#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbl n MET 11 N 0.00 0.00 0.04 0.11 0.00 -1.26 -4.67 117.12 111.34 2wbl n MET 11 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.70 57.73 2wbl n MET 11 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 33.22 33.36 2wbl n MET 11 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2wbl n GLU 12 N -1.21 0.03 -0.11 2.12 -0.58 -1.26 -0.43 120.64 119.21 2wbl n GLU 12 Ca 0.00 0.49 -0.21 0.00 -0.42 0.00 0.00 57.16 57.01 2wbl n GLU 12 Cb 0.00 -1.68 -0.10 0.00 -0.57 0.00 0.00 31.44 29.09 2wbl n GLU 12 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 2wbl n MET 13 N -1.64 0.56 0.11 3.49 1.56 -1.26 -3.85 117.12 116.08 2wbl n MET 13 Ca -0.00 0.53 -0.13 0.00 -0.27 0.00 0.00 57.70 57.82 2wbl n MET 13 Cb 0.08 -1.71 -0.08 0.00 2.15 0.00 0.00 33.22 33.66 2wbl n MET 13 CO 0.00 0.00 0.00 1.98 -0.73 0.00 0.00 175.97 177.22 2wbl h MET 14 N -1.00 -0.24 -0.89 2.12 1.85 -1.60 -3.16 114.93 112.00 2wbl h MET 14 Ca -0.36 0.02 0.08 0.00 -0.61 0.00 0.00 59.70 58.83 2wbl h MET 14 Cb 1.27 0.05 -0.11 0.00 0.43 0.00 0.00 31.60 33.25 2wbl h MET 14 CO -0.22 -0.02 -0.53 1.63 -0.40 0.00 0.00 176.91 177.38 2wbl n LYS 15 N -5.11 -0.39 -0.09 0.39 5.02 0.43 -1.70 118.16 116.70 2wbl n LYS 15 Ca -0.09 1.44 -0.13 0.00 -2.02 0.00 0.00 58.31 57.51 2wbl n LYS 15 Cb 0.19 -2.11 -0.09 0.00 -0.02 0.00 0.00 35.03 32.99 2wbl n LYS 15 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2wbl h ASP 16 N 0.00 -1.64 -0.45 4.39 1.82 -1.66 -0.64 116.42 118.24 2wbl h ASP 16 Ca 0.14 0.21 0.09 0.00 -0.39 0.00 0.00 57.03 57.08 2wbl h ASP 16 Cb 0.37 0.66 -0.09 0.00 0.68 0.00 0.00 39.33 40.95 2wbl h ASP 16 CO -0.84 -0.38 -0.12 0.03 -1.61 0.00 0.00 179.24 176.32 2wbl h ARG 17 N -0.40 -0.01 -0.58 0.28 2.47 -1.29 0.12 114.38 114.96 2wbl h ARG 17 Ca 0.06 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.71 2wbl h ARG 17 Cb 0.55 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.85 2wbl h ARG 17 CO -0.50 -0.01 0.09 0.74 0.56 0.00 0.00 179.97 180.85 2wbl h PHE 18 N -0.01 0.98 -0.09 3.04 0.04 -1.03 -2.96 116.94 116.92 2wbl h PHE 18 Ca 0.22 -0.12 -0.07 0.00 2.80 0.00 0.00 57.97 60.79 2wbl h PHE 18 Cb 0.35 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 38.22 2wbl h PHE 18 CO -0.40 0.84 -0.23 0.00 -0.60 0.00 0.00 178.31 177.92 2wbl h ALA 19 N 1.21 0.14 -0.44 2.45 0.00 0.21 -2.46 119.26 120.37 2wbl h ALA 19 Ca 0.18 -0.39 0.13 0.00 0.00 0.00 0.00 54.91 54.82 2wbl h ALA 19 Cb 0.40 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2wbl h ALA 19 CO 0.01 0.12 0.49 -0.22 0.00 0.00 0.00 179.25 179.65 2wbl h LYS 20 N -0.16 0.00 0.07 0.00 3.64 -0.80 -0.97 116.57 118.34 2wbl h LYS 20 Ca -0.00 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.13 2wbl h LYS 20 Cb 0.85 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 2wbl h LYS 20 CO 0.05 0.00 -1.09 -0.07 -2.27 0.00 0.00 179.45 176.07 2wbl h LEU 21 N 0.00 0.32 -1.06 5.20 -0.00 -1.27 -3.26 115.31 115.24 2wbl h LEU 21 Ca 0.21 -0.32 -0.08 0.00 -0.00 0.00 0.00 57.88 57.69 2wbl h LEU 21 Cb 1.18 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.72 2wbl h LEU 21 CO -0.00 1.20 -0.39 -0.07 -0.00 0.00 0.00 178.44 179.19 2wbl h LEU 22 N 0.08 0.00 -1.36 1.67 3.38 -0.99 -1.60 115.31 116.50 2wbl h LEU 22 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2wbl h LEU 22 Cb 1.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 2wbl h LEU 22 CO 0.17 0.39 0.00 -0.07 0.09 0.00 0.00 178.44 179.02 2wbl h LEU 23 N 0.00 0.00 -1.16 1.67 4.07 -1.56 -3.47 115.31 114.87 2wbl h LEU 23 Ca -0.00 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.59 2wbl h LEU 23 Cb 0.83 0.00 0.15 0.00 1.08 0.00 0.00 40.66 42.72 2wbl h LEU 23 CO 0.05 0.00 -0.70 0.61 -1.08 0.00 0.00 178.44 177.33 2wbl n GLY 24 N -0.21 -0.45 4.06 0.83 0.00 -0.60 -2.42 105.19 106.40 2wbl n GLY 24 Ca 0.01 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -4.58 0.00 -2.66 1.61 1.02 -1.25 0.31 120.64 115.09 2wbl n GLU 25 Ca -0.10 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.62 2wbl n GLU 25 Cb 0.60 -0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 31.03 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 -0.81 6.38 0.00 1.62 -1.08 -1.02 -4.86 116.67 116.90 2wbl s ASP 26 Ca 0.00 -1.20 0.21 0.00 -0.52 0.00 0.00 52.55 51.05 2wbl s ASP 26 Cb 0.00 -2.52 1.12 0.00 -1.46 0.00 0.00 42.92 40.07 2wbl s ASP 26 CO 0.00 -1.52 1.68 0.23 0.52 0.00 0.00 175.17 176.07 2wbl n MET 27 N 8.49 0.39 0.10 4.34 2.81 -1.26 -1.82 117.12 130.16 2wbl n MET 27 Ca 0.18 0.07 0.13 0.00 -1.81 0.00 0.00 57.70 56.26 2wbl n MET 27 Cb 0.49 -1.50 0.45 0.00 -0.71 0.00 0.00 33.22 31.95 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 -1.22 0.65 -0.05 7.83 7.64 -1.26 -4.91 113.62 122.31 2wbl n SER 28 Ca 0.12 0.59 -0.01 0.00 1.01 0.00 0.00 58.87 60.58 2wbl n SER 28 Cb 0.15 -0.76 -0.00 0.00 -1.01 0.00 0.00 64.21 62.59 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 0.91 0.44 0.04 0.23 0.00 -0.76 -4.90 105.19 101.15 2wbl n GLY 29 Ca 0.05 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.21 -1.36 2.36 -0.02 0.00 -1.26 -4.89 105.19 97.81 2wbl n GLY 30 Ca -0.01 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.82 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 0.80 0.60 1.02 -0.02 0.00 -1.26 -4.85 105.19 101.48 2wbl n GLY 31 Ca 0.05 -0.28 0.02 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.50 2.38 0.00 1.61 -0.00 -1.26 -4.92 118.16 113.47 2wbl n LYS 32 Ca -0.17 -1.14 0.00 0.00 -0.00 0.00 0.00 58.31 57.01 2wbl n LYS 32 Cb 0.57 -1.77 0.00 0.00 -0.00 0.00 0.00 35.03 33.83 2wbl n LYS 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wbl n GLY 33 N 0.21 -0.35 3.96 2.58 0.00 -1.26 -4.90 105.19 105.43 2wbl n GLY 33 Ca 0.11 -1.49 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 2wbl n GLY 33 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wbl s VAL 34 N 0.00 1.83 0.62 1.61 -7.23 0.15 -4.97 120.40 112.41 2wbl s VAL 34 Ca 0.00 -1.29 -0.17 0.00 -1.81 0.00 0.00 61.98 58.71 2wbl s VAL 34 Cb 0.00 -2.12 -0.02 0.00 0.56 0.00 0.00 36.38 34.80 2wbl s VAL 34 CO 0.00 0.00 1.14 -0.94 -0.31 0.00 0.00 175.10 174.99 2wbl s SER 35 N -4.44 5.18 0.51 4.85 1.04 -1.26 -4.63 113.70 114.95 2wbl s SER 35 Ca 0.45 2.16 0.26 0.00 0.48 0.00 0.00 55.95 59.29 2wbl s SER 35 Cb -0.04 -2.57 1.37 0.00 0.10 0.00 0.00 66.02 64.88 2wbl s SER 35 CO 0.28 -1.59 1.95 -1.28 0.98 0.00 0.00 173.24 173.58 2wbl h SER 36 N 0.45 0.07 0.12 7.02 0.87 -1.91 0.46 113.55 120.63 2wbl h SER 36 Ca -0.48 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.08 2wbl h SER 36 Cb 1.26 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2wbl h SER 36 CO 0.54 0.03 -0.06 0.00 -0.53 0.00 0.00 176.83 176.82 2wbl h ALA 37 N 1.67 -0.16 -0.68 6.23 0.00 -1.86 -2.15 119.26 122.31 2wbl h ALA 37 Ca 0.33 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wbl h ALA 37 Cb 1.20 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2wbl h ALA 37 CO -0.03 -0.34 0.42 1.25 0.00 0.00 0.00 179.25 180.55 2wbl h LEU 38 N -0.67 0.80 -0.61 0.00 5.85 -1.51 1.00 115.31 120.17 2wbl h LEU 38 Ca -0.02 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 2wbl h LEU 38 Cb 0.51 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 2wbl h LEU 38 CO 0.03 0.60 0.24 0.00 -0.34 0.00 0.00 178.44 178.97 2wbl h ALA 39 N 1.54 0.80 -0.53 1.25 0.00 -0.97 -1.61 119.26 119.74 2wbl h ALA 39 Ca 0.25 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2wbl h ALA 39 Cb -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2wbl h ALA 39 CO -0.05 0.42 -0.09 -0.07 0.00 0.00 0.00 179.25 179.46 2wbl h LEU 40 N 0.86 0.97 -0.46 0.00 3.38 -0.79 -1.56 115.31 117.71 2wbl h LEU 40 Ca 0.20 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2wbl h LEU 40 Cb 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 2wbl h LEU 40 CO -0.02 1.07 0.28 -1.28 0.09 0.00 0.00 178.44 178.59 2wbl h SER 41 N 0.87 0.46 -0.39 -0.43 0.87 -0.49 -2.68 113.55 111.77 2wbl h SER 41 Ca 0.14 -0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.57 2wbl h SER 41 Cb 0.63 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2wbl h SER 41 CO 0.04 0.33 -0.29 0.78 -0.53 0.00 0.00 176.83 177.17 2wbl h ASN 42 N 0.56 0.92 -0.85 6.23 2.35 -1.26 -2.35 115.58 121.19 2wbl h ASN 42 Ca 0.18 -0.44 0.06 0.00 -0.55 0.00 0.00 56.30 55.55 2wbl h ASN 42 Cb -0.01 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.05 2wbl h ASN 42 CO -0.07 1.16 0.52 0.00 -1.65 0.00 0.00 177.43 177.39 2wbl h ALA 43 N 0.78 1.16 0.07 -0.83 0.00 -1.13 0.17 119.26 119.49 2wbl h ALA 43 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wbl h ALA 43 Cb 0.87 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2wbl h ALA 43 CO 0.08 0.26 -0.03 0.82 0.00 0.00 0.00 179.25 180.37 2wbl h ILE 44 N 0.95 1.18 -0.32 0.00 2.04 -1.46 -1.88 117.51 118.02 2wbl h ILE 44 Ca 0.37 -0.95 0.07 0.00 1.00 0.00 0.00 64.86 65.36 2wbl h ILE 44 Cb 0.18 1.79 -0.08 0.00 -0.74 0.00 0.00 36.82 37.97 2wbl h ILE 44 CO -0.18 0.23 -0.28 0.74 0.00 0.00 0.00 178.15 178.66 2wbl h THR 45 N -0.53 0.31 -0.72 -0.27 2.02 -0.94 -1.55 112.91 111.24 2wbl h THR 45 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 2wbl h THR 45 Cb 0.45 