#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbl n ASP 10 N 0.00 5.47 -0.09 0.00 8.00 -1.26 -2.87 116.55 125.80 2wbl n ASP 10 Ca 0.00 -2.98 -0.15 0.00 0.71 0.00 0.00 54.79 52.38 2wbl n ASP 10 Cb 0.00 -0.68 -0.05 0.00 -0.02 0.00 0.00 41.12 40.37 2wbl n ASP 10 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2wbl n MET 11 N 0.42 0.47 -0.25 -1.24 0.00 -1.26 -4.22 117.12 111.04 2wbl n MET 11 Ca 0.28 0.20 0.03 0.00 -0.00 0.00 0.00 57.70 58.21 2wbl n MET 11 Cb 1.18 -1.31 0.16 0.00 0.00 0.00 0.00 33.22 33.25 2wbl n MET 11 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2wbl h GLU 12 N -0.85 0.50 -0.08 2.12 3.07 -2.00 -0.43 114.58 116.91 2wbl h GLU 12 Ca -0.24 -0.03 -0.14 0.00 -0.50 0.00 0.00 59.36 58.45 2wbl h GLU 12 Cb 1.12 -0.11 0.01 0.00 -0.84 0.00 0.00 28.75 28.92 2wbl h GLU 12 CO -0.14 0.33 -0.50 0.00 -1.40 0.00 0.00 179.01 177.29 2wbl h MET 13 N 0.52 0.48 0.69 2.33 3.00 -1.81 -3.04 114.93 117.09 2wbl h MET 13 Ca 0.37 -0.41 -0.03 0.00 0.00 0.00 0.00 59.70 59.63 2wbl h MET 13 Cb 0.48 0.09 0.01 0.00 0.00 0.00 0.00 31.60 32.18 2wbl h MET 13 CO -0.33 1.05 -0.33 1.98 0.00 0.00 0.00 176.91 179.28 2wbl h MET 14 N 0.04 -0.89 -0.22 -0.10 -1.53 -1.65 -2.31 114.93 108.28 2wbl h MET 14 Ca -0.04 0.06 0.04 0.00 -3.44 0.00 0.00 59.70 56.32 2wbl h MET 14 Cb 1.16 0.20 -0.07 0.00 -0.55 0.00 0.00 31.60 32.34 2wbl h MET 14 CO 0.10 -0.59 -0.52 0.87 0.14 0.00 0.00 176.91 176.91 2wbl h LYS 15 N -1.19 -0.49 -0.57 0.39 6.56 -1.26 0.56 116.57 120.56 2wbl h LYS 15 Ca -0.09 0.03 0.08 0.00 -1.06 0.00 0.00 60.65 59.61 2wbl h LYS 15 Cb 0.71 0.11 -0.09 0.00 -0.57 0.00 0.00 32.23 32.39 2wbl h LYS 15 CO 0.15 -0.33 -0.24 -3.47 -2.06 0.00 0.00 179.45 173.51 2wbl n ASP 16 N -5.42 -0.40 -0.10 0.86 4.64 -1.15 -1.08 116.55 113.90 2wbl n ASP 16 Ca -0.05 1.01 -0.11 0.00 -1.38 0.00 0.00 54.79 54.26 2wbl n ASP 16 Cb 0.37 -0.22 -0.03 0.00 -1.04 0.00 0.00 41.12 40.20 2wbl n ASP 16 CO 0.00 0.00 0.00 0.03 -0.82 0.00 0.00 177.20 176.41 2wbl h ARG 17 N 0.00 0.51 0.00 -0.67 3.08 -0.32 -2.77 114.38 114.21 2wbl h ARG 17 Ca 0.19 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2wbl h ARG 17 Cb 0.33 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 2wbl h ARG 17 CO -0.57 0.62 -0.20 0.74 -1.07 0.00 0.00 179.97 179.49 2wbl h PHE 18 N 0.32 0.00 0.27 3.04 0.04 -0.36 -3.15 116.94 117.10 2wbl h PHE 18 Ca 0.09 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 2wbl h PHE 18 Cb 0.37 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.52 2wbl h PHE 18 CO 0.03 0.20 -0.13 0.00 -0.60 0.00 0.00 178.31 177.81 2wbl h ALA 19 N 1.80 -0.83 0.00 2.45 0.00 -0.82 -2.19 119.26 119.67 2wbl h ALA 19 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2wbl h ALA 19 Cb 0.51 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2wbl h ALA 19 CO 0.03 -0.80 0.36 1.57 0.00 0.00 0.00 179.25 180.40 2wbl h LYS 20 N -0.46 0.00 0.11 0.00 5.09 -1.56 0.83 116.57 120.59 2wbl h LYS 20 Ca -0.04 0.00 -0.16 0.00 0.09 0.00 0.00 60.65 60.54 2wbl h LYS 20 Cb 0.28 0.00 0.02 0.00 0.10 0.00 0.00 32.23 32.62 2wbl h LYS 20 CO 0.06 0.00 -0.70 -0.07 -2.09 0.00 0.00 179.45 176.65 2wbl h LEU 21 N 0.00 0.43 -2.22 7.07 3.38 -1.48 -2.99 115.31 119.49 2wbl h LEU 21 Ca 0.00 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.04 2wbl h LEU 21 Cb 0.71 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2wbl h LEU 21 CO 0.00 1.33 0.05 -0.07 0.09 0.00 0.00 178.44 179.83 2wbl h LEU 22 N -0.40 0.00 -0.96 1.67 3.38 0.13 -1.49 115.31 117.64 2wbl h LEU 22 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2wbl h LEU 22 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 2wbl h LEU 22 CO 0.13 0.00 -0.27 -0.11 0.09 0.00 0.00 178.44 178.28 2wbl n LEU 23 N -2.71 1.76 -2.34 1.67 7.94 -0.93 -4.93 117.00 117.47 2wbl n LEU 23 Ca -0.02 -0.59 -0.20 0.00 -1.11 0.00 0.00 56.01 54.09 2wbl n LEU 23 Cb 0.10 -0.04 -0.02 0.00 0.53 0.00 0.00 43.42 43.99 2wbl n LEU 23 CO 0.15 0.32 -0.25 0.61 -1.11 0.00 0.00 177.39 177.11 2wbl n GLY 24 N 1.35 -0.30 3.70 -3.96 0.00 -0.56 -0.60 105.19 104.82 2wbl n GLY 24 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2wbl n GLY 24 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wbl n GLU 25 N -2.93 0.00 -2.68 1.61 1.02 -1.13 -0.83 120.64 115.70 2wbl n GLU 25 Ca -0.23 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.49 2wbl n GLU 25 Cb 0.68 -2.38 -0.03 0.00 -0.02 0.00 0.00 31.44 29.69 2wbl n GLU 25 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2wbl s ASP 26 N -3.30 6.58 0.08 1.62 2.15 0.23 -4.83 116.67 119.21 2wbl s ASP 26 Ca 0.00 -1.75 0.17 0.00 0.43 0.00 0.00 52.55 51.40 2wbl s ASP 26 Cb 0.00 -2.51 0.72 0.00 -0.30 0.00 0.00 42.92 40.83 2wbl s ASP 26 CO 0.00 -1.33 1.53 0.23 -0.17 0.00 0.00 175.17 175.43 2wbl n MET 27 N 8.06 0.06 0.00 4.34 2.81 -1.26 -0.50 117.12 130.62 2wbl n MET 27 Ca 0.32 0.31 0.11 0.00 -1.81 0.00 0.00 57.70 56.63 2wbl n MET 27 Cb 0.50 -1.62 0.50 0.00 -0.71 0.00 0.00 33.22 31.89 2wbl n MET 27 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2wbl n SER 28 N -1.73 0.00 0.00 7.83 7.64 -1.26 -4.90 113.62 121.20 2wbl n SER 28 Ca 0.03 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2wbl n SER 28 Cb 0.18 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2wbl n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wbl n GLY 29 N 0.85 0.71 0.00 0.23 0.00 0.34 -4.85 105.19 102.48 2wbl n GLY 29 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 2wbl n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbl n GLY 30 N -2.00 -0.81 3.47 -0.02 0.00 -1.26 -4.86 105.19 99.70 2wbl n GLY 30 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2wbl n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbl n GLY 31 N 0.41 0.60 1.44 -0.02 0.00 -1.26 -4.84 105.19 101.51 2wbl n GLY 31 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2wbl n GLY 31 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wbl n LYS 32 N -2.00 0.83 0.00 1.61 2.85 -1.26 -4.74 118.16 115.44 2wbl n LYS 32 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2wbl n LYS 32 Cb 0.00 -1.09 0.00 0.00 -0.65 0.00 0.00 35.03 33.29 2wbl n LYS 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2wbl n GLY 33 N 1.33 0.80 3.17 2.58 0.00 -1.26 -4.90 105.19 106.92 2wbl n GLY 33 Ca 0.00 -0.23 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 2wbl n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wbl s VAL 34 N 2.13 0.89 0.90 1.61 0.11 -0.01 -4.96 120.40 121.07 2wbl s VAL 34 Ca 0.00 -1.66 -0.12 0.00 -2.93 0.00 0.00 61.98 57.27 2wbl s VAL 34 Cb 0.00 -1.37 0.06 0.00 -1.53 0.00 0.00 36.38 33.54 2wbl s VAL 34 CO 0.00 -0.59 0.70 -1.54 -3.33 0.00 0.00 175.10 170.33 2wbl n SER 35 N 0.51 -1.02 -0.31 3.54 3.41 -1.26 -4.43 113.62 114.07 2wbl n SER 35 Ca -0.16 0.41 -0.05 0.00 -0.26 0.00 0.00 58.87 58.82 2wbl n SER 35 Cb 0.58 -1.31 0.07 0.00 -0.26 0.00 0.00 64.21 63.29 2wbl n SER 35 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wbl h SER 36 N -1.44 1.07 -0.24 4.04 0.02 -1.90 -1.72 113.55 113.39 2wbl h SER 36 Ca -0.44 -0.12 0.06 0.00 -0.84 0.00 0.00 61.79 60.45 2wbl h SER 36 Cb 1.29 -0.27 -0.07 0.00 0.14 0.00 0.00 62.40 63.48 2wbl h SER 36 CO 0.38 0.89 -0.33 0.00 -1.14 0.00 0.00 176.83 176.63 2wbl h ALA 37 N 1.23 -0.31 -0.52 3.77 0.00 -1.83 -1.99 119.26 119.61 2wbl h ALA 37 Ca 0.29 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 2wbl h ALA 37 Cb 0.08 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2wbl h ALA 37 CO -0.04 -0.78 -0.12 1.25 0.00 0.00 0.00 179.25 179.57 2wbl h LEU 38 N -0.34 1.00 0.02 0.00 6.46 -1.70 -0.69 115.31 120.06 2wbl h LEU 38 Ca 0.12 -0.36 0.02 0.00 -0.12 0.00 0.00 57.88 57.55 2wbl h LEU 38 Cb 0.54 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 2wbl h LEU 38 CO -0.43 1.13 -0.19 0.00 -0.62 0.00 0.00 178.44 178.33 2wbl h ALA 39 N 0.91 -0.25 -0.73 1.25 0.00 -1.18 0.73 119.26 119.99 2wbl h ALA 39 Ca 0.13 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2wbl h ALA 39 Cb 0.68 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 2wbl h ALA 39 CO 0.05 -0.69 0.42 -0.07 0.00 0.00 0.00 179.25 178.96 2wbl h LEU 40 N -0.32 0.63 -0.81 0.00 3.38 -1.25 0.15 115.31 117.10 2wbl h LEU 40 Ca 0.05 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2wbl h LEU 40 Cb 0.38 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2wbl h LEU 40 CO -0.16 0.41 0.43 -1.28 0.09 0.00 0.00 178.44 177.93 2wbl h SER 41 N 0.77 1.02 -0.23 -0.43 0.87 -0.60 -0.38 113.55 114.57 2wbl h SER 41 Ca 0.32 -0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.71 2wbl h SER 41 Cb 0.19 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 2wbl h SER 41 CO -0.18 0.83 -0.12 0.78 -0.53 0.00 0.00 176.83 177.61 2wbl h ASN 42 N 1.13 0.50 -0.77 6.23 2.35 -0.31 -2.80 115.58 121.92 2wbl h ASN 42 Ca 0.28 -0.42 0.08 0.00 -0.55 0.00 0.00 56.30 55.70 2wbl h ASN 42 Cb 0.05 -0.14 -0.07 0.00 0.05 0.00 0.00 38.32 38.21 2wbl h ASN 42 CO -0.04 0.81 0.43 0.00 -1.65 0.00 0.00 177.43 176.98 2wbl h ALA 43 N 0.71 1.07 -0.08 -0.83 0.00 -0.11 0.14 119.26 120.16 2wbl h ALA 43 Ca 0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wbl h ALA 43 Cb 0.63 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2wbl h ALA 43 CO 0.04 0.07 0.04 0.82 0.00 0.00 0.00 179.25 180.22 2wbl h ILE 44 N 0.74 1.08 -0.01 0.00 2.04 -1.10 -2.15 117.51 118.12 2wbl h ILE 44 Ca 0.36 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.99 2wbl h ILE 44 Cb 0.31 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2wbl h ILE 44 CO -0.23 0.07 0.00 0.00 0.00 0.00 0.00 178.15 177.99 2wbl h THR 45 N 0.04 1.19 -0.96 -0.27 1.03 -1.05 -2.61 112.91 110.29 2wbl h THR 45 Ca 0.03 -0.56 0.15 0.00 -0.01 0.00 0.00 66.41 66.01 2wbl h THR 45 Cb 0.08 1.56 -0.09 0.00 -1.07 0.00 0.00 68.15 68.62 2wbl h THR 45 CO -0.00 0.15 0.57 0.78 -0.01 0.00 0.00 175.52 177.00 2wbl h ASN 46 N -0.22 0.78 -0.09 0.00 2.35 -0.74 -1.12 115.58 116.53 2wbl h ASN 46 Ca 0.00 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2wbl h ASN 46 Cb 0.24 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 2wbl h ASN 46 CO 0.00 0.36 -0.04 0.25 -1.65 0.00 0.00 177.43 176.35 2wbl h LEU 47 N 0.83 0.19 0.19 1.61 5.85 -1.34 -2.09 115.31 120.55 2wbl h LEU 47 Ca 0.51 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2wbl h LEU 47 Cb 0.64 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2wbl h LEU 47 CO -0.32 0.55 -0.20 0.00 -0.34 0.00 0.00 178.44 178.12 2wbl h ALA 48 N 0.65 -0.40 -0.70 1.25 0.00 -1.04 0.72 119.26 119.74 2wbl h ALA 48 Ca 0.02 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2wbl h ALA 48 Cb 0.47 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.44 2wbl h ALA 48 CO 0.01 -0.75 -0.42 0.00 0.00 0.00 0.00 179.25 178.09 2wbl h ALA 49 N 0.32 -0.19 -0.77 0.00 0.00 -1.25 0.66 119.26 118.04 2wbl h ALA 49 Ca 0.00 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.16 2wbl h ALA 49 Cb 0.41 0.96 -0.07 0.00 0.00 0.00 0.00 17.79 19.09 2wbl h ALA 49 CO -0.06 -0.77 0.43 1.03 0.00 0.00 0.00 179.25 179.88 2wbl h SER 50 N -0.15 0.61 0.09 0.00 0.87 -0.87 0.38 113.55 114.48 2wbl h SER 50 Ca 0.22 0.05 -0.25 0.00 -1.23 0.00 0.00 61.79 60.58 2wbl h SER 50 Cb 0.56 -0.07 0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2wbl h SER 50 CO -0.77 0.36 -1.02 0.40 -0.53 0.00 0.00 176.83 175.27 2wbl h ILE 51 N 0.73 1.35 -0.04 2.23 1.08 0.15 -3.34 117.51 119.67 2wbl h ILE 51 Ca 0.37 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.47 2wbl h ILE 51 Cb 0.33 2.75 0.00 0.00 -3.07 0.00 0.00 36.82 36.82 2wbl h ILE 51 CO -0.24 0.71 0.00 0.49 -0.69 0.00 0.00 178.15 178.42 2wbl n PHE 52 N -3.95 0.03 -0.14 1.37 3.72 0.13 -3.42 117.46 115.19 2wbl n PHE 52 Ca -0.13 -0.01 -0.11 0.00 -0.05 0.00 0.00 57.45 57.15 2wbl n PHE 52 Cb 0.88 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.41 2wbl n PHE 52 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2wbl h GLY 53 N 4.79 0.80 1.93 1.37 0.00 -1.04 -3.25 103.07 107.68 2wbl h GLY 53 Ca 0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 47.33 46.49 2wbl h GLY 53 CO 0.00 0.57 -1.05 1.05 0.00 0.00 0.00 176.54 177.11 2wbl h GLU 54 N 0.56 0.03 -5.00 4.80 4.11 -1.74 -3.39 114.58 113.95 2wbl h GLU 54 Ca 0.11 -0.05 -0.47 0.00 0.07 0.00 0.00 59.36 59.02 2wbl h GLU 54 Cb 0.55 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.83 2wbl h GLU 54 CO 0.03 1.01 1.57 0.94 0.07 0.00 0.00 179.01 182.63 2wbl n GLN 55 N -3.36 1.39 0.00 1.06 0.00 -1.22 -4.53 117.38 110.72 2wbl n GLN 55 Ca -0.01 -2.08 0.07 0.00 -0.00 0.00 0.00 57.00 54.98 2wbl n GLN 55 Cb 0.95 -3.31 0.02 0.00 0.00 0.00 0.00 30.24 27.90 2wbl n GLN 55 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2wbl n THR 56 N 7.04 0.00 -4.43 1.69 5.66 -1.26 -4.93 114.28 118.05 2wbl n THR 56 Ca 0.47 -0.41 -0.26 0.00 -3.05 0.00 0.00 64.05 60.79 2wbl n THR 56 Cb 0.44 1.20 -0.11 0.00 -1.55 0.00 0.00 70.33 70.31 2wbl n THR 56 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2wbl s LYS 57 N -1.46 1.54 -1.24 1.09 1.02 -1.26 -4.78 119.74 114.64 2wbl s LYS 57 Ca 0.13 -1.57 -0.17 0.00 0.02 0.00 0.00 55.97 54.38 2wbl s LYS 57 Cb 0.11 -1.82 0.11 0.00 -0.52 0.00 0.00 37.83 35.71 2wbl s LYS 57 CO 0.27 0.38 1.59 -1.17 -0.92 0.00 0.00 175.35 175.51 2wbl s LEU 58 N -2.83 4.34 0.23 3.17 2.96 -1.26 -4.88 118.68 120.41 2wbl s LEU 58 Ca 0.22 -2.62 -0.22 0.00 -0.22 0.00 0.00 54.13 51.30 2wbl s LEU 58 Cb -0.07 -2.50 0.04 0.00 0.50 0.00 0.00 46.19 44.15 2wbl s LEU 58 CO 0.11 -1.01 0.67 0.00 -1.32 0.00 0.00 176.35 174.80 2wbl s GLN 59 N 3.16 1.59 0.45 1.98 -2.07 -1.26 -4.92 119.66 118.59 2wbl s GLN 59 Ca 0.49 -0.78 -0.25 0.00 -1.82 0.00 0.00 55.36 52.99 2wbl s GLN 59 Cb 0.01 0.60 -0.08 0.00 -1.09 0.00 0.00 33.01 32.45 2wbl s GLN 59 CO 0.04 -0.72 1.44 -2.14 -1.32 0.00 0.00 175.29 172.59 2wbl s PRO 60 N -3.85 3.66 0.05 9.60 0.02 -1.18 -4.75 135.00 138.55 2wbl s PRO 60 Ca 0.07 2.45 -0.30 0.00 0.02 0.00 0.00 61.00 63.24 2wbl s PRO 60 Cb -0.04 -2.65 -0.09 0.00 0.02 0.00 0.00 34.50 31.74 2wbl s PRO 60 CO -0.01 -0.85 1.92 1.41 -0.33 0.00 0.00 177.00 179.14 2wbl s MET 61 N -2.47 4.14 -0.48 5.54 1.75 -1.26 -4.84 119.30 121.68 2wbl s MET 61 Ca 0.61 2.59 -0.44 0.00 -1.25 0.00 0.00 55.69 57.20 2wbl s MET 61 Cb -0.44 -4.02 -0.18 0.00 2.84 0.00 0.00 34.83 33.02 2wbl s MET 61 CO 0.57 -0.92 2.04 -2.30 -0.65 0.00 0.00 175.02 173.76 2wbl n PRO 62 N 7.08 0.13 -0.26 4.11 -0.01 -1.26 -4.61 135.00 140.18 2wbl n PRO 62 Ca 0.19 0.04 0.26 0.00 -0.01 0.00 0.00 63.50 63.98 2wbl n PRO 62 Cb 0.40 -1.60 0.47 0.00 -0.01 0.00 0.00 33.50 32.76 2wbl n PRO 62 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2wbl n GLN 63 N 6.93 -0.05 0.39 -0.52 0.00 -1.26 -0.55 117.38 122.33 2wbl n GLN 63 Ca 0.49 1.07 -0.16 0.00 0.00 0.00 0.00 57.00 58.40 2wbl n GLN 63 Cb -0.02 -1.94 -0.07 0.00 0.00 0.00 0.00 30.24 28.21 2wbl n GLN 63 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.06 177.44 2wbl h ASP 64 N 0.00 -0.86 -1.07 2.61 2.03 -2.00 -2.31 116.42 114.82 2wbl h ASP 64 Ca 0.67 0.03 0.30 0.00 -0.73 0.00 0.00 57.03 57.29 2wbl h ASP 64 Cb 1.80 0.22 -0.12 0.00 -0.83 0.00 0.00 39.33 40.40 2wbl h ASP 64 CO -0.58 -0.54 0.66 0.03 -1.03 0.00 0.00 179.24 177.78 2wbl h ARG 65 N -1.17 0.37 -0.82 4.15 3.08 -1.17 0.31 114.38 119.13 2wbl h ARG 65 Ca -0.10 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2wbl h ARG 65 Cb 0.78 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.71 2wbl h ARG 65 CO 0.17 0.24 0.49 0.37 -1.07 0.00 0.00 179.97 180.17 2wbl h GLN 66 N 0.38 1.12 -0.25 0.04 4.15 -1.31 0.17 115.11 119.41 2wbl h GLN 66 Ca 0.67 -0.10 -0.16 0.00 0.77 0.00 0.00 58.65 59.82 2wbl h GLN 66 Cb 1.63 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 29.08 2wbl h GLN 66 CO -0.41 0.79 -0.49 0.00 -1.93 0.00 0.00 178.83 176.79 2wbl h ALA 67 N 1.26 0.68 0.82 3.38 0.00 0.12 -1.37 119.26 124.15 2wbl h ALA 67 Ca 0.29 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2wbl h ALA 67 Cb -0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2wbl h ALA 67 CO -0.05 0.68 -0.48 -0.09 0.00 0.00 0.00 179.25 179.30 2wbl h ARG 68 N 0.53 -1.17 -0.74 0.00 2.43 -0.77 -2.15 114.38 112.52 2wbl h ARG 68 Ca 0.03 0.08 0.17 0.00 -0.81 0.00 0.00 59.98 59.44 2wbl h ARG 68 Cb 1.04 0.27 -0.12 0.00 -0.42 0.00 0.00 29.97 30.73 2wbl h ARG 68 CO 0.10 -0.78 0.04 2.35 -1.51 0.00 0.00 179.97 180.17 2wbl h TRP 69 N -1.21 0.02 0.16 2.20 2.91 -0.66 0.59 115.95 119.95 2wbl h TRP 69 Ca -0.11 0.05 -0.01 0.00 1.13 0.00 0.00 58.89 59.95 2wbl h TRP 69 Cb 0.96 0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.72 2wbl h TRP 69 CO -0.08 -0.21 -0.08 0.87 -1.03 0.00 0.00 178.44 177.92 2wbl h LYS 70 N 0.13 -0.20 -0.51 2.65 1.57 -1.08 -2.42 116.57 116.70 2wbl h LYS 70 Ca 0.41 0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 59.09 2wbl h LYS 70 Cb 0.71 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 2wbl h LYS 70 CO -0.62 -0.01 -0.12 1.57 -0.57 0.00 0.00 179.45 179.69 2wbl h LYS 71 N -0.36 0.98 -0.26 3.15 -0.00 -0.94 -1.69 116.57 117.46 2wbl h LYS 71 Ca -0.02 -0.38 -0.07 0.00 -0.00 0.00 0.00 60.65 60.18 2wbl h LYS 71 Cb 0.28 -0.06 -0.01 0.00 -0.00 0.00 0.00 32.23 32.45 2wbl h LYS 71 CO 0.04 1.05 -0.11 0.93 -0.00 0.00 0.00 179.45 181.35 2wbl h GLU 72 N 0.85 0.53 -0.27 0.07 4.39 -0.88 -1.42 114.58 117.85 2wbl h GLU 72 Ca 0.13 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.49 2wbl h GLU 72 Cb 0.69 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2wbl h GLU 72 CO 0.05 0.78 -0.31 0.82 -1.16 0.00 0.00 179.01 179.19 2wbl h ILE 73 N 0.26 1.28 -0.91 3.13 1.08 -1.50 -2.67 117.51 118.17 2wbl h ILE 73 Ca 0.06 -1.40 0.11 0.00 -0.39 0.00 0.00 64.86 63.23 2wbl h ILE 73 Cb 0.62 1.41 -0.07 0.00 -3.07 0.00 0.00 36.82 35.71 2wbl h ILE 73 CO 0.04 0.45 0.59 -0.78 -0.69 0.00 0.00 178.15 177.75 2wbl h ASP 74 N 0.48 0.81 -0.01 1.72 3.58 -1.04 -1.77 116.42 120.19 2wbl h ASP 74 Ca 0.06 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2wbl h ASP 74 Cb 0.77 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 2wbl h ASP 74 CO 0.06 0.46 -0.01 -0.50 -2.88 0.00 0.00 179.24 176.37 2wbl h TRP 75 N 0.89 0.03 0.00 0.28 6.55 -0.92 -3.11 115.95 119.66 2wbl h TRP 75 Ca 0.43 -0.01 -0.03 0.00 0.95 0.00 0.00 58.89 60.23 2wbl h TRP 75 Cb 0.45 -0.01 -0.00 0.00 -0.86 0.00 0.00 29.16 28.74 2wbl h TRP 75 CO -0.00 0.53 -0.16 -0.07 -1.05 0.00 0.00 178.44 177.69 2wbl h LEU 76 N -0.49 0.00 -0.07 -4.49 3.38 -1.37 -2.68 115.31 109.59 2wbl h LEU 76 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wbl h LEU 76 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2wbl h LEU 76 CO 0.00 0.16 0.00 -0.07 0.09 0.00 0.00 178.44 178.62 2wbl h LEU 77 N 0.00 0.00 -1.76 1.67 4.07 -1.36 -3.36 115.31 114.57 2wbl h LEU 77 Ca -0.00 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.92 2wbl h LEU 77 Cb 0.30 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 2wbl h LEU 77 CO 0.02 0.00 -0.16 0.28 -1.08 0.00 0.00 178.44 177.50 2wbl h SER 78 N 0.00 0.00 -0.77 -0.43 0.02 -1.40 -1.43 113.55 109.54 2wbl h SER 78 Ca 0.00 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 61.17 2wbl h SER 78 Cb 0.93 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.44 2wbl h SER 78 CO 0.00 0.16 0.56 0.58 -1.14 0.00 0.00 176.83 177.00 2wbl h VAL 79 N 0.00 0.59 0.00 2.27 2.07 -1.77 -1.96 116.25 117.45 2wbl h VAL 79 Ca -0.00 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2wbl h VAL 79 Cb 0.37 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2wbl h VAL 79 CO 0.02 0.00 -0.39 0.71 0.02 0.00 0.00 177.57 177.93 2wbl h THR 80 N 0.00 0.72 0.00 2.57 1.35 -1.55 -2.53 112.91 113.46 2wbl h THR 80 Ca 0.37 -1.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.38 2wbl h THR 80 Cb 1.49 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 70.13 2wbl h THR 80 CO -0.00 0.38 0.00 0.44 -0.25 0.00 0.00 175.52 176.09 2wbl h ASP 81 N 0.00 0.00 -0.29 5.36 3.45 -1.50 -2.98 116.42 120.45 2wbl h ASP 81 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2wbl h ASP 81 Cb 1.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.96 2wbl h ASP 81 CO 0.05 0.00 0.00 1.41 -1.57 0.00 0.00 179.24 179.13 2wbl n HIS 82 N -3.01 0.39 -3.26 4.55 8.25 -0.96 -4.92 115.22 116.25 2wbl n HIS 82 Ca -0.02 -0.36 -0.43 0.00 -0.26 0.00 0.00 57.72 56.66 2wbl n HIS 82 Cb 0.13 -0.02 -0.08 0.00 1.12 0.00 0.00 29.99 31.14 2wbl n HIS 82 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2wbl s ILE 83 N -1.02 5.02 0.36 1.59 1.01 -1.13 -5.04 121.20 121.99 2wbl s ILE 83 Ca 0.24 -0.11 0.08 0.00 0.00 0.00 0.00 60.65 60.85 2wbl s ILE 83 Cb 0.13 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.48 2wbl s ILE 83 CO 0.18 -0.41 -0.04 0.68 0.00 0.00 0.00 174.94 175.34 2wbl s VAL 84 N 2.34 2.01 -0.11 2.92 -7.23 -1.26 -1.12 120.40 117.94 2wbl s VAL 84 Ca 0.16 -2.10 -0.04 0.00 -1.81 0.00 0.00 61.98 58.19 2wbl s VAL 84 Cb -0.16 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 33.96 2wbl s VAL 84 CO 0.15 -0.12 0.03 -1.61 -0.31 0.00 0.00 175.10 173.25 2wbl s GLU 85 N -3.68 3.25 -0.58 4.82 2.02 0.14 -4.62 118.70 120.05 2wbl s GLU 85 Ca 0.33 -0.35 -0.04 0.00 0.02 0.00 0.00 54.97 54.93 2wbl s GLU 85 Cb 0.06 -2.93 0.15 0.00 0.10 0.00 0.00 34.13 31.51 2wbl s GLU 85 CO 0.17 0.63 0.40 0.12 0.02 0.00 0.00 175.26 176.59 2wbl s PHE 86 N -0.66 3.47 -0.01 1.61 5.36 -1.26 -2.44 117.98 124.05 2wbl s PHE 86 Ca 0.11 -2.57 0.07 0.00 -0.96 0.00 0.00 56.93 53.58 2wbl s PHE 86 Cb -0.12 -3.25 -0.02 0.00 -0.34 0.00 0.00 43.02 39.29 2wbl s PHE 86 CO 0.02 -0.89 -0.22 0.14 -1.46 0.00 0.00 175.22 172.82 2wbl s VAL 87 N 0.29 2.46 0.38 3.12 -7.23 -0.46 -4.90 120.40 114.06 2wbl s VAL 87 Ca 0.14 -1.04 -0.26 0.00 -1.81 0.00 0.00 61.98 59.01 2wbl s VAL 87 Cb -0.21 -1.92 -0.11 0.00 0.56 0.00 0.00 36.38 34.70 2wbl s VAL 87 CO -0.04 0.53 1.20 -0.81 -0.31 0.00 0.00 175.10 175.67 2wbl n PRO 88 N 2.20 1.83 -0.80 4.82 -0.04 -1.26 -1.46 135.00 140.29 2wbl n PRO 88 Ca -0.16 0.65 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 2wbl n PRO 88 Cb 0.52 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2wbl n PRO 88 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wbl n SER 89 N 0.55 0.00 -3.87 3.54 2.88 -0.49 -4.83 113.62 111.41 2wbl n SER 89 Ca 0.07 -0.62 -0.09 0.00 -1.33 0.00 0.00 58.87 56.89 2wbl n SER 89 Cb 0.38 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.76 2wbl n SER 89 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2wbl s GLN 90 N -0.87 0.79 -0.05 -1.46 -0.21 -1.26 -2.17 119.66 114.43 2wbl s GLN 90 Ca 0.00 -0.91 -0.19 0.00 0.02 0.00 0.00 55.36 54.28 2wbl s GLN 90 Cb 0.00 0.32 0.04 0.00 1.00 0.00 0.00 33.01 34.37 2wbl s GLN 90 CO 0.00 -0.24 0.42 1.14 -2.12 0.00 0.00 175.29 174.49 2wbl s GLN 91 N -3.60 0.73 -0.10 2.91 -2.07 -0.72 -4.91 119.66 111.90 2wbl s GLN 91 Ca 0.03 0.08 0.02 0.00 -1.82 0.00 0.00 55.36 53.68 2wbl s GLN 91 Cb 0.04 0.33 -0.01 0.00 -1.09 0.00 0.00 33.01 32.28 2wbl s GLN 91 CO -0.10 -0.19 -0.18 0.99 -1.32 0.00 0.00 175.29 174.49 2wbl s THR 92 N -0.97 2.62 0.92 3.63 2.01 -1.26 -0.25 115.64 122.34 2wbl s THR 92 Ca -0.10 -0.83 -0.13 0.00 0.31 0.00 0.00 61.69 60.94 2wbl s THR 92 Cb -0.04 -2.05 0.14 0.00 0.01 0.00 0.00 72.50 70.57 2wbl s THR 92 CO 0.05 0.55 1.16 -0.94 -0.69 0.00 0.00 174.62 174.74 2wbl s SER 93 N 0.13 3.46 0.00 3.53 1.04 0.91 -4.85 113.70 117.93 2wbl