823 N -5.96 6.23 0.13 1.44 1.04 -1.26 -1.41 113.70 113.91 2sbl s SER 823 Ca -0.13 0.30 -0.25 0.00 0.48 0.00 0.00 55.95 56.36 2sbl s SER 823 Cb 0.19 -1.89 0.07 0.00 0.10 0.00 0.00 66.02 64.49 2sbl s SER 823 CO 0.81 -0.29 0.81 -0.55 0.98 0.00 0.00 173.24 175.00 2sbl s SER 824 N -4.05 -0.33 0.18 7.02 0.15 -1.26 -3.07 113.70 112.34 2sbl s SER 824 Ca 0.40 -0.24 0.02 0.00 0.70 0.00 0.00 55.95 56.83 2sbl s SER 824 Cb -0.09 0.53 0.02 0.00 -1.71 0.00 0.00 66.02 64.77 2sbl s SER 824 CO 0.34 -0.92 0.17 1.21 1.20 0.00 0.00 173.24 175.24 2sbl n GLU 825 N -0.38 1.14 -2.15 5.44 2.13 -1.26 -5.02 120.64 120.54 2sbl n GLU 825 Ca -0.09 -1.11 -0.32 0.00 0.66 0.00 0.00 57.16 56.30 2sbl n GLU 825 Cb 0.62 0.08 -0.01 0.00 0.27 0.00 0.00 31.44 32.39 2sbl n GLU 825 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 2sbl s GLU 826 N -2.78 3.72 0.00 5.31 -1.05 -1.26 -4.82 118.70 117.82 2sbl s GLU 826 Ca 0.13 0.91 0.00 0.00 -0.15 0.00 0.00 54.97 55.86 2sbl s GLU 826 Cb -0.01 -2.10 0.00 0.00 -0.44 0.00 0.00 34.13 31.58 2sbl s GLU 826 CO 0.08 -0.46 0.00 0.41 0.95 0.00 0.00 175.26 176.24 2sbl n GLY 827 N -1.93 -2.24 2.97 -3.83 0.00 -0.15 -4.76 105.19 95.24 2sbl n GLY 827 Ca 0.07 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.59 2sbl n GLY 827 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2sbl n LEU 828 N 0.00 5.58 0.04 0.99 7.94 -1.26 -2.12 117.00 128.18 2sbl n LEU 828 Ca 0.00 -3.66 0.11 0.00 -1.11 0.00 0.00 56.01 51.35 2sbl n LEU 828 Cb 0.00 -1.49 -0.01 0.00 0.53 0.00 0.00 43.42 42.45 2sbl n LEU 828 CO 0.00 0.39 -0.09 0.35 -1.11 0.00 0.00 177.39 176.92 2sbl n THR 829 N 5.66 0.27 -2.42 1.96 -2.24 -1.26 -4.97 114.28 111.28 2sbl n THR 829 Ca 0.51 -0.36 -0.21 0.00 -2.27 0.00 0.00 64.05 61.71 2sbl n THR 829 Cb 0.41 0.02 -0.01 0.00 -2.10 0.00 0.00 70.33 68.65 2sbl n THR 829 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2sbl n PHE 830 N -2.20 -1.03 -3.82 4.78 7.35 -1.26 -4.97 117.46 116.31 2sbl n PHE 830 Ca 0.01 0.02 -0.08 0.00 -0.76 0.00 0.00 57.45 56.63 2sbl n PHE 830 Cb 0.49 -4.01 -0.02 0.00 0.35 0.00 0.00 39.48 36.28 2sbl n PHE 830 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 2sbl s ARG 831 N -5.07 1.69 0.00 -4.13 1.70 -1.26 -2.91 118.95 108.97 2sbl s ARG 831 Ca 0.01 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.32 2sbl s ARG 831 Cb -0.00 0.59 0.00 0.00 -0.57 0.00 0.00 34.95 34.97 2sbl s ARG 831 CO 0.01 -0.76 0.00 0.41 -1.08 0.00 0.00 175.30 173.88 2sbl n GLY 832 N -0.44 -0.70 3.39 3.88 0.00 0.26 -4.71 105.19 106.87 2sbl n GLY 832 Ca -0.06 -0.95 -0.44 0.00 0.00 0.00 0.00 46.02 44.57 2sbl n GLY 832 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2sbl s ILE 833 N 0.00 5.04 0.89 -0.61 1.01 -0.50 -4.93 121.20 122.10 2sbl s ILE 833 Ca 0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.63 2sbl s ILE 833 Cb 0.00 -4.27 0.13 0.00 0.01 0.00 0.00 42.46 38.33 2sbl s ILE 833 CO 0.00 -0.78 1.13 -2.84 0.00 0.00 0.00 174.94 172.45 2sbl s PRO 834 N 2.14 1.23 0.34 2.79 0.02 -1.26 -0.70 135.00 139.56 2sbl s PRO 834 Ca 0.09 1.44 0.09 0.00 0.02 0.00 0.00 61.00 62.63 2sbl s PRO 834 Cb -0.23 -1.76 0.60 0.00 0.02 0.00 0.00 34.50 33.13 2sbl s PRO 834 CO 0.08 -2.45 1.79 -0.91 -0.33 0.00 0.00 177.00 175.18 2sbl h ASN 835 N -1.73 0.20 -3.52 2.53 2.35 -1.54 -3.39 115.58 110.47 2sbl h ASN 835 Ca -0.44 -0.07 -0.56 0.00 -0.55 0.00 0.00 56.30 54.69 2sbl h ASN 835 Cb 1.26 -0.05 -0.13 0.00 0.05 0.00 0.00 38.32 39.45 2sbl h ASN 835 CO 0.44 0.51 -0.50 -0.94 -1.65 0.00 0.00 177.43 175.29 2sbl s SER 836 N -6.89 2.71 -1.02 5.81 1.04 -1.25 -3.66 113.70 110.43 2sbl s SER 836 Ca -0.04 -1.72 -0.19 0.00 0.48 0.00 0.00 55.95 54.47 2sbl s SER 836 Cb 0.14 0.57 0.11 0.00 0.10 0.00 0.00 66.02 66.95 2sbl s SER 836 CO 0.75 -0.99 1.30 -0.63 0.98 0.00 0.00 173.24 174.66 2sbl s ILE 837 N -3.22 4.51 -0.51 -1.02 1.01 -1.14 -4.68 121.20 116.15 2sbl s ILE 837 Ca 0.25 -1.54 0.22 0.00 0.00 0.00 0.00 60.65 59.58 2sbl s ILE 837 Cb 0.02 -4.90 -0.21 0.00 0.01 0.00 0.00 42.46 37.38 2sbl s ILE 837 CO 0.17 -1.68 0.82 -1.54 0.00 0.00 0.00 174.94 172.71 2sbl n SER 838 N 7.17 0.53 0.00 3.58 3.41 -1.25 -2.72 113.62 124.34 2sbl n SER 838 Ca 0.30 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 2sbl n SER 838 Cb 0.48 1.21 0.00 0.00 -0.26 0.00 0.00 64.21 65.64 2sbl n SER 838 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88