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 2wbl h THR 45 CO 0.02 0.00 0.28 0.78 0.37 0.00 0.00 175.52 176.96 2wbl h ASN 46 N -0.25 0.99 -0.10 4.18 2.35 -0.66 -2.02 115.58 120.06 2wbl h ASN 46 Ca 0.16 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2wbl h ASN 46 Cb 0.50 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 2wbl h ASN 46 CO -0.46 0.89 0.03 0.25 -1.65 0.00 0.00 177.43 176.48 2wbl h LEU 47 N 1.05 0.16 -0.95 1.61 5.85 -0.94 -2.30 115.31 119.79 2wbl h LEU 47 Ca 0.24 -0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.81 2wbl h LEU 47 Cb 0.22 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2wbl h LEU 47 CO -0.02 0.34 0.60 0.00 -0.34 0.00 0.00 178.44 179.02 2wbl h ALA 48 N 0.82 1.33 -0.40 1.25 0.00 -1.11 -1.98 119.26 119.17 2wbl h ALA 48 Ca 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2wbl h ALA 48 Cb 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2wbl h ALA 48 CO 0.00 0.34 0.22 0.00 0.00 0.00 0.00 179.25 179.80 2wbl h ALA 49 N 1.45 0.51 -0.47 0.00 0.00 -1.15 0.14 119.26 119.74 2wbl h ALA 49 Ca 0.42 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2wbl h ALA 49 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wbl h ALA 49 CO -0.19 0.04 0.25 0.66 0.00 0.00 0.00 179.25 180.00 2wbl h SER 50 N 0.51 0.60 0.09 0.00 4.64 -0.88 -0.02 113.55 118.49 2wbl h SER 50 Ca 0.14 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2wbl h SER 50 Cb 0.06 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2wbl h SER 50 CO -0.02 0.52 -0.04 0.40 -0.87 0.00 0.00 176.83 176.82 2wbl h ILE 51 N 0.62 1.14 -0.30 0.95 5.03 -1.28 -3.31 117.51 120.35 2wbl h ILE 51 Ca 0.16 -1.30 -0.04 0.00 -0.12 0.00 0.00 64.86 63.56 2wbl h ILE 51 Cb 0.07 1.91 -0.02 0.00 -3.03 0.00 0.00 36.82 35.76 2wbl h ILE 51 CO -0.03 0.30 0.02 -0.26 -0.68 0.00 0.00 178.15 177.50 2wbl h PHE 52 N -0.77 0.45 -0.16 1.37 -1.00 -0.78 -2.68 116.94 113.37 2wbl h PHE 52 Ca -0.01 -0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.78 2wbl h PHE 52 Cb 0.58 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 2wbl h PHE 52 CO 0.11 0.44 0.12 0.78 -1.61 0.00 0.00 178.31 178.16 2wbl h GLY 53 N 0.74 0.00 1.99 -1.45 0.00 -1.08 -0.89 103.07 102.38 2wbl h GLY 53 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2wbl h GLY 53 CO 0.01 0.00 -0.01 0.83 0.00 0.00 0.00 176.54 177.37 2wbl h GLU 54 N 0.00 0.00 -5.59 4.80 5.08 -1.56 -3.40 114.58 113.91 2wbl h GLU 54 Ca 0.08 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.86 2wbl h GLU 54 Cb 0.32 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 2wbl h GLU 54 CO -0.00 0.00 1.94 1.04 -1.00 0.00 0.00 179.01 180.99 2wbl n GLN 55 N -2.99 2.66 -0.01 2.33 1.13 -0.34 -4.62 117.38 115.54 2wbl n GLN 55 Ca 0.04 -2.96 0.10 0.00 -1.94 0.00 0.00 57.00 52.24 2wbl n GLN 55 Cb 0.52 -3.54 -0.14 0.00 0.11 0.00 0.00 30.24 27.19 2wbl n GLN 55 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2wbl n THR 56 N 6.72 0.00 -4.35 5.09 -2.24 -1.26 -4.96 114.28 113.28 2wbl n THR 56 Ca 0.48 -0.28 -0.25 0.00 -2.27 0.00 0.00 64.05 61.73 2wbl n THR 56 Cb 0.46 0.44 -0.09 0.00 -2.10 0.00 0.00 70.33 69.04 2wbl n THR 56 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wbl s LYS 57 N -3.20 2.01 -1.21 -0.78 1.02 -1.26 -4.71 119.74 111.60 2wbl s LYS 57 Ca -0.01 -1.47 -0.14 0.00 0.02 0.00 0.00 55.97 54.37 2wbl s LYS 57 Cb 0.14 -2.04 0.16 0.00 -0.52 0.00 0.00 37.83 35.57 2wbl s LYS 57 CO 0.84 0.38 1.46 -1.17 -0.92 0.00 0.00 175.35 175.94 2wbl s LEU 58 N -3.29 4.95 0.16 3.17 0.20 -1.26 -4.90 118.68 117.70 2wbl s LEU 58 Ca 0.28 -2.95 -0.18 0.00 0.69 0.00 0.00 54.13 51.97 2wbl s LEU 58 Cb -0.07 -2.42 0.04 0.00 -0.43 0.00 0.00 46.19 43.32 2wbl s LEU 58 CO 0.16 -0.78 0.49 0.00 -0.29 0.00 0.00 176.35 175.93 2wbl s GLN 59 N 1.79 1.23 0.58 1.98 -2.07 -1.26 -4.87 119.66 117.04 2wbl s GLN 59 Ca 0.44 -0.72 -0.19 0.00 -1.82 0.00 0.00 55.36 53.07 2wbl s GLN 59 Cb -0.02 0.51 -0.06 0.00 -1.09 0.00 0.00 33.01 32.35 2wbl s GLN 59 CO 0.01 -0.51 0.85 -2.30 -1.32 0.00 0.00 175.29 172.02 2wbl n PRO 60 N -0.30 0.82 -2.41 9.60 -0.02 -1.00 -4.83 135.00 136.86 2wbl n PRO 60 Ca -0.14 0.32 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 2wbl n PRO 60 Cb 0.64 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 32.05 2wbl n PRO 60 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2wbl s MET 61 N -2.55 4.16 0.23 -0.52 1.75 -1.26 -4.94 119.30 116.17 2wbl s MET 61 Ca 0.73 1.60 -0.31 0.00 -1.25 0.00 0.00 55.69 56.46 2wbl s MET 61 Cb -0.43 -3.80 -0.14 0.00 2.84 0.00 0.00 34.83 33.30 2wbl s MET 61 CO 0.49 -0.80 1.26 -0.35 -0.65 0.00 0.00 175.02 174.97 2wbl n PRO 62 N 6.78 1.65 -0.44 4.11 -0.04 -1.26 -4.48 135.00 141.32 2wbl n PRO 62 Ca 0.14 0.59 0.38 0.00 -0.04 0.00 0.00 63.50 64.56 2wbl n PRO 62 Cb 0.45 -2.14 0.65 0.00 -0.04 0.00 0.00 33.50 32.42 2wbl n PRO 62 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2wbl h GLN 63 N 3.53 0.04 0.21 0.54 1.08 -1.99 -0.39 115.11 118.13 2wbl h GLN 63 Ca -0.44 -0.00 -0.32 0.00 -1.45 0.00 0.00 58.65 56.44 2wbl h GLN 63 Cb 1.31 -0.01 0.02 0.00 -0.05 0.00 0.00 27.48 28.75 2wbl h GLN 63 CO 0.71 0.03 -1.46 0.38 -0.95 0.00 0.00 178.83 177.54 2wbl h ASP 64 N 0.04 0.68 -0.81 1.46 2.03 -1.99 -1.86 116.42 115.97 2wbl h ASP 64 Ca 0.86 -0.77 0.06 0.00 -0.73 0.00 0.00 57.03 56.44 2wbl h ASP 64 Cb 2.64 -0.22 -0.06 0.00 -0.83 0.00 0.00 39.33 40.86 2wbl h ASP 64 CO -0.50 1.61 0.50 0.03 -1.03 0.00 0.00 179.24 179.85 2wbl h ARG 65 N 0.12 0.90 -0.53 4.15 3.08 -1.43 0.15 114.38 120.82 2wbl h ARG 65 Ca -0.23 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 59.80 2wbl h ARG 65 Cb 2.10 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 31.91 2wbl h ARG 65 CO 0.24 0.59 0.29 1.96 -1.07 0.00 0.00 179.97 181.98 2wbl h GLN 66 N 0.92 0.55 -0.21 0.04 4.20 -1.40 -1.02 115.11 118.19 2wbl h GLN 66 Ca 0.35 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 2wbl h GLN 66 Cb 0.15 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2wbl h GLN 66 CO -0.17 0.36 0.07 0.00 -0.67 0.00 0.00 178.83 178.43 2wbl h ALA 67 N 1.26 0.27 -0.25 3.87 0.00 -0.71 0.53 119.26 124.23 2wbl h ALA 67 Ca 0.22 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2wbl h ALA 67 Cb 0.09 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 2wbl h ALA 67 CO -0.13 -0.12 -0.14 0.00 0.00 0.00 0.00 179.25 178.86 2wbl h ARG 68 N 0.17 -0.11 0.59 0.00 2.47 -0.57 -1.09 114.38 115.84 2wbl h ARG 68 Ca 0.07 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.77 2wbl h ARG 68 Cb 0.21 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 2wbl h ARG 68 CO -0.00 -0.07 -0.32 2.35 0.56 0.00 0.00 179.97 182.48 2wbl h TRP 69 N -0.11 -0.84 -0.41 3.04 2.91 -1.11 0.11 115.95 119.54 2wbl h TRP 69 Ca 0.14 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.22 2wbl h TRP 69 Cb 0.32 0.29 -0.09 0.00 -0.51 0.00 0.00 29.16 29.16 2wbl h TRP 69 CO -0.31 -0.50 -0.34 0.87 -1.03 0.00 0.00 178.44 177.12 2wbl h LYS 70 N -0.85 -0.25 0.07 2.65 1.79 -0.69 -2.71 116.57 116.58 2wbl h LYS 70 Ca -0.08 0.02 -0.22 0.00 -2.18 0.00 0.00 60.65 58.19 2wbl h LYS 70 Cb 0.67 0.06 0.02 0.00 -1.58 0.00 0.00 32.23 31.40 2wbl h LYS 70 CO 0.11 -0.17 -0.92 1.57 -1.08 0.00 0.00 179.45 178.96 2wbl h LYS 71 N -0.26 0.49 0.15 3.15 2.10 -1.09 -3.01 116.57 118.11 2wbl h LYS 71 Ca 0.17 -0.63 -0.01 0.00 -2.00 0.00 0.00 60.65 58.18 2wbl h LYS 71 Cb 0.55 0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 2wbl h LYS 71 CO -0.55 1.25 -0.07 0.93 -2.00 0.00 0.00 179.45 179.01 2wbl h GLU 72 N 0.02 -0.20 -0.35 0.07 5.08 -0.77 -2.39 114.58 116.05 2wbl h GLU 72 Ca -0.14 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2wbl h GLU 72 Cb 1.63 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.91 2wbl h GLU 72 CO 0.18 -0.08 0.21 0.82 -1.00 0.00 0.00 179.01 179.13 2wbl h ILE 73 N -0.27 1.10 -0.08 3.13 2.04 -1.61 -2.25 117.51 119.58 2wbl h ILE 73 Ca -0.02 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.62 2wbl h ILE 73 Cb 0.21 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2wbl h ILE 73 CO 0.03 0.11 -0.06 0.44 0.00 0.00 0.00 178.15 178.68 2wbl h ASP 74 N 0.48 -0.18 -0.61 1.72 5.19 -1.32 0.35 116.42 122.05 2wbl h ASP 74 Ca 0.13 0.04 0.09 0.00 -0.62 0.00 0.00 57.03 56.66 2wbl h ASP 74 Cb -0.01 0.09 -0.11 0.00 0.18 0.00 0.00 39.33 39.48 2wbl h ASP 74 CO -0.02 -0.08 -0.45 -0.50 -3.12 0.00 0.00 179.24 175.06 2wbl h TRP 75 N -0.06 -1.35 -0.36 4.55 6.55 -0.92 0.21 115.95 124.57 2wbl h TRP 75 Ca 0.05 0.09 -0.08 0.00 0.95 0.00 0.00 58.89 59.90 2wbl h TRP 75 Cb 0.14 0.67 -0.01 0.00 -0.86 0.00 0.00 29.16 29.10 2wbl h TRP 75 CO -0.16 -0.42 -0.09 -0.07 -1.05 0.00 0.00 178.44 176.64 2wbl h LEU 76 N -0.22 0.70 -1.65 -4.49 3.38 -1.18 -2.74 115.31 109.12 2wbl h LEU 76 Ca 0.18 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 2wbl h LEU 76 Cb 0.56 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2wbl h LEU 76 CO -0.71 0.90 -0.13 -0.07 0.09 0.00 0.00 178.44 178.52 2wbl h LEU 77 N 0.49 0.00 -1.17 1.67 4.07 -0.01 -3.26 115.31 117.11 2wbl h LEU 77 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 2wbl h LEU 77 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 2wbl h LEU 77 CO 0.04 0.13 0.00 0.77 -1.08 0.00 0.00 178.44 178.29 2wbl h SER 78 N 0.00 0.00 0.01 -0.43 4.64 -0.27 -1.60 113.55 115.90 2wbl h SER 78 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wbl h SER 78 Cb 0.