s SER 93 Ca -0.09 0.87 0.04 0.00 0.48 0.00 0.00 55.95 57.25 2wbl s SER 93 Cb -0.15 -1.38 0.24 0.00 0.10 0.00 0.00 66.02 64.83 2wbl s SER 93 CO 0.06 -2.57 0.65 1.17 0.98 0.00 0.00 173.24 173.53 2wbl n LYS 94 N -3.76 0.15 0.00 4.02 4.81 -1.26 -1.32 118.16 120.80 2wbl n LYS 94 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 2wbl n LYS 94 Cb 0.59 -1.41 0.00 0.00 0.02 0.00 0.00 35.03 34.24 2wbl n LYS 94 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2wbl n ASP 95 N -0.91 1.33 0.00 3.14 8.00 -1.26 -5.00 116.55 121.85 2wbl n ASP 95 Ca 0.03 -1.45 0.00 0.00 0.71 0.00 0.00 54.79 54.08 2wbl n ASP 95 Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 2wbl n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wbl n GLY 96 N -0.23 0.75 3.70 0.44 0.00 -0.44 -5.04 105.19 104.38 2wbl n GLY 96 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2wbl n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbl s VAL 97 N -2.59 4.37 -0.34 1.61 1.01 -1.26 -4.75 120.40 118.46 2wbl s VAL 97 Ca 0.00 1.70 -0.13 0.00 0.00 0.00 0.00 61.98 63.54 2wbl s VAL 97 Cb 0.00 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 2wbl s VAL 97 CO 0.00 0.08 0.27 0.00 0.00 0.00 0.00 175.10 175.46 2wbl s THR 99 N 1.80 3.73 -0.26 0.00 2.01 0.66 -4.97 115.64 118.60 2wbl s THR 99 Ca 0.08 -0.44 -0.19 0.00 0.31 0.00 0.00 61.69 61.44 2wbl s THR 99 Cb -0.17 -2.57 -0.02 0.00 0.01 0.00 0.00 72.50 69.75 2wbl s THR 99 CO 0.11 0.55 0.58 -1.61 -0.69 0.00 0.00 174.62 173.56 2wbl s GLU 100 N -0.22 4.06 0.47 4.92 2.02 -1.26 -1.75 118.70 126.93 2wbl s GLU 100 Ca 0.03 0.41 0.02 0.00 0.02 0.00 0.00 54.97 55.46 2wbl s GLU 100 Cb -0.13 -3.66 -0.02 0.00 0.10 0.00 0.00 34.13 30.42 2wbl s GLU 100 CO 0.03 -0.41 0.05 0.96 0.02 0.00 0.00 175.26 175.90 2wbl s ILE 101 N 2.44 1.00 -0.09 -1.63 -4.36 -0.92 -5.00 121.20 112.63 2wbl s ILE 101 Ca 0.24 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.67 2wbl s ILE 101 Cb -0.15 -2.27 -0.00 0.00 1.25 0.00 0.00 42.46 41.28 2wbl s ILE 101 CO 0.09 0.00 -0.23 -0.32 0.24 0.00 0.00 174.94 174.72 2wbl s MET 102 N -3.81 2.97 0.04 0.37 1.75 -1.26 -1.39 119.30 117.97 2wbl s MET 102 Ca 0.14 -0.86 0.06 0.00 -1.25 0.00 0.00 55.69 53.78 2wbl s MET 102 Cb 0.02 -2.31 -0.03 0.00 2.84 0.00 0.00 34.83 35.35 2wbl s MET 102 CO 0.08 0.23 -0.15 0.08 -0.65 0.00 0.00 175.02 174.61 2wbl s VAL 103 N 0.22 2.99 -0.13 10.11 1.01 -0.53 -4.94 120.40 129.11 2wbl s VAL 103 Ca -0.14 -1.11 -0.06 0.00 0.00 0.00 0.00 61.98 60.67 2wbl s VAL 103 Cb -0.17 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2wbl s VAL 103 CO 0.07 0.34 0.07 0.42 0.00 0.00 0.00 175.10 176.00 2wbl s THR 104 N -0.95 4.87 -0.01 3.92 -4.23 -1.26 -1.36 115.64 116.61 2wbl s THR 104 Ca 0.15 -0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.57 2wbl s THR 104 Cb -0.11 -3.13 0.00 0.00 1.34 0.00 0.00 72.50 70.61 2wbl s THR 104 CO 0.06 0.55 0.14 0.00 -0.54 0.00 0.00 174.62 174.84 2wbl s ARG 105 N -0.44 0.42 0.36 3.99 1.70 -1.02 -4.99 118.95 118.96 2wbl s ARG 105 Ca 0.10 -0.26 -0.27 0.00 -0.47 0.00 0.00 55.73 54.84 2wbl s ARG 105 Cb -0.12 0.18 -0.12 0.00 -0.57 0.00 0.00 34.95 34.32 2wbl s ARG 105 CO 0.02 -0.09 1.12 0.94 -1.08 0.00 0.00 175.30 176.21 2wbl n GLN 106 N 1.80 1.65 -1.70 3.89 7.27 -1.26 -0.69 117.38 128.34 2wbl n GLN 106 Ca -0.20 0.58 -0.43 0.00 0.07 0.00 0.00 57.00 57.02 2wbl n GLN 106 Cb 0.56 -2.11 -0.02 0.00 2.41 0.00 0.00 30.24 31.08 2wbl n GLN 106 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2wbl n ARG 107 N 0.41 2.30 -0.24 3.69 0.63 -0.28 -4.54 116.66 118.63 2wbl n ARG 107 Ca 0.08 0.82 -0.06 0.00 -0.92 0.00 0.00 57.85 57.76 2wbl n ARG 107 Cb 0.36 -2.52 -0.06 0.00 0.45 0.00 0.00 32.46 30.70 2wbl n ARG 107 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wbl n GLY 108 N 2.01 -2.74 0.19 5.14 0.00 -1.26 -1.13 105.19 107.39 2wbl n GLY 108 Ca 0.10 0.92 0.12 0.00 0.00 0.00 0.00 46.02 47.15 2wbl n GLY 108 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2wbl h ASP 109 N 0.00 0.00 0.00 1.61 2.03 -2.00 -2.17 116.42 115.89 2wbl h ASP 109 Ca 0.09 0.00 -0.32 0.00 -0.73 0.00 0.00 57.03 56.07 2wbl h ASP 109 Cb 0.23 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.68 2wbl h ASP 109 CO -0.54 0.00 -2.19 0.18 -1.03 0.00 0.00 179.24 175.66 2wbl n LEU 110 N -2.32 0.53 -0.01 0.15 4.77 -0.29 -3.89 117.00 115.94 2wbl n LEU 110 Ca -0.02 -0.02 0.11 0.00 -0.03 0.00 0.00 56.01 56.05 2wbl n LEU 110 Cb 0.10 0.21 0.53 0.00 -2.33 0.00 0.00 43.42 41.92 2wbl n LEU 110 CO 0.10 0.50 1.17 0.25 -1.33 0.00 0.00 177.39 178.08 2wbl h LEU 111 N 0.00 0.30 0.00 2.23 7.12 -0.50 -2.13 115.31 122.33 2wbl h LEU 111 Ca -0.47 0.00 -0.35 0.00 0.13 0.00 0.00 57.88 57.19 2wbl h LEU 111 Cb 2.01 -0.06 -0.07 0.00 -0.53 0.00 0.00 40.66 42.01 2wbl h LEU 111 CO 0.01 0.19 -2.30 0.23 -0.13 0.00 0.00 178.44 176.43 2wbl n MET 112 N -4.47 0.89 0.03 1.25 2.81 -1.23 -4.57 117.12 111.82 2wbl n MET 112 Ca 0.07 -0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.79 2wbl n MET 112 Cb 0.30 -1.49 -0.14 0.00 -0.71 0.00 0.00 33.22 31.18 2wbl n MET 112 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2wbl h ASN 113 N 0.00 0.33 -0.62 7.83 2.35 -1.64 -2.85 115.58 121.00 2wbl h ASN 113 Ca -0.52 -0.56 -0.00 0.00 -0.55 0.00 0.00 56.30 54.67 2wbl h ASN 113 Cb 2.15 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 40.39 2wbl h ASN 113 CO 0.02 1.49 0.37 0.40 -1.65 0.00 0.00 177.43 178.06 2wbl h ILE 114 N 0.06 1.18 -0.02 2.81 1.08 -1.66 0.75 117.51 121.71 2wbl h ILE 114 Ca -0.30 -0.42 -0.16 0.00 -0.39 0.00 0.00 64.86 63.59 2wbl h ILE 114 Cb 2.02 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 36.10 2wbl h ILE 114 CO 0.13 0.19 -0.72 1.55 -0.69 0.00 0.00 178.15 178.61 2wbl h PRO 115 N 0.84 0.14 -0.26 2.37 0.14 -1.77 -1.72 132.00 131.73 2wbl h PRO 115 Ca 0.22 -0.12 0.06 0.00 0.14 0.00 0.00 66.00 66.30 2wbl h PRO 115 Cb -0.01 0.03 -0.08 0.00 0.14 0.00 0.00 31.00 31.08 2wbl h PRO 115 CO -0.04 0.80 -0.31 0.00 0.14 0.00 0.00 178.00 178.58 2wbl h ALA 116 N 1.17 -0.26 0.05 -0.56 0.00 -1.15 -0.49 119.26 118.01 2wbl h ALA 116 Ca -0.02 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2wbl h ALA 116 Cb 1.27 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2wbl h ALA 116 CO 0.10 -0.75 -0.02 -0.07 0.00 0.00 0.00 179.25 178.51 2wbl h LEU 117 N -0.32 -0.06 -1.35 0.00 3.38 -0.88 -1.91 115.31 114.17 2wbl h LEU 117 Ca 0.13 -0.37 0.35 0.00 0.09 0.00 0.00 57.88 58.09 2wbl h LEU 117 Cb 0.53 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.18 2wbl h LEU 117 CO -0.44 0.34 0.75 0.03 0.09 0.00 0.00 178.44 179.21 2wbl h ARG 118 N -0.47 0.22 -0.27 1.13 3.08 -1.18 0.66 114.38 117.55 2wbl h ARG 118 Ca -0.01 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 2wbl h ARG 118 Cb 0.42 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 2wbl h ARG 118 CO 0.01 0.15 -0.24 -0.22 -1.07 0.00 0.00 179.97 178.60 2wbl h LYS 119 N 0.23 0.64 -0.28 0.04 3.64 -0.79 -2.24 116.57 117.81 2wbl h LYS 119 Ca 0.72 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 59.76 2wbl h LYS 119 Cb 2.05 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.86 2wbl h LYS 119 CO -0.39 0.93 0.12 -0.07 -2.27 0.00 0.00 179.45 177.77 2wbl h LEU 120 N 0.37 0.35 0.62 5.20 3.38 0.10 -0.98 115.31 124.35 2wbl h LEU 120 Ca 0.05 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2wbl h LEU 120 Cb 0.80 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.46 2wbl h LEU 120 CO 0.06 0.31 -0.30 -0.78 0.09 0.00 0.00 178.44 177.83 2wbl h ASP 121 N 0.39 -0.70 -0.52 -0.43 1.82 -0.74 -1.96 116.42 114.28 2wbl h ASP 121 Ca 0.10 -0.02 0.09 0.00 -0.39 0.00 0.00 57.03 56.81 2wbl h ASP 121 Cb 0.07 0.18 -0.03 0.00 0.68 0.00 0.00 39.33 40.23 2wbl h ASP 121 CO -0.01 -0.35 0.35 0.00 -1.61 0.00 0.00 179.24 177.62 2wbl h ALA 122 N -0.92 2.09 -0.17 -0.78 0.00 -1.19 -0.01 119.26 118.28 2wbl h ALA 122 Ca -0.09 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2wbl h ALA 122 Cb 0.68 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2wbl h ALA 122 CO 0.14 -0.20 -0.23 0.52 0.00 0.00 0.00 179.25 179.48 2wbl h MET 123 N 0.30 0.31 0.00 0.00 2.86 -0.84 -0.29 114.93 117.28 2wbl h MET 123 Ca 0.24 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 2wbl h MET 123 Cb 0.54 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.18 2wbl h MET 123 CO -0.05 0.53 -0.25 -0.07 1.06 0.00 0.00 176.91 178.12 2wbl h LEU 124 N 0.28 0.22 -0.75 1.22 3.38 -0.25 -2.49 115.31 116.92 2wbl h LEU 124 Ca 0.05 -0.79 0.06 0.00 0.09 0.00 0.00 57.88 57.29 2wbl h LEU 124 Cb 0.56 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 2wbl h LEU 124 CO 0.04 0.98 0.45 0.40 0.09 0.00 0.00 178.44 180.39 2wbl h ILE 125 N -0.52 1.02 -0.95 1.22 5.03 -1.30 -1.56 117.51 120.44 2wbl h ILE 125 Ca -0.03 -0.29 0.07 0.00 -0.12 0.00 0.00 64.86 64.49 2wbl h ILE 125 Cb 1.01 0.11 -0.07 0.00 -3.03 0.00 0.00 36.82 34.85 2wbl h ILE 125 CO 0.05 0.15 0.61 0.44 -0.68 0.00 0.00 178.15 178.72 2wbl h ASP 126 N 0.83 0.96 -0.79 1.72 5.19 -1.10 0.12 116.42 123.35 2wbl h ASP 126 Ca 0.33 0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.72 2wbl h ASP 126 Cb 0.16 -0.19 -0.04 0.00 0.18 0.00 0.00 39.33 39.44 2wbl h ASP 126 CO -0.17 0.61 0.35 0.74 -3.12 0.00 0.00 179.24 177.66 2wbl h THR 127 N 1.10 1.26 -0.43 0.35 2.02 -0.82 -1.53 112.91 114.85 2wbl h THR 127 Ca 0.41 -0.76 -0.07 0.00 0.77 0.00 0.00 66.41 66.77 2wbl h THR 127 Cb 0.18 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2wbl h THR 127 CO -0.18 0.32 -0.00 -0.07 0.37 0.00 0.00 175.52 175.96 2wbl h LEU 128 N 1.14 0.75 -2.17 2.58 3.38 -0.72 -3.11 115.31 117.17 2wbl h LEU 128 Ca 0.27 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.98 2wbl h LEU 128 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2wbl h LEU 128 CO -0.03 0.88 0.17 0.44 0.09 0.00 0.00 178.44 179.99 2wbl h ASP 129 N 0.61 0.00 0.24 -0.43 3.45 -0.23 0.43 116.42 120.48 2wbl h ASP 129 Ca 0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 2wbl h ASP 129 Cb 0.49 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.26 2wbl h ASP 129 CO 0.02 0.00 0.00 0.78 -1.57 0.00 0.00 179.24 178.47 2wbl h ASN 130 N 0.00 0.00 -0.42 6.45 -0.26 -1.22 -1.50 115.58 118.64 2wbl h ASN 130 Ca 0.09 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.83 2wbl h ASN 130 Cb 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.69 2wbl h ASN 130 CO -0.00 0.00 0.00 0.49 -1.06 0.00 0.00 177.43 176.86 2wbl n PHE 131 N -3.08 0.86 -1.69 1.19 3.01 0.13 -4.89 117.46 112.98 2wbl n PHE 131 Ca -0.02 -0.35 -0.44 0.00 1.01 0.00 0.00 57.45 57.64 2wbl n PHE 131 Cb 0.12 -0.13 -0.03 0.00 -0.01 0.00 0.00 39.48 39.43 2wbl n PHE 131 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2wbl n ARG 132 N 0.66 2.44 0.00 -1.08 1.74 -0.57 -4.46 116.66 115.40 2wbl n ARG 132 Ca 0.16 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 58.12 2wbl n ARG 132 Cb 0.55 -2.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.31 2wbl n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wbl n GLY 133 N 3.49 -0.50 3.77 -0.13 0.00 -1.26 -4.96 105.19 105.61 2wbl n GLY 133 Ca 0.16 -1.86 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 2wbl n GLY 133 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wbl s HIS 134 N 0.00 3.84 0.14 1.61 5.65 -1.26 -5.08 115.29 120.20 2wbl s HIS 134 Ca 0.00 1.72 0.08 0.00 0.25 0.00 0.00 55.06 57.11 2wbl s HIS 134 Cb 0.00 -2.85 -0.04 0.00 -1.18 0.00 0.00 32.58 28.51 2wbl s HIS 134 CO 0.00 0.40 -0.17 -0.80 -0.65 0.00 0.00 174.74 173.52 2wbl s ASN 135 N -1.35 2.45 0.19 9.88 0.01 -1.26 -5.05 114.94 119.80 2wbl s ASN 135 Ca 0.42 -0.83 -0.05 0.00 -0.71 0.00 0.00 52.86 51.69 2wbl s ASN 135 Cb -0.22 -0.13 0.11 0.00 0.41 0.00 0.00 41.25 41.42 2wbl s ASN 135 CO 0.27 -0.06 1.53 -0.33 -1.51 0.00 0.00 177.10 176.99 2wbl h GLU 136 N 3.42 0.68 -6.76 -0.60 5.08 -1.98 -3.43 114.58 110.98 2wbl h GLU 136 Ca -0.42 -0.37 -0.49 0.00 -1.00 0.00 0.00 59.36 57.08 2wbl h GLU 136 Cb 1.20 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2wbl h GLU 136 CO 0.50 0.98 0.10 -0.59 -1.00 0.00 0.00 179.01 179.00 2wbl s PHE 137 N -4.21 3.41 0.32 4.33 -0.12 -1.26 -4.32 117.98 116.13 2wbl s PHE 137 Ca -0.08 1.14 0.05 0.00 -0.05 0.00 0.00 56.93 57.99 2wbl s PHE 137 Cb 0.12 -2.49 -0.03 0.00 -0.63 0.00 0.00 43.02 39.98 2wbl s PHE 137 CO 0.85 0.02 0.22 1.67 -0.05 0.00 0.00 175.22 177.92 2wbl s TRP 138 N -2.13 1.67 0.17 3.49 -2.14 0.11 -4.97 118.94 115.14 2wbl s TRP 138 Ca 0.53 -1.52 0.11 0.00 2.66 0.00 0.00 56.10 57.88 2wbl s TRP 138 Cb -0.10 -0.80 -0.04 0.00 -3.10 0.00 0.00 33.47 29.43 2wbl s TRP 138 CO 0.23 -0.69 -0.23 0.71 -2.66 0.00 0.00 176.95 174.31 2wbl s TYR 139 N -3.51 2.36 -0.03 1.66 1.51 -1.26 0.06 117.35 118.14 2wbl s TYR 139 Ca 0.37 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 2wbl s TYR 139 Cb 0.03 -1.20 0.02 0.00 -0.11 0.00 0.00 41.96 40.70 2wbl s TYR 139 CO 0.22 0.45 -0.04 0.08 -1.11 0.00 0.00 175.55 175.14 2wbl s VAL 140 N -1.46 0.47 -0.02 0.71 1.01 -0.81 -4.95 120.40 115.34 2wbl s VAL 140 Ca 0.19 -0.13 -0.38 0.00 0.00 0.00 0.00 61.98 61.65 2wbl s VAL 140 Cb -0.09 -0.48 -0.17 0.00 0.00 0.00 0.00 36.38 35.64 2wbl s VAL 140 CO 0.09 0.19 1.38 -1.20 0.00 0.00 0.00 175.10 175.56 2wbl n SER 141 N 3.73 1.48 -0.22 3.32 7.64 -1.26 -3.01 113.62 125.30 2wbl n SER 141 Ca -0.22 1.12 0.02 0.00 1.01 0.00 0.00 58.87 60.79 2wbl n SER 141 Cb 0.53 -1.12 0.13 0.00 -1.01 0.00 0.00 64.21 62.74 2wbl n SER 141 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2wbl h ARG 142 N 4.80 0.40 -2.13 1.43 -0.00 -1.93 -2.77 114.38 114.19 2wbl h ARG 142 Ca -0.48 -0.02 -0.70 0.00 -0.50 0.00 0.00 59.98 58.27 2wbl h ARG 142 Cb 1.35 -0.09 -0.34 0.00 0.00 0.00 0.00 29.97 30.89 2wbl h ARG 142 CO 0.80 0.27 0.27 -0.40 0.00 0.00 0.00 179.97 180.90 2wbl n ASP 143 N -5.00 6.12 0.00 7.04 3.85 -1.26 -4.41 116.55 122.89 2wbl n ASP 143 Ca 0.10 -3.72 0.00 0.00 -0.71 0.00 0.00 54.79 50.47 2wbl n ASP 143 Cb 0.32 -0.86 0.00 0.00 -1.35 0.00 0.00 41.12 39.22 2wbl n ASP 143 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2wbl n SER 144 N -0.25 1.85 0.05 -1.12 3.41 -1.04 -5.05 113.62 111.45 2wbl n SER 144 Ca 0.42 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.81 2wbl n SER 144 Cb 0.35 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.16 2wbl n SER 144 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2wbl h GLU 145 N 0.00 0.33 0.00 4.33 9.09 -1.93 -3.18 114.58 123.22 2wbl h GLU 145 Ca 0.00 -0.56 -0.02 0.00 0.05 0.00 0.00 59.36 58.83 2wbl h GLU 145 Cb 0.00 0.21 -0.00 0.00 -1.65 0.00 0.00 28.75 27.30 2wbl h GLU 145 CO 0.00 1.24 -0.11 1.05 0.05 0.00 0.00 179.01 181.25 2wbl h GLU 146 N 0.09 0.00 0.00 1.06 -0.00 -1.95 -3.11 114.58 110.67 2wbl h GLU 146 Ca -0.36 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 58.92 2wbl h GLU 146 Cb 2.07 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 30.81 2wbl h GLU 146 CO 0.14 0.11 -0.35 0.78 -0.00 0.00 0.00 179.01 179.69 2wbl h GLY 147 N 3.30 0.00 2.00 1.06 0.00 -1.71 -3.14 103.07 104.58 2wbl h GLY 147 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2wbl h GLY 147 CO 0.01 0.00 -0.21 1.46 0.00 0.00 0.00 176.54 177.81 2wbl h GLN 148 N 0.00 0.00 -4.71 4.80 4.20 -1.51 -3.24 115.11 114.65 2wbl h GLN 148 Ca -0.00 0.00 -0.73 0.00 0.06 0.00 0.00 58.65 57.98 2wbl h GLN 148 Cb 1.25 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.89 2wbl h GLN 148 CO 0.05 0.21 1.82 1.04 -0.67 0.00 0.00 178.83 181.27 2wbl n GLN 149 N -3.59 3.34 -3.29 1.46 6.02 -1.19 -4.86 117.38 115.27 2wbl n GLN 149 Ca -0.01 -3.56 0.03 0.00 -0.01 0.00 0.00 57.00 53.45 2wbl n GLN 149 Cb 0.35 -3.14 -0.02 0.00 1.02 0.00 0.00 30.24 28.44 2wbl n GLN 149 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wbl s ALA 150 N 2.07 -2.73 -0.28 -1.58 0.00 -1.22 -5.01 121.76 113.00 2wbl s ALA 150 Ca 0.45 1.84 0.03 0.00 0.00 0.00 0.00 51.96 54.29 2wbl s ALA 150 Cb 0.02 -2.19 0.07 0.00 0.00 0.00 0.00 23.12 21.03 2wbl s ALA 150 CO 0.01 -1.21 -0.07 1.03 0.00 0.00 0.00 175.76 175.53 2wbl s ARG 151 N 2.77 2.03 -0.70 0.00 0.52 -1.26 -5.12 118.95 117.18 2wbl s ARG 151 Ca 0.04 -1.47 -0.20 0.00 -0.52 0.00 0.00 55.73 53.58 2wbl s ARG 151 Cb -0.10 -2.96 0.03 0.00 0.52 0.00 0.00 34.95 32.44 2wbl s ARG 151 CO -0.17 -0.66 0.38 0.36 0.02 0.00 0.00 175.30 175.23 2wbl n LYS 158 N 4.40 -0.57 0.22 3.54 -0.00 -1.26 -5.18 118.16 119.30 2wbl n LYS 158 Ca -0.09 -0.19 0.10 0.00 -0.00 0.00 0.00 58.31 58.12 2wbl n LYS 158 Cb 0.42 -1.01 0.51 0.00 -0.00 0.00 0.00 35.03 34.95 2wbl n LYS 158 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.40 177.51 2wbl h TRP 159 N -0.20 0.00 0.00 5.58 5.08 -2.04 -2.97 115.95 121.39 2wbl h TRP 159 Ca -0.41 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.56 2wbl h TRP 159 Cb 0.80 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.96 2wbl h TRP 159 CO 0.21 0.00 -0.23 -2.67 -1.28 0.00 0.00 178.44 174.47 2wbl n TRP 160 N -2.32 0.29 -2.81 0.12 2.14 -1.26 -4.79 117.44 108.81 2wbl n TRP 160 Ca -0.01 0.08 -0.41 0.00 2.07 0.00 0.00 57.50 59.23 2wbl n TRP 160 Cb 0.32 -0.56 -0.04 0.00 -0.81 0.00 0.00 31.31 30.23 2wbl n TRP 160 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2wbl s LEU 161 N -3.52 4.39 0.09 5.67 1.43 -1.13 -4.97 118.68 120.64 2wbl s LEU 161 Ca 0.11 1.57 -0.31 0.00 -1.03 0.00 0.00 54.13 54.47 2wbl s LEU 161 Cb 0.16 -3.44 -0.09 0.00 0.03 0.00 0.00 46.19 42.85 2wbl s LEU 161 CO 0.62 -0.17 1.72 -2.16 0.23 0.00 0.00 176.35 176.59 2wbl s PRO 162 N 0.68 4.17 0.30 1.29 0.04 -1.26 -4.84 135.00 135.38 2wbl s PRO 162 Ca 0.47 2.43 -0.27 0.00 0.04 0.00 0.00 61.00 63.67 2wbl s PRO 162 Cb -0.21 -3.60 -0.15 0.00 0.04 0.00 0.00 34.50 30.59 2wbl s PRO 162 CO 0.26 -0.78 0.73 -2.30 0.04 0.00 0.00 177.00 174.95 2wbl n PRO 163 N 5.63 0.72 -3.72 0.56 -0.02 -1.16 -4.66 135.00 132.35 2wbl n PRO 163 Ca 0.17 0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.57 2wbl n PRO 163 Cb 0.40 -1.48 -0.05 0.00 -0.02 0.00 0.00 33.50 32.34 2wbl n PRO 163 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wbl s VAL 164 N -1.15 5.23 0.06 -1.45 0.11 -1.26 -1.93 120.40 120.00 2wbl s VAL 164 Ca 0.61 0.09 0.04 0.00 -2.93 0.00 0.00 61.98 59.80 2wbl s VAL 164 Cb -0.75 -3.61 -0.03 0.00 -1.53 0.00 0.00 36.38 30.47 2wbl s VAL 164 CO 0.58 0.21 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.90 2wbl s LYS 165 N -2.20 0.70 0.17 1.54 1.02 0.11 -4.98 119.74 116.10 2wbl s LYS 165 Ca 0.34 -0.86 0.01 0.00 0.02 0.00 0.00 55.97 55.48 2wbl s LYS 165 Cb -0.13 -0.61 -0.05 0.00 -0.52 0.00 0.00 37.83 36.52 2wbl s LYS 165 CO 0.21 0.13 0.02 0.14 -0.92 0.00 0.00 175.35 174.93 2wbl s VAL 166 N -1.29 0.55 0.79 3.17 -7.23 -1.26 0.05 120.40 115.18 2wbl s VAL 166 Ca -0.05 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.03 2wbl s VAL 166 Cb -0.10 -2.12 0.07 0.00 0.56 0.00 0.00 36.38 34.79 2wbl s VAL 166 CO 0.01 -0.45 1.15 -2.84 -0.31 0.00 0.00 175.10 172.66 2wbl s PRO 167 N -3.95 1.88 0.13 4.82 0.02 -1.26 -4.88 135.00 131.76 2wbl s PRO 167 Ca 0.24 1.50 -0.31 0.00 0.02 0.00 0.00 61.00 62.45 2wbl s PRO 167 Cb 0.06 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.68 2wbl s PRO 167 CO 0.04 -1.98 1.56 -1.35 -0.33 0.00 0.00 177.00 174.94 2wbl h PRO 168 N -0.98 -0.43 0.00 5.54 0.11 -1.99 -0.80 132.00 133.45 2wbl h PRO 168 Ca -0.45 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2wbl h PRO 168 Cb 1.26 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.47 2wbl h PRO 168 CO 0.48 -0.29 0.00 0.41 -0.21 0.00 0.00 178.00 178.39 2wbl n GLY 169 N -1.41 -0.89 0.00 -0.55 0.00 -1.26 -4.64 105.19 96.43 2wbl n GLY 169 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2wbl n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbl n GLY 170 N -0.37 0.58 3.71 -0.02 0.00 -0.31 -4.69 105.19 104.10 2wbl n GLY 170 Ca 0.03 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.71 2wbl n GLY 170 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbl s LEU 171 N -0.34 3.15 0.90 0.99 2.01 -1.26 -4.58 118.68 119.54 2wbl s LEU 171 Ca 0.00 2.24 -0.11 0.00 0.01 0.00 0.00 54.13 56.27 2wbl s LEU 171 Cb 0.00 -4.57 0.13 0.00 0.01 0.00 0.00 46.19 41.76 2wbl s LEU 171 CO 0.00 -2.47 1.10 -0.94 1.01 0.00 0.00 176.35 175.05 2wbl s SER 172 N -2.39 3.30 0.16 2.29 1.04 -1.26 -4.88 113.70 111.96 2wbl s SER 172 Ca 0.70 1.79 -0.10 0.00 0.48 0.00 0.00 55.95 58.83 2wbl s SER 172 Cb -0.26 -2.40 0.02 0.00 0.10 0.00 0.00 66.02 63.48 2wbl s SER 172 CO 0.50 -2.79 1.54 1.05 0.98 0.00 0.00 173.24 174.52 2wbl h GLU 173 N -1.65 0.96 -0.52 4.02 -0.00 -1.98 -2.56 114.58 112.85 2wbl h GLU 173 Ca -0.47 -0.43 0.03 0.00 -0.00 0.00 0.00 59.36 58.48 2wbl h GLU 173 Cb 1.27 -0.02 -0.03 0.00 -0.00 0.00 0.00 28.75 29.96 2wbl h GLU 173 CO 0.49 1.10 0.31 -1.35 -0.00 0.00 0.00 179.01 179.57 2wbl h PRO 174 N 0.82 0.60 0.51 1.06 0.11 -1.98 0.23 132.00 133.35 2wbl h PRO 174 Ca 0.10 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.15 2wbl h PRO 174 Cb 0.84 -0.14 0.01 0.00 0.11 0.00 0.00 31.00 31.82 2wbl h PRO 174 CO 0.07 0.40 -0.25 0.77 -0.21 0.00 0.00 178.00 178.78 2wbl h SER 175 N 0.62 -0.58 -0.54 -2.05 0.02 -1.94 -0.49 113.55 108.59 2wbl h SER 175 Ca 0.21 -0.03 0.15 0.00 -0.84 0.00 0.00 61.79 61.28 2wbl h SER 175 Cb 0.03 0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 2wbl h SER 175 CO -0.10 -0.33 0.38 -0.09 -1.14 0.00 0.00 176.83 175.55 2wbl h ARG 176 N -0.80 0.05 -0.01 3.45 2.43 -1.39 -0.47 114.38 117.64 2wbl h ARG 176 Ca -0.07 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2wbl h ARG 176 Cb 0.58 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2wbl h ARG 176 CO 0.12 0.03 -0.02 -0.09 -1.51 0.00 0.00 179.97 178.50 2wbl h ARG 177 N 0.05 0.03 -0.83 0.20 2.43 -0.17 -2.53 114.38 113.56 2wbl h ARG 177 Ca 0.26 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.43 2wbl h ARG 177 Cb 0.95 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.45 2wbl h ARG 177 CO -0.02 0.59 0.54 1.98 -1.51 0.00 0.00 179.97 181.55 2wbl h MET 178 N -0.51 1.05 -0.89 0.20 4.05 -0.28 -0.71 114.93 117.84 2wbl h MET 178 Ca 0.00 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 59.41 2wbl h MET 178 Cb 0.59 -0.24 -0.06 0.00 -0.80 0.00 0.00 31.60 31.09 2wbl h MET 178 CO 0.00 0.69 0.56 -0.07 0.23 0.00 0.00 176.91 178.33 2wbl h LEU 179 N 1.08 0.90 -0.17 3.39 3.38 -1.14 0.82 115.31 123.58 2wbl h LEU 179 Ca 0.32 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.27 2wbl h LEU 179 Cb -0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2wbl h LEU 179 CO -0.09 0.59 -0.01 1.88 0.09 0.00 0.00 178.44 180.89 2wbl h TYR 180 N 1.04 0.33 -0.76 1.13 -1.99 -0.96 -2.22 116.97 113.55 2wbl h TYR 180 Ca 0.38 -0.06 0.10 0.00 2.00 0.00 0.00 58.73 61.14 2wbl h TYR 180 Cb 0.13 -0.09 -0.07 0.00 2.00 0.00 0.00 36.73 38.70 2wbl h TYR 180 CO -0.02 0.54 0.40 0.35 -0.00 0.00 0.00 178.16 179.42 2wbl h PHE 181 N 0.04 0.72 -0.58 4.88 3.04 -0.45 -0.84 116.94 123.76 2wbl h PHE 181 Ca 0.05 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.92 2wbl h PHE 181 Cb 0.41 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.69 2wbl h PHE 181 CO 0.04 0.27 -0.05 1.96 -2.02 0.00 0.00 178.31 178.52 2wbl h GLN 182 N 0.67 1.04 -0.40 1.11 1.08 -0.87 -1.89 115.11 115.85 2wbl h GLN 182 Ca 0.37 -0.35 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 2wbl h GLN 182 Cb 