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2wbl h SER 78 CO 0.02 0.00 -0.00 1.62 -0.87 0.00 0.00 176.83 177.59 2wbl h VAL 79 N 0.00 0.74 0.00 0.95 3.04 -1.70 -2.70 116.25 116.57 2wbl h VAL 79 Ca 0.00 -0.02 -0.05 0.00 -1.01 0.00 0.00 66.70 65.62 2wbl h VAL 79 Cb 0.37 1.01 -0.01 0.00 -2.01 0.00 0.00 31.29 30.65 2wbl h VAL 79 CO 0.00 0.00 -0.26 0.71 -1.01 0.00 0.00 177.57 177.02 2wbl h THR 80 N 0.00 0.59 -0.73 3.17 1.35 -1.56 -2.60 112.91 113.14 2wbl h THR 80 Ca -0.00 -1.26 0.17 0.00 -0.55 0.00 0.00 66.41 64.76 2wbl h THR 80 Cb 0.01 1.86 -0.04 0.00 -1.73 0.00 0.00 68.15 68.24 2wbl h THR 80 CO 0.00 0.25 0.50 0.44 -0.25 0.00 0.00 175.52 176.46 2wbl h ASP 81 N 0.00 0.25 -0.35 5.36 3.45 -1.66 -2.47 116.42 121.01 2wbl h ASP 81 Ca -0.00 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.47 2wbl h ASP 81 Cb 0.83 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.57 2wbl h ASP 81 CO 0.03 0.12 0.00 1.41 -1.57 0.00 0.00 179.24 179.24 2wbl n HIS 82 N -4.44 0.45 -3.36 4.55 8.25 -0.98 -4.85 115.22 114.84 2wbl n HIS 82 Ca 0.14 -0.22 -0.41 0.00 -0.26 0.00 0.00 57.72 56.97 2wbl n HIS 82 Cb 0.62 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.64 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 -1.55 5.13 0.19 1.59 1.01 -0.93 -5.03 121.20 121.61 2wbl s ILE 83 Ca 0.36 0.15 0.07 0.00 0.00 0.00 0.00 60.65 61.23 2wbl s ILE 83 Cb 0.21 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.78 2wbl s ILE 83 CO 0.29 -0.10 -0.13 0.68 0.00 0.00 0.00 174.94 175.68 2wbl s VAL 84 N 2.11 1.59 -0.16 2.92 -7.23 -1.26 -2.19 120.40 116.18 2wbl s VAL 84 Ca 0.14 -2.17 -0.07 0.00 -1.81 0.00 0.00 61.98 58.06 2wbl s VAL 84 Cb -0.16 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2wbl s VAL 84 CO 0.12 -0.64 0.10 -1.61 -0.31 0.00 0.00 175.10 172.76 2wbl s GLU 85 N -3.67 3.76 -0.47 4.82 2.02 0.12 -4.73 118.70 120.55 2wbl s GLU 85 Ca 0.21 -0.25 -0.05 0.00 0.02 0.00 0.00 54.97 54.90 2wbl s GLU 85 Cb 0.00 -3.21 0.12 0.00 0.10 0.00 0.00 34.13 31.14 2wbl s GLU 85 CO 0.05 0.48 0.29 0.12 0.02 0.00 0.00 175.26 176.23 2wbl s PHE 86 N -0.20 3.52 0.19 1.61 5.36 -1.26 -1.96 117.98 125.24 2wbl s PHE 86 Ca 0.09 -2.33 0.09 0.00 -0.96 0.00 0.00 56.93 53.82 2wbl s PHE 86 Cb -0.12 -3.30 -0.04 0.00 -0.34 0.00 0.00 43.02 39.21 2wbl s PHE 86 CO 0.01 -0.96 -0.19 0.14 -1.46 0.00 0.00 175.22 172.76 2wbl s VAL 87 N 0.96 1.97 0.27 3.12 -7.23 0.28 -4.87 120.40 114.89 2wbl s VAL 87 Ca 0.09 -2.03 -0.29 0.00 -1.81 0.00 0.00 61.98 57.94 2wbl s VAL 87 Cb -0.23 -1.97 -0.09 0.00 0.56 0.00 0.00 36.38 34.65 2wbl s VAL 87 CO -0.03 -0.33 1.01 -2.84 -0.31 0.00 0.00 175.10 172.59 2wbl s PRO 88 N -2.97 4.72 0.30 4.82 0.02 -1.26 0.85 135.00 141.48 2wbl s PRO 88 Ca 0.19 1.60 -0.02 0.00 0.02 0.00 0.00 61.00 62.79 2wbl s PRO 88 Cb -0.05 -3.17 0.01 0.00 0.02 0.00 0.00 34.50 31.30 2wbl s PRO 88 CO 0.08 0.35 0.44 0.45 -0.33 0.00 0.00 177.00 177.99 2wbl n SER 89 N 1.23 -1.23 -4.41 2.53 2.88 0.74 -4.85 113.62 110.50 2wbl n SER 89 Ca -0.01 -2.61 -0.21 0.00 -1.33 0.00 0.00 58.87 54.71 2wbl n SER 89 Cb 0.46 2.27 -0.10 0.00 -0.75 0.00 0.00 64.21 66.09 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 -2.64 1.51 0.09 -1.46 -0.21 -1.26 -1.38 119.66 114.30 2wbl s GLN 90 Ca 0.24 -1.73 -0.11 0.00 0.02 0.00 0.00 55.36 53.78 2wbl s GLN 90 Cb -0.01 -1.23 0.01 0.00 1.00 0.00 0.00 33.01 32.78 2wbl s GLN 90 CO 0.17 0.11 0.25 1.14 -2.12 0.00 0.00 175.29 174.85 2wbl s GLN 91 N -3.68 0.87 -0.11 2.91 -2.07 -0.73 -4.89 119.66 111.97 2wbl s GLN 91 Ca 0.28 -0.82 -0.04 0.00 -1.82 0.00 0.00 55.36 52.96 2wbl s GLN 91 Cb 0.02 0.37 0.06 0.00 -1.09 0.00 0.00 33.01 32.36 2wbl s GLN 91 CO 0.11 -0.29 0.20 -0.08 -1.32 0.00 0.00 175.29 173.91 2wbl s THR 92 N -3.56 -0.33 0.76 3.63 -1.32 -1.26 -1.10 115.64 112.47 2wbl s THR 92 Ca 0.02 0.29 -0.11 0.00 -1.21 0.00 0.00 61.69 60.68 2wbl s THR 92 Cb 0.03 -0.38 0.04 0.00 -1.51 0.00 0.00 72.50 70.68 2wbl s THR 92 CO -0.10 0.11 1.08 -0.94 -2.21 0.00 0.00 174.62 172.56 2wbl s SER 93 N 2.35 4.81 0.54 8.08 1.04 -0.43 -4.89 113.70 125.19 2wbl s SER 93 Ca 0.03 1.53 0.23 0.00 0.48 0.00 0.00 55.95 58.22 2wbl s SER 93 Cb -0.12 -2.32 1.43 0.00 0.10 0.00 0.00 66.02 65.11 2wbl s SER 93 CO -0.07 -1.80 2.10 0.07 0.98 0.00 0.00 173.24 174.52 2wbl h LYS 94 N -0.97 0.00 0.00 4.02 -0.00 -2.01 0.13 116.57 117.74 2wbl h LYS 94 Ca -0.45 0.00 -0.06 0.00 -0.00 0.00 0.00 60.65 60.14 2wbl h LYS 94 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.46 2wbl h LYS 94 CO 0.57 0.00 -0.26 0.38 -0.00 0.00 0.00 179.45 180.13 2wbl h ASP 95 N 0.00 0.00 0.00 7.07 -0.00 -2.06 -3.47 116.42 117.96 2wbl h ASP 95 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.13 2wbl h ASP 95 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.76 2wbl h ASP 95 CO -0.00 0.26 0.00 0.61 -0.00 0.00 0.00 179.24 180.11 2wbl n GLY 96 N -0.28 1.91 3.73 7.15 0.00 0.45 -5.11 105.19 113.05 2wbl n GLY 96 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.58 3.50 -0.39 1.61 1.01 -1.26 -4.66 120.40 118.63 2wbl s VAL 97 Ca 0.00 1.16 -0.16 0.00 0.00 0.00 0.00 61.98 62.98 2wbl s VAL 97 Cb 0.00 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.64 2wbl s VAL 97 CO 0.00 0.14 0.37 0.00 0.00 0.00 0.00 175.10 175.61 2wbl s THR 99 N 1.97 3.14 0.28 0.00 -4.23 -0.26 -4.95 115.64 111.60 2wbl s THR 99 Ca 0.10 -0.95 -0.27 0.00 -1.18 0.00 0.00 61.69 59.40 2wbl s THR 99 Cb -0.17 -2.32 -0.09 0.00 1.34 0.00 0.00 72.50 71.26 2wbl s THR 99 CO 0.12 0.41 0.92 -1.61 -0.54 0.00 0.00 174.62 173.92 2wbl s GLU 100 N -1.28 4.63 0.06 3.99 2.02 -1.26 -1.77 118.70 125.10 2wbl s GLU 100 Ca 0.15 1.33 -0.04 0.00 0.02 0.00 0.00 54.97 56.43 2wbl s GLU 100 Cb -0.11 -2.96 -0.03 0.00 0.10 0.00 0.00 34.13 31.13 2wbl s GLU 100 CO 0.05 0.37 0.05 0.96 0.02 0.00 0.00 175.26 176.71 2wbl s ILE 101 N -1.46 0.19 0.28 -1.63 -4.36 -0.48 -4.95 121.20 108.79 2wbl s ILE 101 Ca 0.46 -1.56 -0.08 0.00 -0.26 0.00 0.00 60.65 59.22 2wbl s ILE 101 Cb -0.21 -1.43 -0.06 0.00 1.25 0.00 0.00 42.46 42.01 2wbl s ILE 101 CO 0.26 -0.86 0.58 -0.04 0.24 0.00 0.00 174.94 175.12 2wbl s MET 102 N -3.84 3.72 0.09 0.37 -1.94 -1.26 -0.18 119.30 116.26 2wbl s MET 102 Ca 0.06 0.18 -0.02 0.00 -1.71 0.00 0.00 55.69 54.19 2wbl s MET 102 Cb 0.06 -2.61 -0.04 0.00 2.01 0.00 0.00 34.83 34.26 2wbl s MET 102 CO -0.10 0.22 0.03 0.08 -0.01 0.00 0.00 175.02 175.25 2wbl s VAL 103 N -2.01 0.16 -0.18 -6.03 1.01 0.25 -4.84 120.40 108.75 2wbl s VAL 103 Ca 0.46 -1.78 0.00 0.00 0.00 0.00 0.00 61.98 60.67 2wbl s VAL 103 Cb -0.11 -1.72 0.04 0.00 0.00 0.00 0.00 36.38 34.60 2wbl s VAL 103 CO 0.26 -0.74 -0.08 0.28 0.00 0.00 0.00 175.10 174.82 2wbl s THR 104 N -3.97 1.43 0.07 3.92 -1.32 -1.26 -0.56 115.64 113.96 2wbl s THR 104 Ca 0.14 -0.85 0.07 0.00 -1.21 0.00 0.00 61.69 59.84 2wbl s THR 104 Cb 0.07 -1.54 -0.03 0.00 -1.51 0.00 0.00 72.50 69.49 2wbl s THR 104 CO -0.05 0.17 -0.18 0.00 -2.21 0.00 0.00 174.62 172.35 2wbl s ARG 105 N 1.49 1.05 0.49 7.08 1.70 -0.83 -4.96 118.95 124.97 2wbl s ARG 105 Ca -0.00 -0.99 -0.23 0.00 -0.47 0.00 0.00 55.73 54.04 2wbl s ARG 105 Cb -0.16 -1.16 -0.08 0.00 -0.57 0.00 0.00 34.95 32.98 2wbl s ARG 105 CO -0.08 0.28 1.20 0.94 -1.08 0.00 0.00 175.30 176.55 2wbl n GLN 106 N 1.43 1.58 -1.95 3.89 7.27 -1.26 0.15 117.38 128.48 2wbl n GLN 106 Ca -0.19 0.57 -0.38 0.00 0.07 0.00 0.00 57.00 57.07 2wbl n GLN 106 Cb 0.54 -2.35 0.02 0.00 2.41 0.00 0.00 30.24 30.87 2wbl n GLN 106 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 2wbl s ARG 107 N -2.48 3.35 0.18 3.69 3.52 -0.93 -4.58 118.95 121.71 2wbl s ARG 107 Ca 0.67 2.07 -0.25 0.00 -0.13 0.00 0.00 55.73 58.09 2wbl s ARG 107 Cb -0.47 -2.30 0.07 0.00 -1.56 0.00 0.00 34.95 30.68 2wbl s ARG 107 CO 0.53 -0.97 1.56 0.78 -0.81 0.00 0.00 175.30 176.39 2wbl h GLY 108 N 1.65 -0.41 0.25 8.12 0.00 -1.93 -0.20 103.07 110.54 2wbl h GLY 108 Ca -0.50 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2wbl h GLY 108 CO 0.58 -0.12 0.00 2.09 0.00 0.00 0.00 176.54 179.09 2wbl n ASP 109 N -5.39 0.00 -0.03 0.19 5.75 -1.26 -3.00 116.55 112.81 2wbl n ASP 109 Ca 0.04 -1.65 -0.03 0.00 -0.01 0.00 0.00 54.79 53.14 2wbl n ASP 109 Cb 0.34 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.39 2wbl n ASP 109 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2wbl n LEU 110 N -0.62 0.90 -0.06 -2.12 4.32 -0.16 -4.35 117.00 114.90 2wbl n LEU 110 Ca 0.06 -0.01 -0.07 0.00 -0.02 0.00 0.00 56.01 55.96 2wbl n LEU 110 Cb 0.03 0.02 -0.01 0.00 -1.62 0.00 0.00 43.42 41.83 2wbl n LEU 110 CO 0.04 0.28 0.81 0.25 -1.22 0.00 0.00 177.39 177.55 2wbl h LEU 111 N 0.00 -0.28 0.14 2.23 6.46 -1.26 -2.65 115.31 119.95 2wbl h LEU 111 Ca -0.16 0.08 -0.35 0.00 -0.12 0.00 0.00 57.88 57.34 2wbl h LEU 111 Cb 1.32 0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 41.42 2wbl h LEU 111 CO -0.00 -0.10 -1.86 0.24 -0.62 0.00 0.00 178.44 176.09 2wbl h MET 112 N -0.02 0.30 -0.12 1.25 2.86 -1.86 -3.40 114.93 113.94 2wbl h MET 112 Ca 0.13 -0.51 -0.19 0.00 -2.06 0.00 0.00 59.70 57.07 2wbl h MET 112 Cb 0.21 0.19 0.01 0.00 0.06 0.00 0.00 31.60 32.07 2wbl h MET 112 CO -0.28 1.24 -0.68 -0.91 1.06 0.00 0.00 176.91 177.35 2wbl h ASN 113 N 0.02 0.81 0.25 1.22 2.35 -1.75 -2.28 115.58 116.20 2wbl h ASN 113 Ca -0.39 -0.64 -0.01 0.00 -0.55 0.00 0.00 56.30 54.70 2wbl h ASN 113 Cb 2.01 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 40.15 2wbl h ASN 113 CO 0.10 1.32 -0.12 0.40 -1.65 0.00 0.00 177.43 177.48 2wbl h ILE 114 N 0.35 0.75 -0.36 2.81 1.08 -1.72 -0.03 117.51 120.38 2wbl h ILE 114 Ca -0.05 -0.01 -0.03 0.00 -0.39 0.00 0.00 64.86 64.38 2wbl h ILE 114 Cb 1.32 0.76 -0.02 0.00 -3.07 0.00 0.00 36.82 35.81 2wbl h ILE 114 CO 0.14 0.00 0.10 -0.65 -0.69 0.00 0.00 178.15 177.05 2wbl h PRO 115 N -0.35 0.53 -0.78 2.37 0.11 -1.77 0.30 132.00 132.41 2wbl h PRO 115 Ca -0.03 -0.08 0.06 0.00 0.11 0.00 0.00 66.00 66.05 2wbl h PRO 115 Cb 0.27 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 31.22 2wbl h PRO 115 CO 0.06 0.48 0.48 0.00 -0.21 0.00 0.00 178.00 178.80 2wbl h ALA 116 N 1.60 1.06 -0.09 -0.75 0.00 -1.06 0.14 119.26 120.17 2wbl h ALA 116 Ca 0.12 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 2wbl h ALA 116 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2wbl h ALA 116 CO -0.01 0.21 -0.57 -0.07 0.00 0.00 0.00 179.25 178.81 2wbl h LEU 117 N 0.88 0.30 -0.69 0.00 3.38 0.46 -1.74 115.31 117.91 2wbl h LEU 117 Ca 0.34 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 2wbl h LEU 117 Cb 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2wbl h LEU 117 CO -0.16 0.81 -0.36 0.03 0.09 0.00 0.00 178.44 178.84 2wbl h ARG 118 N 0.21 0.60 -0.34 1.13 3.08 -0.57 0.44 114.38 118.93 2wbl h ARG 118 Ca -0.00 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.76 2wbl h ARG 118 Cb 1.07 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2wbl h ARG 118 CO 0.09 0.87 0.21 -0.22 -1.07 0.00 0.00 179.97 179.85 2wbl h LYS 119 N 0.50 0.46 -0.46 0.04 3.64 -0.71 -1.20 116.57 118.83 2wbl h LYS 119 Ca 0.05 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2wbl h LYS 119 Cb 0.86 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 2wbl h LYS 119 CO 0.07 0.34 0.27 -0.07 -2.27 0.00 0.00 179.45 177.80 2wbl h LEU 120 N 0.44 0.56 -0.37 5.20 3.38 -1.03 0.15 115.31 123.64 2wbl h LEU 120 Ca 0.12 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.10 2wbl h LEU 120 Cb -0.00 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 2wbl h LEU 120 CO -0.02 0.46 -0.09 -0.78 0.09 0.00 0.00 178.44 178.09 2wbl h ASP 121 N 0.61 -0.35 0.46 -0.43 1.82 -0.75 -1.91 116.42 115.87 2wbl h ASP 121 Ca 0.16 0.11 -0.11 0.00 -0.39 0.00 0.00 57.03 56.80 2wbl h ASP 121 Cb 0.01 0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.23 2wbl h ASP 121 CO -0.03 -0.12 -0.51 0.00 -1.61 0.00 0.00 179.24 176.97 2wbl h ALA 122 N 1.37 1.12 -0.42 -0.78 0.00 -0.47 -2.32 119.26 117.75 2wbl h ALA 122 Ca 0.18 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 2wbl h ALA 122 Cb 0.27 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2wbl h ALA 122 CO -0.38 0.64 0.12 0.52 0.00 0.00 0.00 179.25 180.16 2wbl h MET 123 N 0.04 0.66 -0.40 0.00 2.86 -0.17 -0.28 114.93 117.65 2wbl h MET 123 Ca -0.00 -0.15 -0.10 0.00 -2.06 0.00 0.00 59.70 57.39 2wbl h MET 123 Cb 0.92 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 2wbl h MET 123 CO 0.07 0.66 -0.14 -0.07 1.06 0.00 0.00 176.91 178.48 2wbl h LEU 124 N 0.54 0.82 -0.65 1.22 3.38 -1.03 0.11 115.31 119.69 2wbl h LEU 124 Ca 0.14 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 2wbl h LEU 124 Cb 0.28 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2wbl h LEU 124 CO -0.00 1.02 0.09 0.40 0.09 0.00 0.00 178.44 180.03 2wbl h ILE 125 N 0.61 1.26 -0.31 1.22 1.08 -1.41 -1.80 117.51 118.17 2wbl h ILE 125 Ca 0.10 -1.05 0.07 0.00 -0.39 0.00 0.00 64.86 63.58 2wbl h ILE 125 Cb 0.68 0.67 -0.07 0.00 -3.07 0.00 0.00 36.82 35.03 2wbl h ILE 125 CO 0.05 0.39 -0.14 -0.78 -0.69 0.00 0.00 178.15 176.98 2wbl h ASP 126 N 1.01 -0.48 -0.08 1.72 -0.00 -0.89 -2.10 116.42 115.60 2wbl h ASP 126 Ca 0.20 0.12 -0.09 0.00 -0.00 0.00 0.00 57.03 57.26 2wbl h ASP 126 Cb 0.46 0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 40.04 2wbl h ASP 126 CO 0.02 -0.18 -0.20 0.00 -0.00 0.00 0.00 179.24 178.88 2wbl h THR 127 N -0.09 1.25 -0.08 2.25 1.03 -0.17 -1.59 112.91 115.51 2wbl h THR 127 Ca 0.16 -1.16 -0.07 0.00 -0.01 0.00 0.00 66.41 65.32 2wbl h THR 127 Cb 0.33 1.27 -0.01 0.00 -1.07 0.00 0.00 68.15 68.67 2wbl h THR 127 CO -0.37 0.37 -0.29 -0.07 -0.01 0.00 0.00 175.52 175.15 2wbl h LEU 128 N 0.43 0.14 -1.68 0.00 3.38 -1.26 -2.92 115.31 113.40 2wbl h LEU 128 Ca 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2wbl h LEU 128 Cb 0.60 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2wbl h LEU 128 CO 0.04 0.44 0.00 -0.78 0.09 0.00 0.00 178.44 178.23 2wbl h ASP 129 N 0.13 0.00 0.11 -0.43 1.82 -0.57 -2.34 116.42 115.14 2wbl h ASP 129 Ca 0.02 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 2wbl h ASP 129 Cb 0.59 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.60 2wbl h ASP 129 CO 0.04 0.00 0.00 0.59 -1.61 0.00 0.00 179.24 178.26 2wbl n ASN 130 N -3.06 0.00 -1.23 2.28 5.03 -1.10 -1.96 115.26 115.22 2wbl n ASN 130 Ca 0.00 -0.58 0.01 0.00 0.87 0.00 0.00 54.58 54.88 2wbl n ASN 130 Cb 0.27 -0.07 0.25 0.00 -1.02 0.00 0.00 39.78 39.20 2wbl n ASN 130 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2wbl n PHE 131 N -1.07 1.34 -1.92 3.10 3.01 -0.91 -5.01 117.46 116.00 2wbl n PHE 131 Ca 0.16 -1.20 -0.42 0.00 1.01 0.00 0.00 57.45 57.00 2wbl n PHE 131 Cb 0.11 -0.46 -0.03 0.00 -0.01 0.00 0.00 39.48 39.09 2wbl n PHE 131 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2wbl s ARG 132 N -3.01 4.18 3.10 -1.08 0.52 -0.83 -4.39 118.95 117.45 2wbl s ARG 132 Ca 0.46 2.32 0.00 0.00 -0.52 0.00 0.00 55.73 57.99 2wbl s ARG 132 Cb 0.39 -3.85 0.00 0.00 0.52 0.00 0.00 34.95 32.01 2wbl s ARG 132 CO 0.07 -0.81 0.00 0.41 0.02 0.00 0.00 175.30 174.99 2wbl n GLY 133 N 4.13 1.01 3.70 -3.53 0.00 -1.26 -4.90 105.19 104.34 2wbl n GLY 133 Ca 0.17 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.82 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 3.49 0.27 1.61 5.65 -1.26 -5.06 115.29 119.98 2wbl s HIS 134 Ca 0.00 1.02 0.10 0.00 0.25 0.00 0.00 55.06 56.43 2wbl s HIS 134 Cb 0.00 -2.71 -0.05 0.00 -1.18 0.00 0.00 32.58 28.64 2wbl s HIS 134 CO 0.00 0.03 -0.16 -0.80 -0.65 0.00 0.00 174.74 173.17 2wbl s ASN 135 N 0.86 3.28 0.35 9.88 0.01 -1.26 -5.06 114.94 123.00 2wbl s ASN 135 Ca 0.31 -1.06 0.19 0.00 -0.71 0.00 0.00 52.86 51.58 2wbl s ASN 135 Cb -0.16 -0.25 0.19 0.00 0.41 0.00 0.00 41.25 41.43 2wbl s ASN 135 CO 0.13 -0.08 1.51 -0.33 -1.51 0.00 0.00 177.10 176.81 2wbl h GLU 136 N 2.31 0.00 -6.32 -0.60 5.08 -1.97 -3.44 114.58 109.64 2wbl h GLU 136 Ca -0.40 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.42 2wbl h GLU 136 Cb 1.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 2wbl h GLU 136 CO 0.63 0.26 -0.23 -0.59 -1.00 0.00 0.00 179.01 178.07 2wbl s PHE 137 N -3.08 3.47 0.27 4.33 -0.71 -1.26 -4.09 117.98 116.91 2wbl s PHE 137 Ca 0.05 0.59 0.03 0.00 -1.04 0.00 0.00 56.93 56.56 2wbl s PHE 137 Cb 0.06 -2.04 -0.03 0.00 -1.21 0.00 0.00 43.02 39.80 2wbl s PHE 137 CO 0.71 0.31 0.22 1.67 -1.34 0.00 0.00 175.22 176.80 2wbl s TRP 138 N -1.86 1.47 0.09 3.49 -2.14 -0.18 -4.99 118.94 114.81 2wbl s TRP 138 Ca 0.42 -1.52 0.10 0.00 2.66 0.00 0.00 56.10 57.76 2wbl s TRP 138 Cb -0.11 -0.62 -0.03 0.00 -3.10 0.00 0.00 33.47 29.60 2wbl s TRP 138 CO 0.27 -0.78 -0.25 0.71 -2.66 0.00 0.00 176.95 174.24 2wbl s TYR 139 N -3.76 2.37 0.30 1.66 1.51 -1.26 0.29 117.35 118.46 2wbl s TYR 139 Ca 0.40 -0.37 0.10 0.00 -1.01 0.00 0.00 57.07 56.19 2wbl s TYR 139 Cb 0.04 -1.34 -0.05 0.00 -0.11 0.00 0.00 41.96 40.51 2wbl s TYR 139 CO 0.20 0.26 -0.06 0.14 -1.11 0.00 0.00 175.55 174.98 2wbl s VAL 140 N -0.96 2.79 0.20 0.71 -7.23 -0.87 -4.95 120.40 110.10 2wbl s VAL 140 Ca 0.14 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 57.90 2wbl s VAL 140 Cb -0.10 -2.66 -0.10 0.00 0.56 0.00 0.00 36.38 34.08 2wbl s VAL 140 CO 0.05 -0.31 1.54 -0.55 -0.31 0.00 0.00 175.10 175.52 2wbl s SER 141 N -3.64 6.58 0.53 4.85 0.15 -1.26 -3.82 113.70 117.09 2wbl s SER 141 Ca 0.32 2.67 0.25 0.00 0.70 0.00 0.00 55.95 59.89 2wbl s SER 141 Cb -0.03 -2.61 1.40 0.00 -1.71 0.00 0.00 66.02 63.08 2wbl s SER 141 CO 0.18 -0.81 2.01 0.08 1.20 0.00 0.00 173.24 175.90 2wbl h ARG 142 N 6.15 0.00 -0.36 5.44 0.11 -1.93 -2.92 114.38 120.88 2wbl h ARG 142 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 2wbl h ARG 142 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 2wbl h ARG 142 CO 0.87 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 180.69 2wbl n ASP 143 N -4.34 2.95 -2.61 0.08 8.00 -1.26 -4.49 116.55 114.88 2wbl n ASP 143 Ca 0.08 -1.98 -0.09 0.00 0.71 0.00 0.00 54.79 53.51 2wbl n ASP 143 Cb 0.56 -0.24 0.06 0.00 -0.02 0.00 0.00 41.12 41.48 2wbl n ASP 143 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2wbl n SER 144 N 0.59 0.05 0.11 -2.24 3.41 -1.10 -4.99 113.62 109.45 2wbl n SER 144 Ca 0.12 -1.16 -0.11 0.00 -0.26 0.00 0.00 58.87 57.46 2wbl n SER 144 Cb 0.43 -0.31 -0.07 0.00 -0.26 0.00 0.00 64.21 64.00 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 -0.32 -0.22 4.33 9.09 -1.94 -3.28 114.58 122.25 2wbl h GLU 145 Ca -0.13 0.02 0.06 0.00 0.05 0.00 0.00 59.36 