0.38 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 2wbl h GLN 182 CO -0.26 1.04 0.20 -0.22 -0.95 0.00 0.00 178.83 178.64 2wbl h LYS 183 N 0.94 0.58 0.59 1.46 1.63 -0.67 0.25 116.57 121.34 2wbl h LYS 183 Ca 0.16 -0.08 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 2wbl h LYS 183 Cb 0.61 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.12 2wbl h LYS 183 CO 0.04 0.50 -0.43 -0.44 -3.45 0.00 0.00 179.45 175.66 2wbl h ASP 184 N 0.51 -1.14 -0.82 4.20 5.19 -1.16 -0.63 116.42 122.57 2wbl h ASP 184 Ca 0.14 0.08 0.18 0.00 -0.62 0.00 0.00 57.03 56.81 2wbl h ASP 184 Cb 0.11 0.35 -0.15 0.00 0.18 0.00 0.00 39.33 39.81 2wbl h ASP 184 CO -0.02 -0.63 -0.10 -1.28 -3.12 0.00 0.00 179.24 174.09 2wbl h SER 185 N -0.98 -0.58 -0.31 6.45 0.87 -1.13 0.02 113.55 117.89 2wbl h SER 185 Ca -0.08 0.23 -0.11 0.00 -1.23 0.00 0.00 61.79 60.60 2wbl h SER 185 Cb 0.81 0.45 -0.01 0.00 -0.44 0.00 0.00 62.40 63.21 2wbl h SER 185 CO 0.03 -0.25 -0.21 0.58 -0.53 0.00 0.00 176.83 176.45 2wbl h VAL 186 N 0.04 1.27 0.00 2.23 2.07 -0.37 -2.83 116.25 118.66 2wbl h VAL 186 Ca 0.43 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.57 2wbl h VAL 186 Cb 0.73 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2wbl h VAL 186 CO -0.80 0.44 -0.31 0.71 0.02 0.00 0.00 177.57 177.63 2wbl h THR 187 N 0.69 0.87 -0.18 2.57 1.35 0.60 -0.99 112.91 117.83 2wbl h THR 187 Ca 0.10 -1.23 -0.02 0.00 -0.55 0.00 0.00 66.41 64.70 2wbl h THR 187 Cb 0.72 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.87 2wbl h THR 187 CO 0.06 0.30 0.01 1.56 -0.25 0.00 0.00 175.52 177.20 2wbl h GLN 188 N 0.00 0.30 -0.71 4.72 1.08 -1.09 -2.10 115.11 117.31 2wbl h GLN 188 Ca -0.00 -0.09 0.05 0.00 -1.45 0.00 0.00 58.65 57.16 2wbl h GLN 188 Cb 0.72 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 28.06 2wbl h GLN 188 CO 0.04 0.49 0.42 0.28 -0.95 0.00 0.00 178.83 179.11 2wbl h VAL 189 N 0.07 1.01 -0.58 -0.54 2.07 -1.25 -0.66 116.25 116.37 2wbl h VAL 189 Ca 0.05 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2wbl h VAL 189 Cb 0.35 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2wbl h VAL 189 CO 0.01 0.14 0.39 -0.61 0.02 0.00 0.00 177.57 177.51 2wbl h GLN 190 N 0.77 0.74 -0.19 1.57 4.15 -0.99 -1.52 115.11 119.65 2wbl h GLN 190 Ca 0.31 -0.04 -0.19 0.00 0.77 0.00 0.00 58.65 59.49 2wbl h GLN 190 Cb 0.15 -0.17 0.01 0.00 0.21 0.00 0.00 27.48 27.68 2wbl h GLN 190 CO -0.16 0.49 -0.63 0.87 -1.93 0.00 0.00 178.83 177.47 2wbl h LYS 191 N 0.76 0.76 -0.82 1.69 1.57 -0.67 -1.81 116.57 118.05 2wbl h LYS 191 Ca 0.22 -0.57 0.02 0.00 -1.87 0.00 0.00 60.65 58.45 2wbl h LYS 191 Cb -0.05 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 2wbl h LYS 191 CO -0.05 1.18 0.53 0.00 -0.57 0.00 0.00 179.45 180.54 2wbl h ALA 192 N 0.58 1.06 -0.10 3.86 0.00 -0.58 0.81 119.26 124.88 2wbl h ALA 192 Ca -0.03 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2wbl h ALA 192 Cb 1.26 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2wbl h ALA 192 CO 0.13 0.39 -0.28 0.00 0.00 0.00 0.00 179.25 179.49 2wbl h ALA 193 N 1.32 0.17 -0.91 0.00 0.00 -1.34 -2.43 119.26 116.07 2wbl h ALA 193 Ca 0.31 -0.41 0.10 0.00 0.00 0.00 0.00 54.91 54.91 2wbl h ALA 193 Cb -0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 2wbl h ALA 193 CO -0.09 0.19 0.59 1.98 0.00 0.00 0.00 179.25 181.91 2wbl h MET 194 N -0.07 0.88 0.04 0.00 -1.53 -0.97 0.23 114.93 113.51 2wbl h MET 194 Ca -0.01 -0.05 -0.00 0.00 -3.44 0.00 0.00 59.70 56.20 2wbl h MET 194 Cb 0.89 -0.20 0.00 0.00 -0.55 0.00 0.00 31.60 31.75 2wbl h MET 194 CO 0.06 0.58 -0.02 0.00 0.14 0.00 0.00 176.91 177.68 2wbl h ALA 195 N 1.55 -0.05 -0.64 0.39 0.00 -0.82 0.14 119.26 119.82 2wbl h ALA 195 Ca 0.43 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2wbl h ALA 195 Cb 0.42 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2wbl h ALA 195 CO -0.19 -0.30 0.35 0.82 0.00 0.00 0.00 179.25 179.92 2wbl h ILE 196 N -0.50 0.95 0.33 0.00 2.04 -0.90 0.13 117.51 119.56 2wbl h ILE 196 Ca -0.01 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 2wbl h ILE 196 Cb 0.46 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2wbl h ILE 196 CO 0.01 0.12 -0.29 -1.13 0.00 0.00 0.00 178.15 176.85 2wbl h ASN 197 N 0.64 -0.77 -0.33 1.72 -0.73 -0.55 -1.63 115.58 113.94 2wbl h ASN 197 Ca 0.29 0.06 0.04 0.00 1.87 0.00 0.00 56.30 58.57 2wbl h ASN 197 Cb 0.19 0.26 -0.02 0.00 0.27 0.00 0.00 38.32 39.02 2wbl h ASN 197 CO -0.19 -0.43 0.22 0.00 -0.37 0.00 0.00 177.43 176.67 2wbl h ALA 198 N -0.08 1.97 0.28 1.57 0.00 0.12 -2.02 119.26 121.10 2wbl h ALA 198 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2wbl h ALA 198 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2wbl h ALA 198 CO -0.03 -0.02 -0.13 0.37 0.00 0.00 0.00 179.25 179.43 2wbl h GLN 199 N 0.27 -0.36 -0.54 0.00 5.75 -0.58 -2.65 115.11 117.00 2wbl h GLN 199 Ca 0.14 0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.70 2wbl h GLN 199 Cb 0.22 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 2wbl h GLN 199 CO -0.03 -0.02 0.36 -0.24 -2.65 0.00 0.00 178.83 176.25 2wbl h VAL 200 N -0.92 1.04 0.00 2.39 3.04 -1.12 -0.44 116.25 120.23 2wbl h VAL 200 Ca -0.04 -0.20 -0.05 0.00 -1.01 0.00 0.00 66.70 65.40 2wbl h VAL 200 Cb 0.50 0.41 -0.01 0.00 -2.01 0.00 0.00 31.29 30.19 2wbl h VAL 200 CO 0.06 0.11 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.40 2wbl h LEU 201 N 0.58 0.00 -0.39 3.16 3.38 -1.36 -1.63 115.31 119.05 2wbl h LEU 201 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2wbl h LEU 201 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2wbl h LEU 201 CO -0.06 0.25 -0.03 -1.54 0.09 0.00 0.00 178.44 177.16 2wbl n SER 202 N -4.21 0.63 -0.05 -0.43 3.41 -0.19 -3.30 113.62 109.48 2wbl n SER 202 Ca -0.02 -1.07 0.04 0.00 -0.26 0.00 0.00 58.87 57.56 2wbl n SER 202 Cb 0.31 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.20 2wbl n SER 202 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wbl n GLU 203 N -0.59 3.67 -2.75 4.33 1.02 -0.65 -5.01 120.64 120.68 2wbl n GLU 203 Ca 0.20 -0.14 -0.35 0.00 -0.02 0.00 0.00 57.16 56.85 2wbl n GLU 203 Cb 0.23 -0.94 -0.06 0.00 -0.02 0.00 0.00 31.44 30.65 2wbl n GLU 203 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2wbl s MET 204 N -1.68 4.36 0.21 3.49 -1.94 -0.98 -4.99 119.30 117.77 2wbl s MET 204 Ca 0.04 1.29 -0.31 0.00 -1.71 0.00 0.00 55.69 55.01 2wbl s MET 204 Cb 0.07 -2.52 -0.10 0.00 2.01 0.00 0.00 34.83 34.29 2wbl s MET 204 CO 0.32 0.08 1.48 -2.00 -0.01 0.00 0.00 175.02 174.89 2wbl s GLU 205 N -2.56 4.25 -0.21 2.03 2.12 -1.26 -4.97 118.70 118.11 2wbl s GLU 205 Ca 0.56 2.30 -0.29 0.00 0.36 0.00 0.00 54.97 57.90 2wbl s GLU 205 Cb -0.16 -3.14 -0.02 0.00 0.26 0.00 0.00 34.13 31.08 2wbl s GLU 205 CO 0.21 -0.48 1.43 0.42 -0.54 0.00 0.00 175.26 176.29 2wbl s ILE 206 N 0.47 3.97 0.48 -3.70 1.01 -1.26 -4.75 121.20 117.42 2wbl s ILE 206 Ca 0.63 1.13 -0.21 0.00 0.00 0.00 0.00 60.65 62.21 2wbl s ILE 206 Cb -0.42 -3.89 -0.08 0.00 0.01 0.00 0.00 42.46 38.08 2wbl s ILE 206 CO 0.38 -0.28 1.05 -2.84 0.00 0.00 0.00 174.94 173.25 2wbl s PRO 207 N 4.13 3.80 0.23 2.79 0.02 -1.26 -4.91 135.00 139.80 2wbl s PRO 207 Ca 0.63 1.41 -0.06 0.00 0.02 0.00 0.00 61.00 63.00 2wbl s PRO 207 Cb -0.23 -2.14 0.36 0.00 0.02 0.00 0.00 34.50 32.51 2wbl s PRO 207 CO 0.23 -0.44 1.79 1.05 -0.33 0.00 0.00 177.00 179.31 2wbl h GLU 208 N 1.65 0.67 -0.83 5.54 9.09 -1.98 -1.67 114.58 127.05 2wbl h GLU 208 Ca -0.49 -0.04 0.08 0.00 0.05 0.00 0.00 59.36 58.95 2wbl h GLU 208 Cb 1.22 -0.15 -0.07 0.00 -1.65 0.00 0.00 28.75 28.11 2wbl h GLU 208 CO 0.59 0.45 0.49 0.66 0.05 0.00 0.00 179.01 181.25 2wbl h SER 209 N 0.69 0.74 0.02 3.06 4.64 -1.98 -0.88 113.55 119.84 2wbl h SER 209 Ca 0.37 0.03 0.02 0.00 -0.47 0.00 0.00 61.79 61.75 2wbl h SER 209 Cb 0.36 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.30 2wbl h SER 209 CO -0.26 0.45 -0.18 0.22 -0.87 0.00 0.00 176.83 176.19 2wbl h TYR 210 N 0.87 -0.48 -0.17 4.77 3.20 -1.68 -2.09 116.97 121.39 2wbl h TYR 210 Ca 0.38 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.32 2wbl h TYR 210 Cb 0.27 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 2wbl h TYR 210 CO -0.05 -0.26 0.15 0.82 -1.64 0.00 0.00 178.16 177.17 2wbl h ILE 211 N -0.31 0.71 0.00 1.81 2.04 -1.11 0.45 117.51 121.11 2wbl h ILE 211 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 2wbl h ILE 211 Cb 0.37 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2wbl h ILE 211 CO -0.16 0.00 0.00 0.47 0.00 0.00 0.00 178.15 178.46 2wbl n ASP 212 N -4.18 0.00 -0.01 1.72 8.00 -0.43 -3.33 116.55 118.33 2wbl n ASP 212 Ca 0.01 -0.04 0.09 0.00 0.71 0.00 0.00 54.79 55.57 2wbl n ASP 212 Cb 0.27 -0.31 -0.13 0.00 -0.02 0.00 0.00 41.12 40.93 2wbl n ASP 212 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2wbl n SER 213 N -1.31 0.76 -4.69 -2.24 3.41 0.13 -4.98 113.62 104.70 2wbl n SER 213 Ca 0.12 -0.23 -0.44 0.00 -0.26 0.00 0.00 58.87 58.06 2wbl n SER 213 Cb 0.22 1.64 -0.04 0.00 -0.26 0.00 0.00 64.21 65.78 2wbl n SER 213 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wbl n LEU 214 N -1.97 3.64 -4.60 1.04 4.32 -1.13 -5.00 117.00 113.30 2wbl n LEU 214 Ca -0.02 1.05 -0.29 0.00 -0.02 0.00 0.00 56.01 56.73 2wbl n LEU 214 Cb 0.44 -1.50 0.20 0.00 -1.62 0.00 0.00 43.42 40.94 2wbl n LEU 214 CO 0.39 -0.01 0.59 -2.16 -1.22 0.00 0.00 177.39 174.98 2wbl s PRO 215 N 1.59 -0.07 0.12 3.23 0.04 -1.26 -4.97 135.00 133.68 2wbl s PRO 215 Ca 0.79 0.69 -0.19 0.00 0.04 0.00 0.00 61.00 62.34 2wbl s PRO 215 Cb -0.58 -1.66 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 2wbl s PRO 215 CO 0.37 -3.11 1.73 1.57 0.04 0.00 0.00 177.00 177.60 2wbl h LYS 216 N -2.18 0.36 -5.14 4.56 -0.00 -1.94 -3.47 116.57 108.77 2wbl h LYS 216 Ca -0.57 -0.04 -0.38 0.00 -0.00 0.00 0.00 60.65 59.66 2wbl h LYS 216 Cb 1.33 -0.07 -0.14 0.00 -0.00 0.00 0.00 32.23 33.34 2wbl h LYS 216 CO 0.54 0.31 -0.67 -0.80 -0.00 0.00 0.00 179.45 178.82 2wbl s ASN 217 N -5.53 1.93 0.17 7.07 0.01 -1.26 -5.01 114.94 112.31 2wbl s ASN 217 Ca -0.13 -1.16 -0.17 0.00 -0.71 0.00 0.00 52.86 50.69 2wbl s ASN 217 Cb 0.09 -0.02 0.10 0.00 0.41 0.00 0.00 41.25 41.83 2wbl s ASN 217 CO 0.71 -0.44 1.68 1.23 -1.51 0.00 0.00 177.10 178.76 2wbl h GLY 218 N 2.53 0.33 0.80 0.66 0.00 -1.92 -1.74 103.07 103.73 2wbl h GLY 218 Ca -0.38 0.11 0.04 0.00 0.00 0.00 0.00 47.33 47.10 2wbl h GLY 218 CO 0.64 -0.14 0.37 0.07 0.00 0.00 0.00 176.54 177.48 2wbl h ARG 219 N 0.03 0.69 -0.89 4.80 -0.00 -1.97 -2.75 114.38 114.29 2wbl h ARG 219 Ca 0.20 -0.04 0.17 0.00 -0.00 0.00 0.00 59.98 60.31 2wbl h ARG 219 Cb 0.30 -0.15 -0.07 0.00 -0.00 0.00 0.00 29.97 30.04 2wbl h ARG 219 CO -0.39 0.45 0.58 0.00 -0.00 0.00 0.00 179.97 180.61 2wbl h ALA 220 N 1.29 2.00 0.16 0.08 0.00 -1.72 -2.54 119.26 118.53 2wbl h ALA 220 Ca 0.26 0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.90 2wbl h ALA 220 Cb 0.08 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2wbl h ALA 220 CO -0.13 -0.26 -1.30 0.66 0.00 0.00 0.00 179.25 178.21 2wbl h SER 221 N 0.56 0.55 0.21 0.00 4.64 -1.15 -3.43 113.55 114.93 2wbl h SER 221 Ca 0.46 -0.58 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 2wbl h SER 221 Cb 0.93 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2wbl h SER 221 CO -0.20 1.45 -0.10 -0.07 -0.87 0.00 0.00 176.83 177.04 2wbl h LEU 222 N 0.10 -0.24 0.00 5.97 4.07 -1.29 -3.46 115.31 120.46 2wbl h LEU 222 Ca -0.17 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.68 2wbl h LEU 222 Cb 2.02 0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.82 2wbl h LEU 222 CO 0.22 0.26 0.00 0.61 -1.08 0.00 0.00 178.44 178.46 2wbl n GLY 223 N 0.92 2.31 0.00 0.83 0.00 -1.23 -4.74 105.19 103.29 2wbl n GLY 223 Ca -0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 46.02 45.90 2wbl n GLY 223 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wbl n ASP 224 N 0.00 -0.01 0.31 1.61 9.92 -1.24 -1.11 116.55 126.03 2wbl n ASP 224 Ca 0.00 0.02 -0.12 0.00 -0.53 0.00 0.00 54.79 54.15 2wbl n ASP 224 Cb 0.00 -0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 2wbl n ASP 224 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2wbl h SER 225 N 0.00 -0.67 -0.85 -2.24 0.87 -1.95 -2.41 113.55 106.30 2wbl h SER 225 Ca 0.00 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.66 2wbl h SER 225 Cb 0.00 0.17 -0.07 0.00 -0.44 0.00 0.00 62.40 62.07 2wbl h SER 225 CO -0.01 -0.48 0.51 0.40 -0.53 0.00 0.00 176.83 176.73 2wbl h ILE 226 N -0.80 0.98 -0.53 2.23 2.04 -1.45 -2.77 117.51 117.20 2wbl h ILE 226 Ca -0.08 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2wbl h ILE 226 Cb 0.61 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2wbl h ILE 226 CO 0.13 0.16 0.31 0.22 0.00 0.00 0.00 178.15 178.97 2wbl h TYR 227 N 0.89 0.71 -0.24 1.37 3.20 -1.15 -1.99 116.97 119.75 2wbl h TYR 227 Ca 0.39 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.31 2wbl h TYR 227 Cb 0.27 -0.23 -0.07 0.00 1.54 0.00 0.00 36.73 38.23 2wbl h TYR 227 CO -0.04 0.50 -0.29 0.87 -1.64 0.00 0.00 178.16 177.55 2wbl h LYS 228 N 0.71 -0.29 -0.22 1.82 1.57 -1.16 -2.19 116.57 116.81 2wbl h LYS 228 Ca 0.19 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2wbl h LYS 228 Cb 0.01 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.32 2wbl h LYS 228 CO -0.03 -0.20 -0.54 0.77 -0.57 0.00 0.00 179.45 178.88 2wbl h SER 229 N -0.30 -1.76 -0.79 0.86 0.02 -1.19 -1.56 113.55 108.82 2wbl h SER 229 Ca 0.13 0.22 0.12 0.00 -0.84 0.00 0.00 61.79 61.41 2wbl h SER 229 Cb 0.51 0.70 -0.06 0.00 0.14 0.00 0.00 62.40 63.69 2wbl h SER 229 CO -0.42 -0.46 0.52 0.40 -1.14 0.00 0.00 176.83 175.73 2wbl h ILE 230 N -0.53 0.89 -0.36 3.27 2.04 -1.32 -2.85 117.51 118.66 2wbl h ILE 230 Ca 0.05 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2wbl h ILE 230 Cb 0.66 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 2wbl h ILE 230 CO -0.48 0.12 0.00 0.35 0.00 0.00 0.00 178.15 178.13 2wbl n THR 231 N -4.51 0.47 -0.74 -0.27 -2.24 -0.64 -4.89 114.28 101.46 2wbl n THR 231 Ca 0.14 -0.59 -0.29 0.00 -2.27 0.00 0.00 64.05 61.04 2wbl n THR 231 Cb 0.40 0.55 0.25 0.00 -2.10 0.00 0.00 70.33 69.42 2wbl n THR 231 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wbl s GLU 232 N -1.53 -1.30 0.02 -0.78 2.02 -0.88 -4.98 118.70 111.27 2wbl s GLU 232 Ca 0.35 0.38 -0.25 0.00 0.02 0.00 0.00 54.97 55.47 2wbl s GLU 232 Cb 0.19 -1.55 -0.18 0.00 0.10 0.00 0.00 34.13 32.69 2wbl s GLU 232 CO 0.27 -3.86 1.42 1.49 0.02 0.00 0.00 175.26 174.59 2wbl h GLU 233 N -2.70 -0.04 -6.46 1.61 4.81 -1.92 -3.44 114.58 106.44 2wbl h GLU 233 Ca -0.53 0.00 -0.44 0.00 -0.13 0.00 0.00 59.36 58.26 2wbl h GLU 233 Cb 1.33 0.01 0.02 0.00 0.63 0.00 0.00 28.75 30.74 2wbl h GLU 233 CO 0.43 0.28 -0.23 1.67 -0.73 0.00 0.00 179.01 180.43 2wbl s TRP 234 N -4.91 2.47 -0.24 0.92 -2.14 -1.26 -5.14 118.94 108.63 2wbl s TRP 234 Ca -0.15 -0.49 -0.16 0.00 2.66 0.00 0.00 56.10 57.97 2wbl s TRP 234 Cb 0.03 -2.32 0.07 0.00 -3.10 0.00 0.00 33.47 28.15 2wbl s TRP 234 CO 0.66 -0.57 0.61 0.12 -2.66 0.00 0.00 176.95 175.11 2wbl s PHE 235 N -2.44 -0.87 -0.15 1.66 5.36 -1.26 -4.97 117.98 115.32 2wbl s PHE 235 Ca 0.56 1.83 -0.02 0.00 -0.96 0.00 0.00 56.93 58.33 2wbl s PHE 235 Cb -0.08 0.45 0.05 0.00 -0.34 0.00 0.00 43.02 43.10 2wbl s PHE 235 CO 0.34 -0.44 0.02 0.34 -1.46 0.00 0.00 175.22 174.02 2wbl s ASP 236 N 1.25 2.43 0.28 6.13 3.68 -1.26 -5.05 116.67 124.13 2wbl s ASP 236 Ca -0.07 -0.56 -0.03 0.00 2.13 0.00 0.00 52.55 54.02 2wbl s ASP 236 Cb -0.06 -0.54 0.37 0.00 -1.45 0.00 0.00 42.92 41.24 2wbl s ASP 236 CO -0.13 -0.27 1.89 1.55 0.13 0.00 0.00 175.17 178.35 2wbl h PRO 237 N 8.28 1.05 -0.28 4.34 0.13 -1.96 0.92 132.00 144.48 2wbl h PRO 237 Ca -0.18 -0.12 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 2wbl h PRO 237 Cb 1.12 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2wbl h PRO 237 CO 0.31 0.78 0.14 0.93 -0.23 0.00 0.00 178.00 179.94 2wbl h GLU 238 N 1.06 0.40 -0.26 0.86 3.07 -1.97 -2.17 114.58 115.57 2wbl h GLU 238 Ca 0.27 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.95 2wbl h GLU 238 Cb 0.05 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.87 2wbl h GLU 238 CO -0.04 0.37 -0.33 1.96 -1.40 0.00 0.00 179.01 179.57 2wbl h GLN 239 N 0.33 0.56 -0.73 2.33 4.20 -1.92 0.11 115.11 119.98 2wbl h GLN 239 Ca 0.10 -0.25 0.12 0.00 0.06 0.00 0.00 58.65 58.68 2wbl h GLN 239 Cb 0.09 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.78 2wbl h GLN 239 CO -0.01 0.82 0.31 0.35 -0.67 0.00 0.00 178.83 179.62 2wbl h PHE 240 N 0.47 0.54 -0.08 2.96 3.57 -0.66 0.17 116.94 123.90 2wbl h PHE 240 Ca 0.05 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.39 2wbl h PHE 240 Cb 0.81 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.42 2wbl h PHE 240 CO 0.03 0.12 -0.76 -0.07 -2.23 0.00 0.00 178.31 175.39 2wbl h LEU 241 N 0.49 0.57 -1.54 0.59 3.38 -0.93 -3.14 115.31 114.72 2wbl h LEU 241 Ca 0.38 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2wbl h LEU 241 Cb 0.53 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2wbl h LEU 241 CO -0.35 1.14 -0.18 0.00 0.09 0.00 0.00 178.44 179.14 2wbl h ALA 242 N 0.85 1.16 0.00 1.53 0.00 -0.38 -1.40 119.26 121.01 2wbl h ALA 242 Ca -0.04 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2wbl h ALA 242 Cb 1.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2wbl h ALA 242 CO 0.14 0.22 0.00 0.52 0.00 0.00 0.00 179.25 180.13 2wbl h MET 243 N 0.00 0.00 -6.45 0.00 2.86 -0.64 -3.46 114.93 107.25 2wbl h MET 243 Ca -0.00 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 57.01 2wbl h MET 243 Cb 0.53 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.05 2wbl h MET 243 CO 0.02 0.00 -0.74 -0.51 1.06 0.00 0.00 176.91 176.75 2wbl s LEU 244 N -4.73 2.87 -0.45 1.22 1.02 -0.53 -5.09 118.68 113.00 2wbl s LEU 244 Ca 0.04 -0.65 -0.27 0.00 0.02 0.00 0.00 54.13 53.28 2wbl s LEU 244 Cb 0.09 -1.55 0.03 0.00 0.02 0.00 0.00 46.19 44.78 2wbl s LEU 244 CO 0.43 0.10 1.00 -0.62 0.02 0.00 0.00 176.35 177.29 2wbl s ASP 245 N -2.87 6.58 -0.16 2.29 3.68 -1.26 -4.89 116.67 120.04 2wbl s ASP 245 Ca 0.25 0.33 0.15 0.00 2.13 0.00 0.00 52.55 55.41 2wbl s ASP 245 Cb -0.08 -2.49 0.35 0.00 -1.45 0.00 0.00 42.92 39.25 2wbl s ASP 245 CO 0.14 -1.09 1.18 0.23 0.13 0.00 0.00 175.17 175.77 2wbl n MET 246 N 7.34 1.38 0.11 4.34 2.81 -1.26 -4.69 117.12 127.15 2wbl n MET 246 Ca 0.08 -2.90 0.13 0.00 -1.81 0.00 0.00 57.70 53.20 2wbl n MET 246 Cb 0.49 -1.51 0.45 0.00 -0.71 0.00 0.00 33.22 31.93 2wbl n MET 246 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2wbl n SER 247 N -1.21 0.70 -4.15 7.83 3.41 -1.26 -4.77 113.62 114.17 2wbl n SER 247 Ca 0.17 0.60 -0.17 0.00 -0.26 0.00 0.00 58.87 59.21 2wbl n SER 247 Cb 0.68 -0.78 -0.12 0.00 -0.26 0.00 0.00 64.21 63.73 2wbl n SER 247 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2wbl s THR 248 N -3.17 0.99 0.21 6.66 -4.23 -1.26 -5.05 115.64 109.78 2wbl s THR 248 Ca 0.08 -1.30 -0.15 0.00 -1.18 0.00 0.00 61.69 59.14 2wbl s THR 248 Cb 0.12 -1.02 0.21 0.00 1.34 0.00 0.00 72.50 73.15 2wbl s THR 248 CO 0.51 -0.29 1.62 -0.33 -0.54 0.00 0.00 174.62 175.59 2wbl h GLU 249 N 4.24 -0.03 -0.51 3.99 5.08 -2.00 -2.12 114.58 123.23 2wbl h GLU 249 Ca -0.39 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.07 2wbl h GLU 249 Cb 1.19 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 2wbl h GLU 249 CO 0.42 -0.02 -0.04 0.45 -1.00 0.00 0.00 179.01 178.82 2wbl h HIS 250 N -0.03 -0.10 -0.33 4.33 3.86 -1.98 0.29 115.15 121.19 2wbl h HIS 250 Ca 0.29 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.51 2wbl h HIS 250 Cb 0.48 0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 2wbl h HIS 250 CO -0.53 -0.15 0.09 0.87 0.86 0.00 0.00 177.93 179.07 2wbl h LYS 251 N 0.08 0.53 -0.22 2.45 1.57 -1.75 0.48 116.57 119.70 2wbl h LYS 251 Ca 0.25 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2wbl h LYS 251 Cb 0.39 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2wbl h LYS 251 CO -0.46 0.58 0.13 0.28 -0.57 0.00 0.00 179.45 179.41 2wbl h VAL 252 N 0.38 1.10 -0.38 0.50 2.07 -0.96 -2.05 116.25 116.91 2wbl h VAL 252 Ca 0.11 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.42 2wbl h VAL 252 Cb 0.28 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2wbl h VAL 252 CO -0.00 0.09 0.18 0.25 0.02 0.00 0.00 177.57 178.11 2wbl h LEU 253 N 0.26 0.26 -1.83 2.57 5.85 0.02 0.40 115.31 122.85 2wbl h LEU 253 Ca 0.08 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.85 2wbl h LEU 253 Cb 0.03 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2wbl h LEU 253 CO -0.01 0.19 0.18 0.44 -0.34 0.00 0.00 178.44 178.90 2wbl h ASP 254 N 0.37 0.19 0.22 1.25 3.45 0.01 -0.75 116.42 121.16 2wbl h ASP 254 Ca 0.16 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.61 2wbl h ASP 254 Cb 0.08 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 2wbl h ASP 254 CO -0.12 0.13 -0.11 0.25 -1.57 0.00 0.00 179.24 177.82 2wbl h LEU 255 N 0.22 -0.25 -1.03 1.55 5.85 -0.49 -2.08 115.31 119.08 2wbl h LEU 255 Ca 0.11 -0.26 0.21 0.00 0.84 0.00 0.00 57.88 58.78 2wbl h LEU 255 Cb 0.18 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.17 2wbl h LEU 255 CO -0.02 0.18 0.61 0.50 -0.34 0.00 0.00 178.44 179.37 2wbl h LYS 256 N -0.76 0.65 -0.49 1.25 3.64 -0.59 0.58 116.57 120.86 2wbl h LYS 256 Ca -0.03 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 2wbl h LYS 256 Cb 0.50 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2wbl h LYS 256 CO 0.05 0.43 -0.07 -0.91 -2.27 0.00 0.00 179.45 176.69 2wbl h ASN 257 N 0.67 0.90 -0.61 4.20 2.35 -1.13 -1.19 115.58 120.78 2wbl h ASN 257 Ca 0.60 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2wbl h ASN 257 Cb 1.05 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.15 2wbl h ASN 257 CO -0.41 1.03 0.39 -0.09 -1.65 0.00 0.00 177.43 176.70 2wbl h ARG 258 N 0.76 0.81 0.05 0.81 9.65 -0.25 -1.32 114.38 124.89 2wbl h ARG 258 Ca 0.13 -0.06 -0.28 0.00 -1.10 0.00 0.00 59.98 58.68 2wbl h ARG 258 Cb 0.61 -0.18 0.02 0.00 -1.39 0.00 0.00 29.97 29.03 2wbl h ARG 258 CO 0.04 0.55 -1.12 0.82 2.80 0.00 0.00 179.97 183.05 2wbl h ILE 259 N 0.82 1.30 -0.32 1.20 2.04 -0.85 -2.49 117.51 119.20 2wbl h ILE 259 Ca 0.22 -2.39 -0.10 0.00 1.00 0.00 0.00 64.86 63.59 2wbl h ILE 259 Cb -0.07 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 2wbl h ILE 259 CO -0.05 0.73 -0.22 -0.33 0.00 0.00 0.00 178.15 178.28 2wbl h GLU 260 N 0.32 0.62 -0.26 2.37 5.08 -1.16 0.93 114.58 122.48 2wbl h GLU 260 Ca -0.15 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2wbl h GLU 260 Cb 1.79 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.99 2wbl h GLU 260 CO 0.21 0.80 0.17 0.00 -1.00 0.00 0.00 179.01 179.19 2wbl h ALA 261 N 1.21 0.33 -0.69 3.43 0.00 -1.25 -1.75 119.26 120.54 2wbl h ALA 261 Ca 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2wbl h ALA 261 Cb 0.68 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2wbl h ALA 261 CO 0.05 -0.19 0.19 0.66 0.00 0.00 0.00 179.25 179.95 2wbl h SER 262 N 0.34 1.02 -0.14 0.00 4.64 -1.03 -1.20 113.55 117.19 2wbl h SER 262 Ca 0.09 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2wbl h SER 262 Cb -0.03 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.79 2wbl h SER 262 CO -0.02 0.97 0.09 0.58 -0.87 0.00 0.00 176.83 177.58 2wbl h VAL 263 