59.36 2wbl h GLU 145 Cb 0.37 0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 27.54 2wbl h GLU 145 CO 0.10 0.04 0.17 1.05 0.05 0.00 0.00 179.01 180.41 2wbl h GLU 146 N -0.88 0.00 -0.45 1.06 -0.00 -1.95 -0.77 114.58 111.58 2wbl h GLU 146 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 2wbl h GLU 146 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.24 2wbl h GLU 146 CO 0.06 0.00 0.29 0.78 -0.00 0.00 0.00 179.01 180.14 2wbl h GLY 147 N 0.00 0.64 -6.85 1.06 0.00 -1.69 -3.17 103.07 93.06 2wbl h GLY 147 Ca 0.10 -0.24 -0.77 0.00 0.00 0.00 0.00 47.33 46.42 2wbl h GLY 147 CO -0.00 0.24 1.52 0.61 0.00 0.00 0.00 176.54 178.91 2wbl n GLN 148 N -4.46 3.77 -0.57 4.80 0.00 -0.30 -4.88 117.38 115.75 2wbl n GLN 148 Ca 0.04 -3.88 -0.02 0.00 0.00 0.00 0.00 57.00 53.14 2wbl n GLN 148 Cb 0.06 -2.82 -0.02 0.00 0.00 0.00 0.00 30.24 27.46 2wbl n GLN 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wbl n GLN 149 N 3.50 0.00 0.00 2.61 0.00 -1.20 -5.01 117.38 117.28 2wbl n GLN 149 Ca 0.35 -0.29 0.00 0.00 0.00 0.00 0.00 57.00 57.06 2wbl n GLN 149 Cb 0.37 0.20 0.00 0.00 0.00 0.00 0.00 30.24 30.81 2wbl n GLN 149 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2wbl n ASP 157 N 0.00 0.00 -4.49 2.61 2.03 -1.26 -5.10 116.55 110.33 2wbl n ASP 157 Ca -0.08 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.79 2wbl n ASP 157 Cb 0.45 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.85 2wbl n ASP 157 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2wbl s LYS 158 N 0.00 4.03 0.33 -0.67 1.02 -1.26 -4.90 119.74 118.28 2wbl s LYS 158 Ca 0.00 -2.36 0.15 0.00 0.02 0.00 0.00 55.97 53.78 2wbl s LYS 158 Cb 0.00 -5.18 0.80 0.00 -0.52 0.00 0.00 37.83 32.93 2wbl s LYS 158 CO 0.00 -1.90 1.36 -2.67 -0.92 0.00 0.00 175.35 171.22 2wbl n TRP 159 N 6.46 0.50 0.85 3.18 4.27 -1.26 -2.25 117.44 129.18 2wbl n TRP 159 Ca 0.39 0.26 0.13 0.00 -3.89 0.00 0.00 57.50 54.39 2wbl n TRP 159 Cb 0.44 -0.75 0.46 0.00 -1.36 0.00 0.00 31.31 30.10 2wbl n TRP 159 CO 0.00 0.00 0.00 -2.67 -2.29 0.00 0.00 177.69 172.73 2wbl n TRP 160 N -2.09 0.32 -3.03 -2.67 2.14 -1.26 -4.81 117.44 106.04 2wbl n TRP 160 Ca -0.01 0.09 -0.40 0.00 2.07 0.00 0.00 57.50 59.26 2wbl n TRP 160 Cb 0.27 -0.60 -0.05 0.00 -0.81 0.00 0.00 31.31 30.12 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 -3.56 4.34 -0.16 5.67 1.43 -0.95 -4.97 118.68 120.48 2wbl s LEU 161 Ca 0.12 1.24 -0.33 0.00 -1.03 0.00 0.00 54.13 54.13 2wbl s LEU 161 Cb 0.16 -3.11 -0.10 0.00 0.03 0.00 0.00 46.19 43.17 2wbl s LEU 161 CO 0.59 -0.09 2.01 -0.81 0.23 0.00 0.00 176.35 178.28 2wbl n PRO 162 N 3.60 1.96 -1.62 1.29 -0.04 -1.26 -4.83 135.00 134.09 2wbl n PRO 162 Ca -0.01 0.67 -0.48 0.00 -0.04 0.00 0.00 63.50 63.63 2wbl n PRO 162 Cb 0.51 -2.73 -0.04 0.00 -0.04 0.00 0.00 33.50 31.20 2wbl n PRO 162 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2wbl n PRO 163 N 7.36 1.54 -3.10 0.54 -0.02 -1.25 -4.67 135.00 135.40 2wbl n PRO 163 Ca 0.27 0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 61.91 2wbl n PRO 163 Cb 0.31 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 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 0.19 4.56 0.13 -1.45 0.11 -1.26 -2.04 120.40 120.65 2wbl s VAL 164 Ca 0.76 1.50 0.11 0.00 -2.93 0.00 0.00 61.98 61.41 2wbl s VAL 164 Cb -0.80 -4.04 -0.04 0.00 -1.53 0.00 0.00 36.38 29.97 2wbl s VAL 164 CO 0.48 0.52 -0.24 -0.54 -3.33 0.00 0.00 175.10 171.98 2wbl s LYS 165 N -0.99 1.51 0.03 1.54 1.02 0.14 -4.98 119.74 118.01 2wbl s LYS 165 Ca 0.33 -1.33 0.03 0.00 0.02 0.00 0.00 55.97 55.02 2wbl s LYS 165 Cb -0.21 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.13 2wbl s LYS 165 CO 0.23 0.45 -0.09 0.08 -0.92 0.00 0.00 175.35 175.10 2wbl s VAL 166 N -1.14 0.65 0.25 3.17 1.01 -1.26 -1.01 120.40 122.08 2wbl s VAL 166 Ca 0.16 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2wbl s VAL 166 Cb -0.10 -0.64 -0.14 0.00 0.00 0.00 0.00 36.38 35.50 2wbl s VAL 166 CO 0.07 -0.15 1.14 -2.65 0.00 0.00 0.00 175.10 173.52 2wbl n PRO 167 N 1.99 1.47 -1.80 2.72 -0.02 -1.26 -4.87 135.00 133.23 2wbl n PRO 167 Ca -0.19 0.52 -0.41 0.00 -2.02 0.00 0.00 63.50 61.40 2wbl n PRO 167 Cb 0.56 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 32.04 2wbl n PRO 167 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2wbl s PRO 168 N -1.06 4.12 -0.46 0.52 0.04 -1.26 -2.34 135.00 134.56 2wbl s PRO 168 Ca 0.64 2.56 -0.03 0.00 0.04 0.00 0.00 61.00 64.21 2wbl s PRO 168 Cb -0.72 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 30.82 2wbl s PRO 168 CO 0.56 -0.57 0.39 0.41 0.04 0.00 0.00 177.00 177.83 2wbl n GLY 169 N 1.21 0.45 4.54 0.56 0.00 -1.26 -4.95 105.19 105.74 2wbl n GLY 169 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.01 -1.84 3.18 -0.02 0.00 -0.99 -4.96 105.19 99.55 2wbl n GLY 170 Ca 0.00 -1.62 -0.23 0.00 0.00 0.00 0.00 46.02 44.18 2wbl n GLY 170 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wbl s LEU 171 N 0.00 2.15 0.29 0.99 2.96 -1.26 -4.01 118.68 119.79 2wbl s LEU 171 Ca 0.00 -0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 53.16 2wbl s LEU 171 Cb 0.00 -0.77 -0.13 0.00 0.50 0.00 0.00 46.19 45.79 2wbl s LEU 171 CO 0.00 0.11 1.42 -1.54 -1.32 0.00 0.00 176.35 175.02 2wbl n SER 172 N 2.02 3.05 -0.33 3.68 3.41 -1.26 -4.78 113.62 119.41 2wbl n SER 172 Ca -0.17 1.16 0.09 0.00 -0.26 0.00 0.00 58.87 59.69 2wbl n SER 172 Cb 0.54 -1.49 0.26 0.00 -0.26 0.00 0.00 64.21 63.26 2wbl n SER 172 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2wbl h GLU 173 N 3.84 0.75 0.00 4.33 4.57 -1.99 0.22 114.58 126.30 2wbl h GLU 173 Ca -0.46 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 2wbl h GLU 173 Cb 1.26 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2wbl h GLU 173 CO 0.72 0.50 -0.06 -1.00 -1.18 0.00 0.00 179.01 178.00 2wbl h PRO 174 N 0.77 0.00 -0.03 0.92 0.13 -1.99 0.23 132.00 132.03 2wbl h PRO 174 Ca 0.51 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.62 2wbl h PRO 174 Cb 0.68 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.81 2wbl h PRO 174 CO -0.34 0.06 -0.06 0.77 -0.23 0.00 0.00 178.00 178.20 2wbl h SER 175 N 0.00 0.11 -0.60 1.44 0.02 -0.95 -2.98 113.55 110.59 2wbl h SER 175 Ca -0.00 -0.55 -0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2wbl h SER 175 Cb 0.14 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2wbl h SER 175 CO 0.01 0.64 0.37 0.03 -1.14 0.00 0.00 176.83 176.73 2wbl h ARG 176 N -0.41 0.82 0.34 3.45 3.08 -1.08 -2.57 114.38 118.01 2wbl h ARG 176 Ca 0.00 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2wbl h ARG 176 Cb 0.61 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2wbl h ARG 176 CO 0.01 0.57 -0.37 0.00 -1.07 0.00 0.00 179.97 179.11 2wbl h ARG 177 N 0.84 -0.72 -0.25 0.04 3.08 -0.55 -2.09 114.38 114.72 2wbl h ARG 177 Ca 0.22 0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.23 2wbl h ARG 177 Cb -0.04 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2wbl h ARG 177 CO -0.04 -0.48 -0.23 0.00 -1.07 0.00 0.00 179.97 178.15 2wbl h MET 178 N -0.75 0.46 0.46 0.04 -0.00 -1.40 -1.99 114.93 111.76 2wbl h MET 178 Ca -0.02 -0.16 -0.01 0.00 -0.00 0.00 0.00 59.70 59.51 2wbl h MET 178 Cb 0.69 -0.03 -0.02 0.00 -0.00 0.00 0.00 31.60 32.23 2wbl h MET 178 CO -0.08 0.66 -0.44 -0.07 -0.00 0.00 0.00 176.91 176.97 2wbl h LEU 179 N 0.41 -1.21 -1.20 -0.10 3.38 -1.30 0.34 115.31 115.63 2wbl h LEU 179 Ca 0.06 0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.26 2wbl h LEU 179 Cb 0.63 0.40 -0.07 0.00 0.09 0.00 0.00 40.66 41.70 2wbl h LEU 179 CO 0.04 -0.61 0.59 1.88 0.09 0.00 0.00 178.44 180.43 2wbl h TYR 180 N -0.91 0.93 -0.46 1.13 -1.99 -1.19 -1.78 116.97 112.70 2wbl h TYR 180 Ca -0.05 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.64 2wbl h TYR 180 Cb 0.80 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 39.21 2wbl h TYR 180 CO -0.23 0.38 0.03 0.35 -0.00 0.00 0.00 178.16 178.70 2wbl h PHE 181 N 0.82 0.86 -0.14 4.88 3.57 -0.68 -2.54 116.94 123.71 2wbl h PHE 181 Ca 0.45 -0.14 -0.22 0.00 3.53 0.00 0.00 57.97 61.59 2wbl h PHE 181 Cb 0.56 -0.23 0.01 0.00 2.79 0.00 0.00 35.95 39.08 2wbl h PHE 181 CO -0.00 0.82 -0.78 1.96 -2.23 0.00 0.00 178.31 178.07 2wbl h GLN 182 N 0.65 0.73 -0.80 1.11 1.08 -0.50 -2.33 115.11 115.06 2wbl h GLN 182 Ca 0.14 -0.61 0.13 0.00 -1.45 0.00 0.00 58.65 56.86 2wbl h GLN 182 Cb 0.45 0.13 -0.09 0.00 -0.05 0.00 0.00 27.48 27.92 2wbl h GLN 182 CO 0.02 1.22 0.41 -0.22 -0.95 0.00 0.00 178.83 179.30 2wbl h LYS 183 N 0.50 0.60 -0.30 1.46 3.64 -1.31 0.60 116.57 121.76 2wbl h LYS 183 Ca -0.05 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 2wbl h LYS 183 Cb 1.40 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 2wbl h LYS 183 CO 0.16 0.40 -0.04 0.22 -2.27 0.00 0.00 179.45 177.91 2wbl h ASP 184 N 0.62 0.56 -0.48 4.20 3.58 -1.39 0.49 116.42 124.02 2wbl h ASP 184 Ca 0.42 -0.34 0.07 0.00 0.42 0.00 0.00 57.03 57.60 2wbl h ASP 184 Cb 0.55 -0.15 -0.06 0.00 1.72 0.00 0.00 39.33 41.39 2wbl h ASP 184 CO -0.33 0.77 0.15 -1.28 -2.88 0.00 0.00 179.24 175.67 2wbl h SER 185 N 0.35 0.13 -0.21 2.28 0.87 -0.72 -0.32 113.55 115.93 2wbl h SER 185 Ca 0.08 0.06 -0.14 0.00 -1.23 0.00 0.00 61.79 60.57 2wbl h SER 185 Cb 0.51 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 