N 1.04 1.03 -0.61 0.95 2.07 -0.62 0.56 116.25 120.67 2wbl h VAL 263 Ca 0.22 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.70 2wbl h VAL 263 Cb 0.34 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2wbl h VAL 263 CO -0.00 0.03 0.39 0.58 0.02 0.00 0.00 177.57 178.59 2wbl h VAL 264 N 0.18 1.12 -0.37 2.57 2.07 -1.09 0.77 116.25 121.49 2wbl h VAL 264 Ca 0.05 -0.27 0.07 0.00 0.82 0.00 0.00 66.70 67.37 2wbl h VAL 264 Cb -0.02 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 29.96 2wbl h VAL 264 CO -0.02 0.14 0.01 0.40 0.02 0.00 0.00 177.57 178.13 2wbl h ILE 265 N 0.79 0.73 -0.03 4.57 1.08 -0.95 -2.90 117.51 120.80 2wbl h ILE 265 Ca 0.23 -0.04 -0.02 0.00 -0.39 0.00 0.00 64.86 64.65 2wbl h ILE 265 Cb -0.05 0.61 -0.00 0.00 -3.07 0.00 0.00 36.82 34.31 2wbl h ILE 265 CO -0.07 0.02 -0.05 -0.50 -0.69 0.00 0.00 178.15 176.86 2wbl h TRP 266 N 0.11 0.11 0.00 1.37 6.55 -0.03 -2.72 115.95 121.34 2wbl h TRP 266 Ca 0.18 -0.04 0.00 0.00 0.95 0.00 0.00 58.89 59.99 2wbl h TRP 266 Cb 0.25 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.53 2wbl h TRP 266 CO -0.25 0.60 0.00 1.63 -1.05 0.00 0.00 178.44 179.37 2wbl n LYS 267 N -4.76 0.07 0.00 0.49 4.01 0.26 -1.58 118.16 116.65 2wbl n LYS 267 Ca -0.08 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.72 2wbl n LYS 267 Cb 0.30 -1.15 0.00 0.00 -0.51 0.00 0.00 35.03 33.67 2wbl n LYS 267 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2wbl n ARG 268 N -0.65 1.48 0.00 1.97 0.63 -1.10 -5.03 116.66 113.96 2wbl n ARG 268 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2wbl n ARG 268 Cb 0.00 -0.93 0.00 0.00 0.45 0.00 0.00 32.46 31.98 2wbl n ARG 268 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2wbl n LYS 269 N -1.43 0.00 0.00 -0.14 5.02 -0.61 -5.10 118.16 115.90 2wbl n LYS 269 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2wbl n LYS 269 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.12 2wbl n LYS 269 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2wbl n ARG 288 N 0.00 0.00 0.20 1.97 -4.01 -1.26 -5.13 116.66 108.43 2wbl n ARG 288 Ca 0.00 0.00 0.18 0.00 -1.04 0.00 0.00 57.85 56.99 2wbl n ARG 288 Cb 0.00 0.00 0.76 0.00 -3.04 0.00 0.00 32.46 30.18 2wbl n ARG 288 CO 0.00 0.00 0.00 0.93 -3.04 0.00 0.00 177.63 175.52 2wbl h GLU 289 N 0.71 0.00 -0.07 2.89 5.08 -1.99 -2.65 114.58 118.55 2wbl h GLU 289 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2wbl h GLU 289 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2wbl h GLU 289 CO 0.00 0.00 0.01 1.25 -1.00 0.00 0.00 179.01 179.27 2wbl h LEU 290 N 0.00 0.11 -0.51 1.33 6.46 -2.02 -1.57 115.31 119.10 2wbl h LEU 290 Ca 0.11 -0.29 -0.10 0.00 -0.12 0.00 0.00 57.88 57.48 2wbl h LEU 290 Cb 0.92 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.81 2wbl h LEU 290 CO -0.00 0.37 -0.08 -0.26 -0.62 0.00 0.00 178.44 177.85 2wbl h PHE 291 N -0.15 1.07 -0.74 1.25 0.04 -1.82 -1.13 116.94 115.46 2wbl h PHE 291 Ca 0.02 -0.22 0.12 0.00 2.80 0.00 0.00 57.97 60.69 2wbl h PHE 291 Cb 0.31 -0.27 -0.05 0.00 2.20 0.00 0.00 35.95 38.14 2wbl h PHE 291 CO 0.02 1.01 0.49 1.49 -0.60 0.00 0.00 178.31 180.72 2wbl h GLU 292 N 0.83 0.51 0.18 1.51 4.81 -1.50 0.10 114.58 121.02 2wbl h GLU 292 Ca 0.14 -0.03 -0.30 0.00 -0.13 0.00 0.00 59.36 59.03 2wbl h GLU 292 Cb 0.63 -0.12 0.03 0.00 0.63 0.00 0.00 28.75 29.93 2wbl h GLU 292 CO 0.04 0.34 -1.29 0.93 -0.73 0.00 0.00 179.01 178.31 2wbl h GLU 293 N 0.53 0.56 -0.69 1.92 5.08 -0.62 -2.80 114.58 118.56 2wbl h GLU 293 Ca 0.35 -0.84 -0.06 0.00 -1.00 0.00 0.00 59.36 57.81 2wbl h GLU 293 Cb 0.64 0.29 -0.03 0.00 0.50 0.00 0.00 28.75 30.16 2wbl h GLU 293 CO -0.12 1.39 0.19 0.00 -1.00 0.00 0.00 179.01 179.47 2wbl h ARG 294 N 0.15 1.09 -0.17 2.33 3.08 -0.59 -0.70 114.38 119.57 2wbl h ARG 294 Ca -0.21 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 2wbl h ARG 294 Cb 1.98 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.87 2wbl h ARG 294 CO 0.24 0.95 0.09 0.00 -1.07 0.00 0.00 179.97 180.18 2wbl h ALA 295 N 1.09 0.21 -0.42 0.04 0.00 -0.90 -1.92 119.26 117.36 2wbl h ALA 295 Ca 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2wbl h ALA 295 Cb 0.33 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2wbl h ALA 295 CO -0.00 -0.24 0.21 0.93 0.00 0.00 0.00 179.25 180.15 2wbl h GLU 296 N 0.16 0.58 0.00 0.00 5.08 -1.27 -0.57 114.58 118.56 2wbl h GLU 296 Ca 0.06 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2wbl h GLU 296 Cb 0.09 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2wbl h GLU 296 CO -0.01 0.44 -0.19 1.79 -1.00 0.00 0.00 179.01 180.04 2wbl h THR 297 N 0.59 0.48 0.03 1.13 1.35 -0.76 -1.70 112.91 114.02 2wbl h THR 297 Ca 0.15 -1.04 -0.17 0.00 -0.55 0.00 0.00 66.41 64.80 2wbl h THR 297 Cb 0.04 1.73 0.01 0.00 -1.73 0.00 0.00 68.15 68.21 2wbl h THR 297 CO -0.02 0.19 -0.68 0.40 -0.25 0.00 0.00 175.52 175.16 2wbl h ILE 298 N 0.00 1.43 -0.39 6.82 2.04 -0.37 -2.43 117.51 124.62 2wbl h ILE 298 Ca -0.00 -2.17 -0.01 0.00 1.00 0.00 0.00 64.86 63.68 2wbl h ILE 298 Cb 0.72 2.69 -0.02 0.00 -0.74 0.00 0.00 36.82 39.46 2wbl h ILE 298 CO 0.03 0.63 0.21 -0.07 0.00 0.00 0.00 178.15 178.95 2wbl h LEU 299 N -0.11 0.47 -0.31 1.44 3.38 -1.17 0.01 115.31 119.02 2wbl h LEU 299 Ca -0.09 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2wbl h LEU 299 Cb 1.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2wbl h LEU 299 CO 0.13 0.38 0.02 0.58 0.09 0.00 0.00 178.44 179.64 2wbl h VAL 300 N 0.54 1.25 -0.52 1.22 2.07 -1.29 -2.53 116.25 116.99 2wbl h VAL 300 Ca 0.14 -0.89 -0.09 0.00 0.82 0.00 0.00 66.70 66.68 2wbl h VAL 300 Cb 0.02 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2wbl h VAL 300 CO -0.02 0.29 -0.03 -0.07 0.02 0.00 0.00 177.57 177.75 2wbl h LEU 301 N 0.34 0.88 -1.82 2.57 3.38 -1.07 -2.77 115.31 116.82 2wbl h LEU 301 Ca 0.09 -0.25 0.11 0.00 0.09 0.00 0.00 57.88 57.92 2wbl h LEU 301 Cb 0.40 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2wbl h LEU 301 CO 0.01 0.96 0.35 -0.07 0.09 0.00 0.00 178.44 179.78 2wbl h LEU 302 N 0.83 0.18 -0.30 1.67 3.38 -0.82 0.50 115.31 120.75 2wbl h LEU 302 Ca 0.15 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.93 2wbl h LEU 302 Cb 0.54 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2wbl h LEU 302 CO 0.03 0.11 -0.60 0.11 0.09 0.00 0.00 178.44 178.17 2wbl h LYS 303 N 0.20 0.81 0.07 1.13 1.57 -1.18 -1.64 116.57 117.53 2wbl h LYS 303 Ca 0.23 -0.55 -0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2wbl h LYS 303 Cb 0.66 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2wbl h LYS 303 CO -0.04 1.17 -0.04 1.96 -0.57 0.00 0.00 179.45 181.94 2wbl h GLN 304 N 0.61 -0.10 -0.25 3.15 1.08 -0.87 -2.86 115.11 115.87 2wbl h GLN 304 Ca -0.00 0.01 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 2wbl h GLN 304 Cb 1.21 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 2wbl h GLN 304 CO 0.13 0.39 -0.56 0.87 -0.95 0.00 0.00 178.83 178.71 2wbl h LYS 305 N -0.64 0.83 -2.14 1.46 1.57 -0.19 -3.35 116.57 114.11 2wbl h LYS 305 Ca -0.01 -0.55 -0.57 0.00 -1.87 0.00 0.00 60.65 57.65 2wbl h LYS 305 Cb 0.53 0.08 -0.41 0.00 0.08 0.00 0.00 32.23 32.51 2wbl h LYS 305 CO 0.02 1.18 -0.82 1.19 -0.57 0.00 0.00 179.45 180.45 2wbl n PHE 306 N -4.04 2.26 -1.99 -1.35 3.01 -0.62 -5.08 117.46 109.67 2wbl n PHE 306 Ca -0.05 -3.93 -0.34 0.00 1.01 0.00 0.00 57.45 54.15 2wbl n PHE 306 Cb 0.63 -0.47 0.02 0.00 -0.01 0.00 0.00 39.48 39.65 2wbl n PHE 306 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2wbl s PRO 307 N -2.39 3.10 0.00 -1.08 0.04 -1.08 -3.07 135.00 130.53 2wbl s PRO 307 Ca 0.41 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.87 2wbl s PRO 307 Cb 0.21 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.77 2wbl s PRO 307 CO -0.07 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.36 2wbl n GLY 308 N -0.39 0.51 3.83 0.56 0.00 -1.26 -5.04 105.19 103.39 2wbl n GLY 308 Ca 0.10 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 2wbl n GLY 308 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wbl s LEU 309 N 0.00 4.43 0.84 0.99 2.34 -1.17 -5.03 118.68 121.08 2wbl s LEU 309 Ca 0.00 1.18 -0.15 0.00 0.06 0.00 0.00 54.13 55.22 2wbl s LEU 309 Cb 0.00 -3.09 -0.02 0.00 -0.56 0.00 0.00 46.19 42.52 2wbl s LEU 309 CO 0.00 0.19 0.29 -2.65 -1.06 0.00 0.00 176.35 173.12 2wbl n PRO 310 N 1.26 0.00 -1.55 1.48 -0.02 -1.26 -4.94 135.00 129.97 2wbl n PRO 310 Ca -0.08 0.04 -0.40 0.00 -2.02 0.00 0.00 63.50 61.04 2wbl n PRO 310 Cb 0.51 -1.71 0.03 0.00 -0.02 0.00 0.00 33.50 32.31 2wbl n PRO 310 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2wbl n GLN 311 N -0.66 0.94 -2.23 -0.52 3.00 -1.26 -5.01 117.38 111.64 2wbl n GLN 311 Ca 0.07 0.35 -0.26 0.00 -0.01 0.00 0.00 57.00 57.15 2wbl n GLN 311 Cb 0.52 -1.91 0.06 0.00 0.00 0.00 0.00 30.24 28.91 2wbl n GLN 311 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2wbl s SER 312 N -0.98 5.00 0.22 1.08 1.04 -1.26 -4.85 113.70 113.95 2wbl s SER 312 Ca 0.67 0.53 -0.09 0.00 0.48 0.00 0.00 55.95 57.54 2wbl s SER 312 Cb -0.51 -1.25 0.33 0.00 0.10 0.00 0.00 66.02 64.69 2wbl s SER 312 CO 0.54 -1.48 1.69 0.28 0.98 0.00 0.00 173.24 175.26 2wbl h SER 313 N -0.51 -0.03 -0.23 7.02 0.02 -1.95 -0.06 113.55 117.81 2wbl h SER 313 Ca -0.45 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2wbl h SER 313 Cb 1.30 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 64.01 2wbl h SER 313 CO 0.60 -0.02 0.15 0.25 -1.14 0.00 0.00 176.83 176.67 2wbl h LEU 314 N 0.24 0.27 0.12 5.07 7.12 -1.95 0.20 115.31 126.38 2wbl h LEU 314 Ca 0.34 -0.02 0.02 0.00 0.13 0.00 0.00 57.88 58.35 2wbl h LEU 314 Cb 0.53 -0.07 -0.04 0.00 -0.53 0.00 0.00 40.66 40.55 2wbl h LEU 314 CO -0.45 0.21 -0.36 0.44 -0.13 0.00 0.00 178.44 178.16 2wbl h ASP 315 N 0.30 -1.03 -0.89 1.25 3.32 -1.69 -0.48 116.42 117.19 2wbl h ASP 315 Ca 0.08 0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.32 2wbl h ASP 315 Cb -0.01 0.39 -0.06 0.00 0.22 0.00 0.00 39.33 39.87 2wbl h ASP 315 CO -0.02 -0.44 0.58 0.40 -1.72 0.00 0.00 179.24 178.04 2wbl h ILE 316 N -0.59 1.06 -0.53 0.35 2.04 -0.78 -1.57 117.51 117.49 2wbl h ILE 316 Ca 0.03 -0.34 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 2wbl h ILE 316 Cb 0.62 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2wbl h ILE 316 CO -0.21 0.18 -0.10 -1.28 0.00 0.00 0.00 178.15 176.74 2wbl h SER 317 N 1.00 1.01 -0.14 1.72 0.87 -0.26 -1.08 113.55 116.66 2wbl h SER 317 Ca 0.38 -0.35 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 2wbl h SER 317 Cb 0.21 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 2wbl h SER 317 CO -0.14 1.12 0.07 0.11 -0.53 0.00 0.00 176.83 177.46 2wbl h LYS 318 N 0.88 0.14 -0.48 2.24 1.57 -0.28 -2.84 116.57 117.80 2wbl h LYS 318 Ca 0.14 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.83 2wbl h LYS 318 Cb 0.67 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 2wbl h LYS 318 CO 0.05 0.09 -0.01 0.82 -0.57 0.00 0.00 179.45 179.83 2wbl h ILE 319 N 0.14 1.26 -0.47 1.86 2.04 -1.13 -2.56 117.51 118.65 2wbl h ILE 319 Ca 0.06 -1.08 0.09 0.00 1.00 0.00 0.00 64.86 64.93 2wbl h ILE 319 Cb 0.01 1.01 -0.08 0.00 -0.74 0.00 0.00 36.82 37.02 2wbl h ILE 319 CO -0.04 0.38 -0.05 -0.61 0.00 0.00 0.00 178.15 177.83 2wbl h GLN 320 N 0.71 0.06 -0.47 2.37 4.15 -1.09 -3.14 115.11 117.70 2wbl h GLN 320 Ca 0.13 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.55 2wbl h GLN 320 Cb 0.52 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.20 2wbl h GLN 320 CO 0.03 0.04 0.00 1.19 -1.93 0.00 0.00 178.83 178.16 2wbl n PHE 321 N -5.28 1.16 -2.79 3.99 3.01 -1.08 -4.97 117.46 111.50 2wbl n PHE 321 Ca 0.04 -0.67 -0.42 0.00 1.01 0.00 0.00 57.45 57.41 2wbl n PHE 321 Cb 0.26 -0.24 -0.03 0.00 -0.01 0.00 0.00 39.48 39.45 2wbl n PHE 321 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2wbl s ASN 322 N -1.21 6.88 0.21 4.37 2.47 -0.98 -4.90 114.94 121.78 2wbl s ASN 322 Ca 0.43 1.05 0.23 0.00 0.42 0.00 0.00 52.86 54.99 2wbl s ASN 322 Cb 0.30 -2.48 0.21 0.00 -1.45 0.00 0.00 41.25 37.83 2wbl s ASN 322 CO 0.18 -0.65 1.26 0.11 -3.72 0.00 0.00 177.10 174.28 2wbl h LYS 323 N 7.80 0.00 -6.27 0.43 1.79 -1.92 -3.39 116.57 115.01 2wbl h LYS 323 Ca -0.22 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.70 2wbl h LYS 323 Cb 1.08 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.69 2wbl h LYS 323 CO 0.93 0.00 1.23 0.34 -1.08 0.00 0.00 179.45 180.87 2wbl s ASP 324 N -5.06 5.86 0.17 0.86 -1.08 -1.26 -4.32 116.67 111.84 2wbl s ASP 324 Ca 0.04 0.79 -0.14 0.00 -0.52 0.00 0.00 52.55 52.71 2wbl s ASP 324 Cb 0.10 -2.53 0.11 0.00 -1.46 0.00 0.00 42.92 39.14 2wbl s ASP 324 CO 0.74 -1.83 1.79 0.58 0.52 0.00 0.00 175.17 176.97 2wbl h VAL 325 N 6.69 0.97 -0.47 1.11 2.07 -1.92 -0.03 116.25 124.66 2wbl h VAL 325 Ca -0.29 -0.16 0.09 0.00 0.82 0.00 0.00 66.70 67.15 2wbl h VAL 325 Cb 1.14 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 31.28 2wbl h VAL 325 CO 1.12 0.09 -0.00 1.23 0.02 0.00 0.00 177.57 180.02 2wbl h GLY 326 N 0.48 0.48 1.42 2.17 0.00 -1.95 -1.03 103.07 104.64 2wbl h GLY 326 Ca 0.20 0.06 -0.19 0.00 0.00 0.00 0.00 47.33 47.41 2wbl h GLY 326 CO -0.14 -0.13 -0.68 1.46 0.00 0.00 0.00 176.54 177.05 2wbl h GLN 327 N 0.11 0.58 -0.10 4.80 4.20 -1.88 -1.04 115.11 121.80 2wbl h GLN 327 Ca 0.24 -0.43 0.03 0.00 0.06 0.00 0.00 58.65 58.54 2wbl h GLN 327 Cb 0.35 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 2wbl h GLN 327 CO -0.40 1.06 -0.09 0.00 -0.67 0.00 0.00 178.83 178.73 2wbl h ALA 328 N 0.83 -0.01 -0.71 3.87 0.00 -0.48 0.17 119.26 122.93 2wbl h ALA 328 Ca -0.02 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2wbl h ALA 328 Cb 1.26 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 2wbl h ALA 328 CO 0.13 -0.55 0.36 0.28 0.00 0.00 0.00 179.25 179.47 2wbl h VAL 329 N -0.11 1.23 -0.16 0.00 2.07 -1.16 -2.06 116.25 116.06 2wbl h VAL 329 Ca 0.07 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2wbl h VAL 329 Cb 0.21 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2wbl h VAL 329 CO -0.16 0.26 0.10 -0.07 0.02 0.00 0.00 177.57 177.72 2wbl h LEU 330 N 0.99 0.16 -0.22 2.57 3.38 -0.56 -1.65 115.31 119.98 2wbl h LEU 330 Ca 0.25 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 2wbl h LEU 330 Cb 0.09 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2wbl h LEU 330 CO -0.03 0.12 -0.05 -0.08 0.09 0.00 0.00 178.44 178.48 2wbl h GLU 331 N 0.20 0.42 -0.20 1.13 4.22 -0.61 -2.38 114.58 117.35 2wbl h GLU 331 Ca 0.06 -0.16 -0.19 0.00 0.08 0.00 0.00 59.36 59.15 2wbl h GLU 331 Cb -0.02 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2wbl h GLU 331 CO -0.02 0.66 -0.63 0.66 -2.18 0.00 0.00 179.01 177.50 2wbl h SER 332 N 0.15 0.83 -0.04 1.04 4.64 -1.40 -0.54 113.55 118.23 2wbl h SER 332 Ca 0.06 -0.48 -0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2wbl h SER 332 Cb 0.50 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2wbl h SER 332 CO 0.02 1.25 0.00 0.22 -0.87 0.00 0.00 176.83 177.46 2wbl h TYR 333 N 0.53 0.07 -0.54 4.77 3.20 -1.35 -0.12 116.97 123.53 2wbl h TYR 333 Ca -0.01 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.91 2wbl h TYR 333 Cb 1.23 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.43 2wbl h TYR 333 CO 0.07 0.33 0.25 0.66 -1.64 0.00 0.00 178.16 177.83 2wbl h SER 334 N -0.22 0.34 -0.12 -2.11 4.64 -1.45 -0.99 113.55 113.64 2wbl h SER 334 Ca 0.01 0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.41 2wbl h SER 334 Cb 0.30 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.34 2wbl h SER 334 CO 0.00 0.23 -0.10 -0.09 -0.87 0.00 0.00 176.83 175.99 2wbl h ARG 335 N 0.48 -0.12 -0.13 4.77 2.43 -0.76 0.99 114.38 122.05 2wbl h ARG 335 Ca 0.25 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 2wbl h ARG 335 Cb 0.20 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2wbl h ARG 335 CO -0.20 -0.08 -0.43 -0.84 -1.51 0.00 0.00 179.97 176.91 2wbl h ILE 336 N -0.12 1.32 -0.61 1.20 -0.00 -0.79 -1.94 117.51 116.57 2wbl h ILE 336 Ca 0.08 -1.58 -0.07 0.00 -0.00 0.00 0.00 64.86 63.29 2wbl h ILE 336 Cb 0.24 1.69 -0.02 0.00 -0.00 0.00 0.00 36.82 38.73 2wbl h ILE 336 CO -0.19 0.48 0.11 -0.07 -0.00 0.00 0.00 178.15 178.47 2wbl h LEU 337 N 0.25 0.96 -1.12 0.16 3.38 -0.85 0.16 115.31 118.25 2wbl h LEU 337 Ca 0.02 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.80 2wbl h LEU 337 Cb 0.86 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 2wbl h LEU 337 CO 0.07 0.97 0.60 -0.08 0.09 0.00 0.00 178.44 180.09 2wbl h GLU 338 N 0.91 1.04 0.00 1.13 4.81 -0.56 -1.64 114.58 120.27 2wbl h GLU 338 Ca 0.19 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.12 2wbl h GLU 338 Cb 0.41 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 2wbl h GLU 338 CO 0.01 0.69 -1.24 0.66 -0.73 0.00 0.00 179.01 178.39 2wbl h SER 339 N 1.07 0.00 -0.41 1.04 4.64 -0.73 -2.23 113.55 116.92 2wbl h SER 339 Ca 0.39 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.62 2wbl h SER 339 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 2wbl h SER 339 CO -0.15 0.98 -0.08 0.25 -0.87 0.00 0.00 176.83 176.97 2wbl h LEU 340 N 0.00 0.84 -0.24 5.97 5.85 -0.63 -2.24 115.31 124.86 2wbl h LEU 340 Ca -0.11 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.39 2wbl h LEU 340 Cb 1.84 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.63 2wbl h LEU 340 CO 0.11 0.95 0.09 0.00 -0.34 0.00 0.00 178.44 179.25 2wbl h ALA 341 N 1.13 0.27 -0.81 1.25 0.00 -1.20 -1.47 119.26 118.44 2wbl h ALA 341 Ca 0.13 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2wbl h ALA 341 Cb 0.58 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2wbl h ALA 341 CO 0.04 -0.32 0.49 -0.92 0.00 0.00 0.00 179.25 178.54 2wbl h TYR 342 N 0.21 0.91 0.50 0.00 3.20 -1.28 -0.24 116.97 120.27 2wbl h TYR 342 Ca 0.10 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 2wbl h TYR 342 Cb 0.06 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2wbl h TYR 342 CO -0.11 0.47 -0.37 1.15 -1.64 0.00 0.00 178.16 177.65 2wbl h THR 343 N 0.91 0.25 -1.01 1.81 2.02 -0.93 0.25 112.91 116.20 2wbl h THR 343 Ca 0.35 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.59 2wbl h THR 343 Cb 0.15 0.25 -0.07 0.00 -1.74 0.00 0.00 68.15 66.75 2wbl h THR 343 CO -0.17 0.00 0.65 0.58 0.37 0.00 0.00 175.52 176.96 2wbl h VAL 344 N -0.85 1.11 -0.72 3.16 2.07 -1.02 0.11 116.25 120.10 2wbl h VAL 344 Ca -0.05 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.10 2wbl h VAL 344 Cb 0.72 -0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2wbl h VAL 344 CO 0.01 0.22 0.43 -0.03 0.02 0.00 0.00 177.57 178.23 2wbl h MET 345 N 1.20 0.79 -0.28 1.57 -1.53 -0.64 -1.50 114.93 114.55 2wbl h MET 345 Ca 0.43 -0.05 -0.13 0.00 -3.44 0.00 0.00 59.70 56.51 2wbl h MET 345 Cb 0.12 -0.18 -0.00 0.00 -0.55 0.00 0.00 31.60 30.99 2wbl h MET 345 CO -0.16 0.52 -0.33 0.77 0.14 0.00 0.00 176.91 177.85 2wbl h SER 346 N 0.82 0.78 -0.25 1.39 0.02 0.11 -1.42 113.55 114.99 2wbl h SER 346 Ca 0.31 -0.49 0.06 0.00 -0.84 0.00 0.00 61.79 60.83 2wbl h SER 346 Cb 0.12 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.37 2wbl h SER 346 CO -0.15 1.11 -0.18 0.03 -1.14 0.00 0.00 176.83 176.50 2wbl h ARG 347 N 0.47 -0.16 -0.33 3.45 2.47 -0.59 0.53 114.38 120.23 2wbl h ARG 347 Ca 0.04 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.81 2wbl h ARG 347 Cb 0.91 0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 29.23 2wbl h ARG 347 CO 0.08 -0.11 0.09 0.82 0.56 0.00 0.00 179.97 181.42 2wbl h ILE 348 N -0.17 0.88 -0.09 2.04 2.04 -1.19 -2.77 117.51 118.24 2wbl h ILE 348 Ca 0.14 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 2wbl h ILE 348 Cb 0.38 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2wbl h ILE 348 CO -0.35 0.04 -0.18 -0.33 0.00 0.00 0.00 178.15 177.33 2wbl h GLU 349 N 0.22 0.15 -0.25 2.37 3.07 -0.46 -1.49 114.58 118.19 2wbl h GLU 349 Ca 0.15 -0.04 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 2wbl h GLU 349 Cb 0.14 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 2wbl h GLU 349 CO -0.17 0.33 -0.21 -0.44 -1.40 0.00 0.00 179.01 177.12 2wbl h ASP 350 N 0.14 0.46 -0.03 1.42 3.32 -0.65 0.22 116.42 121.30 2wbl h ASP 350 Ca 0.03 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2wbl h ASP 350 Cb 0.40 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2wbl h ASP 350 CO 0.03 0.68 -0.03 0.58 -1.72 0.00 0.00 179.24 178.78 2wbl h VAL 351 N 0.42 1.38 0.00 -1.35 2.07 -1.13 -2.18 116.25 115.45 2wbl h VAL 351 Ca 0.07 -1.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 2wbl h VAL 351 Cb 0.61 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 2wbl h VAL 351 CO 0.04 0.31 -0.20 -0.07 0.02 0.00 0.00 177.57 177.68 2wbl h LEU 352 N -0.38 0.00 0.03 2.57 3.38 -1.14 0.84 115.31 120.60 2wbl h LEU 352 Ca 0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.77 2wbl h LEU 352 Cb 0.52 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.29 2wbl h LEU 352 CO 0.01 0.20 -0.84 0.22 0.09 0.00 0.00 178.44 178.11 2wbl h TYR 353 N 0.00 0.78 0.00 1.13 3.20 -0.96 -2.50 116.97 118.62 2wbl h TYR 353 Ca -0.00 -0.45 -0.09 0.00 3.14 0.00 0.00 58.73 61.33 2wbl h TYR 353 Cb 0.40 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 2wbl h TYR 353 CO 0.00 1.29 -0.42 1.79 -1.64 0.00 0.00 178.16 179.18 2wbl h THR 354 N 0.06 0.87 -0.67 1.81 1.35 -1.05 -2.21 112.91 113.08 2wbl h THR 354 Ca -0.11 -1.76 -0.01 0.00 -0.55 0.00 0.00 66.41 63.98 2wbl h THR 354 Cb 1.54 2.09 -0.03 0.00 -1.73 0.00 0.00 68.15 70.02 2wbl h THR 354 CO 0.16 0.41 0.38 -0.78 -0.25 0.00 0.00 175.52 175.45 2wbl h ASP 355 N 0.00 0.82 -0.11 5.36 -0.00 -0.90 -0.92 116.42 120.66 2wbl h ASP 355 Ca -0.00 -0.08 0.03 0.00 -0.00 0.00 0.00 57.03 56.98 2wbl h ASP 355 Cb 1.06 -0.21 -0.04 0.00 -0.00 0.00 0.00 39.33 40.14 2wbl h ASP 355 CO 0.05 0.66 -0.11 0.74 -0.00 0.00 0.00 179.24 180.59 2wbl h THR 356 N 0.91 0.70 -0.61 2.25 2.02 -0.94 -2.65 112.91 114.58 2wbl h THR 356 Ca 0.24 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.39 2wbl h THR 356 Cb 0.01 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2wbl h THR 356 CO -0.04 0.00 0.27 -0.07 0.37 0.00 0.00 175.52 176.05 2wbl h LEU 357 N -0.13 0.80 -1.49 2.58 3.38 -1.25 -2.46 115.31 116.74 2wbl h LEU 357 Ca 0.08 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2wbl h LEU 357 Cb 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2wbl h LEU 357 CO -0.19 0.70 -0.21 0.00 0.09 0.00 0.00 178.44 178.83 2wbl h ALA 358 N 1.42 1.18 0.07 1.53 0.00 -0.86 -3.04 119.26 119.56 2wbl h ALA 358 Ca 0.21 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2wbl h ALA 358 Cb 0.13 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2wbl h ALA 358 CO -0.02 0.26 -0.46 -0.07 0.00 0.00 0.00 179.25 178.96 2wbl h LEU 359 N 0.00 0.24 0.00 0.00 4.07 -1.15 -3.42 115.31 115.05 2wbl h LEU 359 Ca -0.00 -0.97 0.00 0.00 0.08 0.00 0.00 57.88 56.99 2wbl h LEU 359 Cb 0.56 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.22 2wbl h LEU 359 CO 0.03 1.22 0.00 0.29 -1.08 0.00 0.00 178.44 178.89 2wbl n LYS 360 N -4.35 0.00 0.00 1.13 4.01 -0.96 -5.09 118.16 112.90 2wbl n LYS 360 Ca -0.13 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.67 2wbl n LYS 360 Cb 0.66 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.18 2wbl n LYS 360 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29