2wbl h SER 185 CO 0.02 0.10 -0.35 0.58 -0.53 0.00 0.00 176.83 176.66 2wbl h VAL 186 N 0.31 1.28 -0.40 2.23 2.07 0.28 -2.05 116.25 119.97 2wbl h VAL 186 Ca 0.23 -1.50 -0.10 0.00 0.82 0.00 0.00 66.70 66.15 2wbl h VAL 186 Cb 0.25 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2wbl h VAL 186 CO -0.25 0.49 -0.15 0.74 0.02 0.00 0.00 177.57 178.42 2wbl h THR 187 N 0.61 1.26 -0.02 2.57 2.02 -0.44 0.28 112.91 119.20 2wbl h THR 187 Ca 0.06 -1.20 -0.10 0.00 0.77 0.00 0.00 66.41 65.94 2wbl h THR 187 Cb 0.88 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2wbl h THR 187 CO 0.08 0.41 -0.47 1.56 0.37 0.00 0.00 175.52 177.47 2wbl h GLN 188 N 0.66 0.04 -0.19 6.66 4.20 -1.00 -2.29 115.11 123.17 2wbl h GLN 188 Ca 0.11 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.74 2wbl h GLN 188 Cb 0.62 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.40 2wbl h GLN 188 CO 0.04 0.50 -0.12 0.28 -0.67 0.00 0.00 178.83 178.86 2wbl h VAL 189 N 0.03 1.32 -0.56 -0.54 2.07 -0.52 -2.21 116.25 115.83 2wbl h VAL 189 Ca -0.00 -1.21 0.05 0.00 0.82 0.00 0.00 66.70 66.36 2wbl h VAL 189 Cb 0.84 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 2wbl h VAL 189 CO 0.06 0.36 0.29 -0.61 0.02 0.00 0.00 177.57 177.70 2wbl h GLN 190 N 0.11 0.53 -0.42 1.57 4.15 -0.36 -1.92 115.11 118.78 2wbl h GLN 190 Ca 0.04 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 2wbl h GLN 190 Cb 0.62 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 2wbl h GLN 190 CO 0.03 0.35 0.19 0.87 -1.93 0.00 0.00 178.83 178.35 2wbl h LYS 191 N 0.55 0.61 -0.39 1.69 1.57 -1.42 -1.46 116.57 117.72 2wbl h LYS 191 Ca 0.25 -0.10 0.08 0.00 -1.87 0.00 0.00 60.65 59.00 2wbl h LYS 191 Cb 0.15 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.29 2wbl h LYS 191 CO -0.17 0.55 -0.07 0.00 -0.57 0.00 0.00 179.45 179.19 2wbl h ALA 192 N 1.03 0.29 -0.01 3.86 0.00 -0.91 -1.29 119.26 122.23 2wbl h ALA 192 Ca 0.14 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2wbl h ALA 192 Cb 0.15 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2wbl h ALA 192 CO -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.80 2wbl h ALA 193 N 1.37 0.01 -0.72 0.00 0.00 -1.13 -2.66 119.26 116.14 2wbl h ALA 193 Ca 0.19 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.18 2wbl h ALA 193 Cb 0.28 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2wbl h ALA 193 CO -0.37 -0.42 0.48 0.52 0.00 0.00 0.00 179.25 179.46 2wbl h MET 194 N -0.13 0.33 -0.34 0.00 2.07 -0.80 -0.82 114.93 115.24 2wbl h MET 194 Ca 0.00 -0.02 -0.10 0.00 -2.07 0.00 0.00 59.70 57.52 2wbl h MET 194 Cb 0.14 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 29.79 2wbl h MET 194 CO -0.00 0.22 -0.17 0.00 1.07 0.00 0.00 176.91 178.03 2wbl h ALA 195 N 1.66 0.48 0.22 6.32 0.00 -0.90 -0.78 119.26 126.27 2wbl h ALA 195 Ca 0.35 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wbl h ALA 195 Cb 0.89 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2wbl h ALA 195 CO -0.10 0.40 -0.11 0.82 0.00 0.00 0.00 179.25 180.27 2wbl h ILE 196 N 0.49 0.85 -0.70 0.00 2.04 -1.05 -0.83 117.51 118.30 2wbl h ILE 196 Ca 0.08 -0.46 0.13 0.00 1.00 0.00 0.00 64.86 65.60 2wbl h ILE 196 Cb 0.70 1.11 -0.13 0.00 -0.74 0.00 0.00 36.82 37.77 2wbl h ILE 196 CO 0.05 0.10 -0.30 -1.13 0.00 0.00 0.00 178.15 176.87 2wbl h ASN 197 N -0.54 -1.07 -0.65 1.72 -0.73 -1.17 0.14 115.58 113.29 2wbl h ASN 197 Ca -0.03 0.24 -0.00 0.00 1.87 0.00 0.00 56.30 58.38 2wbl h ASN 197 Cb 0.40 0.57 -0.03 0.00 0.27 0.00 0.00 38.32 39.53 2wbl h ASN 197 CO 0.05 -0.29 0.40 0.00 -0.37 0.00 0.00 177.43 177.22 2wbl h ALA 198 N 1.28 1.47 0.10 1.57 0.00 -1.03 -0.77 119.26 121.89 2wbl h ALA 198 Ca 0.29 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2wbl h ALA 198 Cb 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2wbl h ALA 198 CO -0.76 0.47 -0.05 0.37 0.00 0.00 0.00 179.25 179.28 2wbl h GLN 199 N 0.90 -0.13 -0.22 0.00 5.75 0.49 -1.96 115.11 119.95 2wbl h GLN 199 Ca 0.24 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.80 2wbl h GLN 199 Cb -0.04 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 2wbl h GLN 199 CO -0.05 0.23 -0.12 0.28 -2.65 0.00 0.00 178.83 176.53 2wbl h VAL 200 N -0.51 0.63 -0.87 2.39 2.07 -0.56 -2.52 116.25 116.87 2wbl h VAL 200 Ca -0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.63 2wbl h VAL 200 Cb 0.42 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 2wbl h VAL 200 CO 0.02 0.00 0.56 -0.07 0.02 0.00 0.00 177.57 178.11 2wbl h LEU 201 N -0.10 0.68 -1.50 2.57 3.38 -1.06 -0.35 115.31 118.92 2wbl h LEU 201 Ca 0.12 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2wbl h LEU 201 Cb 0.29 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2wbl h LEU 201 CO -0.29 0.36 -0.04 0.77 0.09 0.00 0.00 178.44 179.34 2wbl h SER 202 N 0.73 0.00 -0.02 -0.43 4.64 -0.91 -2.96 113.55 114.60 2wbl h SER 202 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2wbl h SER 202 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2wbl h SER 202 CO -0.19 0.04 -0.13 -0.62 -0.87 0.00 0.00 176.83 175.06 2wbl n GLU 203 N -3.15 1.75 -2.82 4.77 1.02 -0.19 -4.94 120.64 117.07 2wbl n GLU 203 Ca 0.00 -1.48 -0.38 0.00 -0.02 0.00 0.00 57.16 55.29 2wbl n GLU 203 Cb 0.31 -1.40 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 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 -1.89 4.61 0.47 3.49 -1.94 -0.92 -5.00 119.30 118.12 2wbl s MET 204 Ca 0.22 1.30 -0.23 0.00 -1.71 0.00 0.00 55.69 55.27 2wbl s MET 204 Cb 0.17 -2.94 -0.07 0.00 2.01 0.00 0.00 34.83 33.99 2wbl s MET 204 CO 0.34 0.36 1.22 -2.00 -0.01 0.00 0.00 175.02 174.93 2wbl s GLU 205 N -1.80 3.67 -0.33 2.03 2.12 -1.26 -4.95 118.70 118.18 2wbl s GLU 205 Ca 0.46 1.91 -0.29 0.00 0.36 0.00 0.00 54.97 57.41 2wbl s GLU 205 Cb -0.20 -2.43 0.01 0.00 0.26 0.00 0.00 34.13 31.77 2wbl s GLU 205 CO 0.25 -0.66 1.17 0.42 -0.54 0.00 0.00 175.26 175.90 2wbl s ILE 206 N -1.46 4.33 0.33 -3.70 1.01 -1.26 -4.75 121.20 115.70 2wbl s ILE 206 Ca 0.64 1.51 -0.29 0.00 0.00 0.00 0.00 60.65 62.51 2wbl s ILE 206 Cb -0.32 -4.34 -0.11 0.00 0.01 0.00 0.00 42.46 37.70 2wbl s ILE 206 CO 0.39 -0.54 1.53 -2.65 0.00 0.00 0.00 174.94 173.66 2wbl n PRO 207 N 7.15 2.65 -0.29 2.79 -0.02 -1.26 -4.90 135.00 141.11 2wbl n PRO 207 Ca 0.13 0.93 0.22 0.00 -2.02 0.00 0.00 63.50 62.76 2wbl n PRO 207 Cb 0.47 -2.68 0.52 0.00 -0.02 0.00 0.00 33.50 31.79 2wbl n PRO 207 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2wbl h GLU 208 N 3.78 0.38 0.00 -0.52 9.09 -1.99 -0.51 114.58 124.81 2wbl h GLU 208 Ca -0.49 -0.02 -0.06 0.00 0.05 0.00 0.00 59.36 58.84 2wbl h GLU 208 Cb 1.24 -0.09 -0.01 0.00 -1.65 0.00 0.00 28.75 28.24 2wbl h GLU 208 CO 0.71 0.25 -0.31 0.66 0.05 0.00 0.00 179.01 180.37 2wbl h SER 209 N 0.39 0.00 0.19 3.06 4.64 -1.99 -2.85 113.55 116.99 2wbl h SER 209 Ca 0.55 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.86 2wbl h SER 209 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 2wbl h SER 209 CO -0.24 0.31 -0.09 0.22 -0.87 0.00 0.00 176.83 176.16 2wbl h TYR 210 N 0.00 -0.24 -0.92 4.77 3.20 -1.46 -2.84 116.97 119.48 2wbl h TYR 210 Ca -0.00 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.07 2wbl h TYR 210 Cb 0.81 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.09 2wbl h TYR 210 CO 0.00 0.17 0.60 -0.84 -1.64 0.00 0.00 178.16 176.45 2wbl h ILE 211 N -0.83 0.67 -0.17 1.81 3.07 -1.52 0.17 117.51 120.71 2wbl h ILE 211 Ca -0.03 -0.15 -0.11 0.00 1.55 0.00 0.00 64.86 66.12 2wbl h ILE 211 Cb 0.52 0.21 -0.01 0.00 -0.27 0.00 0.00 36.82 37.26 2wbl h ILE 211 CO 0.04 0.08 -0.38 0.44 -1.05 0.00 0.00 178.15 177.28 2wbl h ASP 212 N 0.43 0.39 1.12 2.16 5.19 -1.54 -2.85 116.42 121.32 2wbl h ASP 212 Ca 0.48 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.73 2wbl h ASP 212 Cb 1.17 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.58 2wbl h ASP 212 CO -0.19 0.74 0.00 0.77 -3.12 0.00 0.00 179.24 177.44 2wbl h SER 213 N 0.32 0.00 -3.95 6.45 4.64 -0.42 -3.46 113.55 117.14 2wbl h SER 213 Ca 0.03 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.82 2wbl h SER 213 Cb 0.82 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.01 2wbl h SER 213 CO 0.07 0.00 0.73 -0.76 -0.87 0.00 0.00 176.83 175.99 2wbl s LEU 214 N -5.08 4.28 1.02 5.97 1.02 -0.98 -5.02 118.68 119.88 2wbl s LEU 214 Ca 0.05 2.93 -0.12 0.00 0.02 0.00 0.00 54.13 57.02 2wbl s LEU 214 Cb 0.09 -3.75 0.20 0.00 0.02 0.00 0.00 46.19 42.76 2wbl s LEU 214 CO 0.51 -0.89 1.08 -2.84 0.02 0.00 0.00 176.35 174.22 2wbl s PRO 215 N -2.15 0.26 0.36 1.29 0.02 -1.26 -4.96 135.00 128.57 2wbl s PRO 215 Ca 0.54 0.75 0.04 0.00 0.02 0.00 0.00 61.00 62.35 2wbl s PRO 215 Cb -0.44 -1.70 0.70 0.00 0.02 0.00 0.00 34.50 33.08 2wbl s PRO 215 CO 0.59 -2.90 2.00 1.57 -0.33 0.00 0.00 177.00 177.93 2wbl h LYS 216 N -2.03 0.76 0.00 5.54 -0.00 -1.97 -3.47 116.57 115.41 2wbl h LYS 216 Ca -0.55 -0.05 0.04 0.00 -0.00 0.00 0.00 60.65 60.09 2wbl h LYS 216 Cb 1.32 -0.17 -0.00 0.00 -0.00 0.00 0.00 32.23 33.37 2wbl h LYS 216 CO 0.54 0.50 0.29 0.27 -0.00 0.00 0.00 179.45 181.05 2wbl n ASN 217 N -4.45 -1.45 0.01 7.07 0.23 -1.26 -5.09 115.26 110.31 2wbl n ASN 217 Ca 0.07 -1.91 -0.12 0.00 -0.53 0.00 0.00 54.58 52.09 2wbl n ASN 217 Cb 0.10 2.39 -0.08 0.00 -2.08 0.00 0.00 39.78 40.11 2wbl n ASN 217 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2wbl h GLY 218 N 1.39 -1.19 -0.13 4.83 0.00 -1.92 -2.48 103.07 103.57 2wbl h GLY 218 Ca -0.22 0.67 0.10 0.00 0.00 0.00 0.00 47.33 47.88 2wbl h GLY 218 CO 0.28 -0.29 -0.22 0.07 0.00 0.00 0.00 176.54 176.38 2wbl h ARG 219 N -0.48 -0.12 -0.74 4.80 -0.00 -1.97 0.47 114.38 116.34 2wbl h ARG 219 Ca 0.02 0.01 0.11 0.00 -0.00 0.00 0.00 59.98 60.11 2wbl h ARG 219 Cb 0.55 0.03 -0.08 0.00 -0.00 0.00 0.00 29.97 30.47 2wbl h ARG 219 CO -0.33 -0.08 0.36 0.00 -0.00 0.00 0.00 179.97 179.93 2wbl h ALA 220 N 1.19 1.03 -0.15 0.08 0.00 -1.86 0.65 119.26 120.20 2wbl h ALA 220 Ca 0.22 0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.98 2wbl h ALA 220 Cb 0.47 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wbl h ALA 220 CO -0.55 -0.07 -0.74 0.66 0.00 0.00 0.00 179.25 178.55 2wbl h SER 221 N 0.59 0.91 0.80 0.00 4.64 -0.68 -3.32 113.55 116.48 2wbl h SER 221 Ca 0.37 -0.63 -0.18 0.00 -0.47 0.00 0.00 61.79 60.88 2wbl h SER 221 Cb 0.43 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 2wbl h SER 221 CO -0.30 1.39 -0.87 -0.07 -0.87 0.00 0.00 176.83 176.12 2wbl h LEU 222 N 0.49 0.05 0.00 5.97 3.38 0.29 -3.45 115.31 122.04 2wbl h LEU 222 Ca -0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2wbl h LEU 222 Cb 1.38 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2wbl h LEU 222 CO 0.15 0.89 0.00 0.61 0.09 0.00 0.00 178.44 180.19 2wbl n GLY 223 N 0.93 -0.01 0.44 0.83 0.00 0.22 -4.47 105.19 103.14 2wbl n GLY 223 Ca -0.01 -1.65 -0.17 0.00 0.00 0.00 0.00 46.02 44.19 2wbl n GLY 223 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wbl h ASP 224 N 0.00 -1.14 -0.26 1.61 3.32 -1.93 -0.85 116.42 117.16 2wbl h ASP 224 Ca 0.00 0.09 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 2wbl h ASP 224 Cb 0.00 0.37 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2wbl h ASP 224 CO 0.00 -0.59 -0.42 0.77 -1.72 0.00 0.00 179.24 177.27 2wbl h SER 225 N -0.90 0.88 -0.69 6.45 4.64 -1.96 -2.36 113.55 119.61 2wbl h SER 225 Ca -0.05 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2wbl h SER 225 Cb 0.78 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 2wbl h SER 225 CO -0.03 1.18 0.44 0.40 -0.87 0.00 0.00 176.83 177.94 2wbl h ILE 226 N 0.66 1.19 -0.56 0.95 2.04 -1.77 -1.25 117.51 118.77 2wbl h ILE 226 Ca 0.05 -0.38 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 2wbl h ILE 226 Cb 1.00 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2wbl h ILE 226 CO 0.10 0.19 0.12 0.22 0.00 0.00 0.00 178.15 178.78 2wbl h TYR 227 N 0.94 0.89 -0.21 1.37 3.20 -0.98 -1.56 116.97 120.63 2wbl h TYR 227 Ca 0.25 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.93 2wbl h TYR 227 Cb -0.07 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 37.93 2wbl h TYR 227 CO -0.02 0.75 -0.31 0.87 -1.64 0.00 0.00 178.16 177.81 2wbl h LYS 228 N 0.83 0.43 -0.30 1.82 1.79 -1.10 -2.64 116.57 117.40 2wbl h LYS 228 Ca 0.18 -0.18 -0.13 0.00 -2.18 0.00 0.00 60.65 58.34 2wbl h LYS 228 Cb 0.32 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2wbl h LYS 228 CO 0.00 0.70 -0.34 0.77 -1.08 0.00 0.00 179.45 179.50 2wbl h SER 229 N 0.37 0.82 0.42 0.86 0.02 -0.83 -2.31 113.55 112.90 2wbl h SER 229 Ca 0.05 -0.48 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2wbl h SER 229 Cb 0.73 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.04 2wbl h SER 229 CO 0.06 1.13 0.00 -0.38 -1.14 0.00 0.00 176.83 176.50 2wbl n ILE 230 N -4.20 0.14 -0.12 3.27 -0.00 -0.62 -3.26 119.36 114.57 2wbl n ILE 230 Ca -0.04 0.04 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 2wbl n ILE 230 Cb 0.50 -0.61 0.00 0.00 -0.00 0.00 0.00 39.64 39.53 2wbl n ILE 230 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 2wbl n THR 231 N -1.25 0.67 -0.37 1.39 -2.24 -1.00 -4.75 114.28 106.73 2wbl n THR 231 Ca 0.13 -0.78 -0.28 0.00 -2.27 0.00 0.00 64.05 60.86 2wbl n THR 231 Cb 0.19 0.69 0.25 0.00 -2.10 0.00 0.00 70.33 69.37 2wbl n THR 231 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wbl n GLU 232 N -0.33 -3.63 0.18 -0.78 1.02 -0.88 -4.97 120.64 111.24 2wbl n GLU 232 Ca 0.00 -1.07 -0.07 0.00 -0.02 0.00 0.00 57.16 56.00 2wbl n GLU 232 Cb 0.22 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 29.72 2wbl n GLU 232 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2wbl h GLU 233 N -3.15 -0.45 -5.96 3.49 4.81 -1.92 -3.44 114.58 107.96 2wbl h GLU 233 Ca -0.45 0.03 -0.61 0.00 -0.13 0.00 0.00 59.36 58.20 2wbl h GLU 233 Cb 1.24 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.68 2wbl h GLU 233 CO 0.30 -0.30 -0.44 -1.58 -0.73 0.00 0.00 179.01 176.26 2wbl s TRP 234 N -3.69 3.52 -0.04 0.92 0.51 -1.26 -5.11 118.94 113.79 2wbl s TRP 234 Ca -0.07 0.38 0.00 0.00 -2.12 0.00 0.00 56.10 54.29 2wbl s TRP 234 Cb 0.01 -1.85 0.03 0.00 -0.81 0.00 0.00 33.47 30.84 2wbl s TRP 234 CO 0.20 0.56 -0.01 0.12 -0.51 0.00 0.00 176.95 177.32 2wbl s PHE 235 N -1.50 0.44 -0.25 -1.98 5.36 -1.26 -5.01 117.98 113.78 2wbl s PHE 235 Ca 0.35 -0.06 0.02 0.00 -0.96 0.00 0.00 56.93 56.28 2wbl s PHE 235 Cb -0.13 -0.50 0.06 0.00 -0.34 0.00 0.00 43.02 42.12 2wbl s PHE 235 CO 0.25 -0.16 -0.07 0.34 -1.46 0.00 0.00 175.22 174.12 2wbl s ASP 236 N 1.07 4.09 0.60 6.13 2.15 -1.26 -5.01 116.67 124.44 2wbl s ASP 236 Ca -0.09 -1.29 0.35 0.00 0.43 0.00 0.00 52.55 51.96 2wbl s ASP 236 Cb -0.14 -1.32 1.93 0.00 -0.30 0.00 0.00 42.92 43.09 2wbl s ASP 236 CO -0.01 -0.22 2.23 1.55 -0.17 0.00 0.00 175.17 178.54 2wbl h PRO 237 N 7.88 0.00 0.09 4.34 0.13 -1.97 -0.08 132.00 142.40 2wbl h PRO 237 Ca -0.18 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2wbl h PRO 237 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2wbl h PRO 237 CO 0.43 0.03 -0.04 0.93 -0.23 0.00 0.00 178.00 179.12 2wbl h GLU 238 N 0.00 -0.12 0.08 0.86 4.39 -1.99 -2.90 114.58 114.90 2wbl h GLU 238 Ca -0.00 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 2wbl h GLU 238 Cb 0.13 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2wbl h GLU 238 CO 0.00 0.32 -0.04 1.96 -1.16 0.00 0.00 179.01 180.09 2wbl h GLN 239 N -0.61 -0.11 -0.80 2.33 1.08 -1.84 -2.64 115.11 112.51 2wbl h GLN 239 Ca -0.01 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.27 2wbl h GLN 239 Cb 0.49 0.02 -0.10 0.00 -0.05 0.00 0.00 27.48 27.85 2wbl h GLN 239 CO 0.02 -0.06 -0.53 0.35 -0.95 0.00 0.00 178.83 177.66 2wbl h PHE 240 N -0.12 -1.71 -0.66 2.96 3.57 -1.10 -1.19 116.94 118.69 2wbl h PHE 240 Ca -0.01 0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2wbl h PHE 240 Cb 0.10 0.85 -0.03 0.00 2.79 0.00 0.00 35.95 39.65 2wbl h PHE 240 CO -0.07 -0.36 0.42 -0.07 -2.23 0.00 0.00 178.31 176.00 2wbl h LEU 241 N -0.08 0.77 -1.56 0.59 3.38 -1.52 -2.20 115.31 114.70 2wbl h LEU 241 Ca 0.13 -0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.17 2wbl h LEU 241 Cb 0.41 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2wbl h LEU 241 CO -0.80 0.57 0.45 0.00 0.09 0.00 0.00 178.44 178.75 2wbl h ALA 242 N 1.23 1.97 -0.19 1.53 0.00 -0.91 -1.67 119.26 121.22 2wbl h ALA 242 Ca 0.24 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 2wbl h ALA 242 Cb -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2wbl h ALA 242 CO -0.05 -0.12 -0.18 0.52 0.00 0.00 0.00 179.25 179.42 2wbl h MET 243 N 0.49 0.32 -6.50 0.00 2.86 -0.60 -3.45 114.93 108.04 2wbl h MET 243 Ca 0.31 -0.09 -0.50 0.00 -2.06 0.00 0.00 59.70 57.36 2wbl h MET 243 Cb 0.57 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 2wbl h MET 243 CO -0.10 0.50 -0.16 -0.51 1.06 0.00 0.00 176.91 177.70 2wbl s LEU 244 N -8.70 4.03 -0.64 1.22 1.43 -0.63 -5.02 118.68 110.36 2wbl s LEU 244 Ca -0.06 0.60 -0.27 0.00 -1.03 0.00 0.00 54.13 53.38 2wbl s LEU 244 Cb 0.15 -3.44 -0.00 0.00 0.03 0.00 0.00 46.19 42.92 2wbl s LEU 244 CO 0.75 -0.24 1.64 -0.62 0.23 0.00 0.00 176.35 178.12 2wbl s ASP 245 N -3.52 5.63 -0.19 2.29 3.68 -1.26 -4.82 116.67 118.48 2wbl s ASP 245 Ca 0.42 0.11 0.16 0.00 2.13 0.00 0.00 52.55 55.37 2wbl s ASP 245 Cb -0.10 -2.54 0.62 0.00 -1.45 0.00 0.00 42.92 39.45 2wbl s ASP 245 CO 0.33 -2.14 1.52 0.23 0.13 0.00 0.00 175.17 175.24 2wbl n MET 246 N 9.19 3.56 -0.10 4.34 2.81 -1.26 -4.69 117.12 130.97 2wbl n MET 246 Ca 0.14 -2.92 -0.01 0.00 -1.81 0.00 0.00 57.70 53.10 2wbl n MET 246 Cb 0.51 -1.96 0.24 0.00 -0.71 0.00 0.00 33.22 31.31 2wbl n MET 246 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2wbl h SER 247 N 2.56 0.69 -3.50 7.83 4.64 -1.99 -3.43 113.55 120.35 2wbl h SER 247 Ca 0.00 -0.10 -0.66 0.00 -0.47 0.00 0.00 61.79 60.56 2wbl h SER 247 Cb 1.59 -0.18 -0.16 0.00 -0.31 0.00 0.00 62.40 63.34 2wbl h SER 247 CO 0.30 0.66 -0.74 0.42 -0.87 0.00 0.00 176.83 176.59 2wbl s THR 248 N -5.27 3.33 0.47 2.95 -4.23 -1.26 -5.02 115.64 106.61 2wbl s THR 248 Ca -0.09 -1.33 0.23 0.00 -1.18 0.00 0.00 61.69 59.32 2wbl s THR 248 Cb 0.16 -2.57 0.27 0.00 1.34 0.00 0.00 72.50 71.70 2wbl s THR 248 CO 0.78 0.08 2.09 -0.08 -0.54 0.00 0.00 174.62 176.96 2wbl h GLU 249 N 3.52 0.00 -0.11 3.99 4.81 -2.00 -1.95 114.58 122.84 2wbl h GLU 249 Ca -0.49 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.65 2wbl h GLU 249 Cb 1.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.54 2wbl h GLU 249 CO 0.52 0.11 -0.34 0.45 -0.73 0.00 0.00 179.01 179.02 2wbl h HIS 250 N 0.00 0.24 -0.03 0.92 3.86 -1.96 -2.39 115.15 115.79 2wbl h HIS 250 Ca -0.00 -0.05 -0.07 0.00 -1.16 0.00 0.00 60.37 59.09 2wbl h HIS 250 Cb 0.24 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.66 2wbl h HIS 250 CO 0.00 0.53 -0.24 0.87 0.86 0.00 0.00 177.93 179.94 2wbl h LYS 251 N 0.18 0.21 -0.70 2.45 1.57 -1.70 -0.91 116.57 117.68 2wbl h LYS 251 Ca 0.02 -0.19 0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2wbl h LYS 251 Cb 0.69 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.98 2wbl h LYS 251 CO 0.05 0.88 0.35 0.28 -0.57 0.00 0.00 179.45 180.44 2wbl h VAL 252 N -0.38 0.87 -0.28 0.50 2.07 -1.56 -1.09 116.25 116.38 2wbl h VAL 252 Ca -0.02 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.34 2wbl h VAL 252 Cb 0.94 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 2wbl h VAL 252 CO 0.05 0.11 -0.01 0.25 0.02 0.00 0.00 177.57 177.99 2wbl h LEU 253 N 0.61 -0.12 -0.88 2.57 7.12 -1.32 -0.13 115.31 123.17 2wbl h LEU 253 Ca 0.34 0.06 -0.02 0.00 0.13 0.00 0.00 57.88 58.39 2wbl h LEU 253 Cb 0.32 0.12 -0.04 0.00 -0.53 0.00 0.00 40.66 40.53 2wbl h LEU 253 CO -0.25 -0.03 0.47 0.44 -0.13 0.00 0.00 178.44 178.94 2wbl h ASP 254 N 0.07 1.11 0.10 1.25 3.32 -0.48 -0.98 116.42 120.80 2wbl h ASP 254 Ca 0.13 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 2wbl h ASP 254 Cb 0.18 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2wbl h ASP 254 CO -0.23 0.90 -0.05 0.25 -1.72 0.00 0.00 179.24 178.39 2wbl h LEU 255 N 1.23 -0.11 -0.74 1.55 5.85 -0.82 -1.54 115.31 120.73 2wbl h LEU 255 Ca 0.31 -0.22 0.12 0.00 0.84 0.00 0.00 57.88 58.92 2wbl h LEU 255 Cb 0.05 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.02 2wbl h LEU 255 CO -0.05 0.17 0.34 0.50 -0.34 0.00 0.00 178.44 179.06 2wbl h LYS 256 N -0.39 0.52 -0.62 1.25 3.64 -0.81 0.26 116.57 120.43 2wbl h LYS 256 Ca -0.01 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 2wbl h LYS 256 Cb 0.33 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2wbl h LYS 256 CO 0.02 0.34 0.13 -0.91 -2.27 0.00 0.00 179.45 176.76 2wbl h ASN 257 N 0.53 0.96 -0.62 4.20 2.35 -1.09 -0.85 115.58 121.06 2wbl h ASN 257 Ca 0.39 -0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 2wbl h ASN 257 Cb 0.51 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.60 2wbl h ASN 257 CO -0.34 0.96 0.25 0.03 -1.65 0.00 0.00 177.43 176.68 2wbl h ARG 258 N 0.92 0.93 -0.13 0.81 3.08 -0.29 -0.81 114.38 118.89 2wbl h ARG 258 Ca 0.19 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 2wbl h ARG 258 Cb 0.39 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 2wbl h ARG 258 CO 0.01 0.79 -0.05 0.82 -1.07 0.00 0.00 179.97 180.47 2wbl h ILE 259 N 0.87 1.30 -0.51 2.04 2.04 -0.88 -2.45 117.51 119.92 2wbl h ILE 259 Ca 0.21 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 65.10 2wbl h ILE 259 Cb 0.20 1.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.94 2wbl h ILE 259 CO -0.02 0.30 0.19 -0.08 0.00 0.00 0.00 178.15 178.54 2wbl h GLU 260 N -0.06 0.36 -0.42 2.37 4.81 -1.13 -0.85 114.58 119.66 2wbl h GLU 260 Ca 0.03 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.31 2wbl h GLU 260 Cb 0.49 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.73 2wbl h GLU 260 CO 0.02 0.24 0.09 0.00 -0.73 0.00 0.00 179.01 178.62 2wbl h ALA 261 N 1.34 0.46 0.51 2.92 0.00 -1.06 -2.25 119.26 121.18 2wbl h ALA 261 Ca 0.25 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2wbl h ALA 261 Cb 0.26 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wbl h ALA 261 CO -0.24 -0.31 -0.50 0.77 0.00 0.00 0.00 179.25 178.96 2wbl h SER 262 N 0.22 -1.38 -0.79 0.00 0.02 -0.87 -2.52 113.55 108.22 2wbl h SER 262 Ca 0.21 0.11 0.18 0.00 -0.84 0.00 0.00 61.79 61.45 2wbl h SER 262 Cb 0.25 0.46 -0.12 0.00 0.14 0.00 0.00 62.40 63.13 2wbl h SER 262 CO -0.27 -0.67 0.24 0.58 -1.14 0.00 0.00 176.83 175.57 2wbl h VAL 263 N -1.01 0.49 -0.13 2.27 2.07 -0.84 0.20 116.25 119.30 2wbl h VAL 263 Ca -0.06 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.38 2wbl h VAL 263 Cb 0.88 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2wbl h VAL 263 CO -0.06 0.06 -0.04 0.58 0.02 0.00 0.00 177.57 178.12 2wbl h VAL 264 N 0.30 0.85 0.00 2.57 2.07 -1.31 -0.92 116.25 119.81 2wbl h VAL 264 Ca 0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.98 2wbl h VAL 264 Cb 0.82 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2wbl h VAL 264 CO -0.53 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 176.68 2wbl n ILE 265 N -5.17 0.00 -0.33 4.57 5.41 0.55 -3.13 119.36 121.26 2wbl n ILE 265 Ca -0.04 1.49 0.20 0.00 1.00 0.00 0.00 62.75 65.40 2wbl n ILE 265 Cb 0.10 -2.37 0.39 0.00 -0.71 0.00 0.00 39.64 37.05 2wbl n ILE 265 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2wbl h TRP 266 N 0.00 0.37 0.00 1.39 6.55 -1.09 0.15 115.95 123.32 2wbl h TRP 266 Ca 0.00 0.05 0.00 0.00 0.95 0.00 0.00 58.89 59.89 2wbl h TRP 266 Cb 0.00 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.30 2wbl h TRP 266 CO -0.04 -0.38 0.00 1.63 -1.05 0.00 0.00 178.44 178.60 2wbl n LYS 267 N -5.33 0.61 -0.45 0.49 4.01 -0.35 -5.06 118.16 112.08 2wbl n LYS 267 Ca 0.28 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.08 2wbl n LYS 267 Cb 0.91 -1.19 0.00 0.00 -0.51 0.00 0.00 35.03 34.24 2wbl n LYS 267 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 2wbl n ARG 268 N 1.42 0.00 0.00 1.97 -4.01 0.50 -5.01 116.66 111.54 2wbl n ARG 268 Ca 0.00 -0.67 0.00 0.00 -1.04 0.00 0.00 57.85 56.14 2wbl n ARG 268 Cb 0.31 -0.35 0.00 0.00 -3.04 0.00 0.00 32.46 29.37 2wbl n ARG 268 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2wbl n LYS 287 N 0.00 0.00 0.00 2.89 3.00 -1.26 -5.05 118.16 117.74 2wbl n LYS 287 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.34 2wbl n LYS 287 Cb 0.63 0.00 0.15 0.00 0.00 0.00 0.00 35.03 35.81 2wbl n LYS 287 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2wbl n ARG 288 N 0.00 0.09 0.13 1.64 0.63 -1.26 -2.99 116.66 114.90 2wbl n ARG 288 Ca 0.00 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 2wbl n ARG 288 Cb 0.00 -1.50 0.30 0.00 0.45 0.00 0.00 32.46 31.71 2wbl n ARG 288 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2wbl h GLU 289 N 0.00 0.14 0.66 -0.14 5.08 -1.97 -1.99 114.58 116.35 2wbl h GLU 289 Ca 0.00 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2wbl h GLU 289 Cb 0.05 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2wbl h GLU 289 CO 0.00 0.49 -0.46 1.25 -1.00 0.00 0.00 179.01 179.29 2wbl h LEU 290 N 0.12 -1.18 -1.43 1.33 5.85 -1.96 0.73 115.31 118.77 2wbl h LEU 290 Ca 0.01 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2wbl h LEU 290 Cb 0.70 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2wbl h LEU 290 CO 0.05 -0.68 0.46 -0.26 -0.34 0.00 0.00 178.44 177.68 2wbl h PHE 291 N -1.07 0.69 -0.25 1.25 0.04 -1.78 0.46 116.94 116.28 2wbl h PHE 291 Ca -0.08 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 2wbl h PHE 291 Cb 0.88 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 2wbl h PHE 291 CO -0.14 0.35 -0.02 1.49 -0.60 0.00 0.00 178.31 179.39 2wbl h GLU 292 N 0.67 0.46 -0.57 1.51 4.22 -1.03 -1.71 114.58 118.13 2wbl h GLU 292 Ca 0.31 -0.16 -0.11 0.00 0.08 0.00 0.00 59.36 59.49 2wbl h GLU 292 Cb 0.34 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2wbl h GLU 292 CO -0.10 0.65 -0.06 1.49 -2.18 0.00 0.00 179.01 178.80 2wbl h GLU 293 N 0.23 1.05 -0.59 1.92 4.81 0.15 -2.73 114.58 119.42 2wbl h GLU 293 Ca 0.07 -0.36 0.04 0.00 -0.13 0.00 0.00 59.36 58.98 2wbl h GLU 293 Cb 0.45 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 2wbl h GLU 293 CO 0.02 1.06 0.34 0.00 -0.73 0.00 0.00 179.01 179.69 2wbl h ARG 294 N 0.94 0.64 -0.39 1.92 3.08 -0.07 -1.81 114.38 118.70 2wbl h ARG 294 Ca 0.15 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.11 2wbl h ARG 294 Cb 0.63 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2wbl h ARG 294 CO 0.04 0.42 0.01 0.00 -1.07 0.00 0.00 179.97 179.38 2wbl h ALA 295 N 1.28 0.52 0.00 0.04 0.00 -1.20 -2.48 119.26 117.42 2wbl h ALA 295 Ca 0.25 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2wbl h ALA 295 Cb 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2wbl h ALA 295 CO -0.13 0.28 -0.16 1.05 0.00 0.00 0.00 179.25 180.29 2wbl h GLU 296 N 0.51 0.00 -0.66 0.00 9.09 -1.35 -1.04 114.58 121.13 2wbl h GLU 296 Ca 0.11 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.45 2wbl h GLU 296 Cb 0.45 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.52 2wbl h GLU 296 CO 0.02 0.16 0.13 1.79 0.05 0.00 0.00 179.01 181.17 2wbl h THR 297 N 0.00 1.26 -0.28 -1.06 1.35 -0.89 -2.70 112.91 110.59 2wbl h THR 297 Ca -0.00 -0.99 -0.06 0.00 -0.55 0.00 0.00 66.41 64.81 2wbl h THR 297 Cb 0.35 0.63 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 2wbl h THR 297 CO 0.02 0.37 -0.04 0.40 -0.25 0.00 0.00 175.52 176.02 2wbl h ILE 298 N 0.99 1.27 -0.61 6.82 2.04 -1.01 -2.64 117.51 124.37 2wbl h ILE 298 Ca 0.20 -1.04 0.11 0.00 1.00 0.00 0.00 64.86 65.13 2wbl h ILE 298 Cb 0.40 1.39 -0.08 0.00 -0.74 0.00 0.00 36.82 37.79 2wbl h ILE 298 CO 0.01 0.33 0.17 -0.07 0.00 0.00 0.00 178.15 178.59 2wbl h LEU 299 N 0.29 0.08 -0.31 1.44 3.38 -1.15 0.25 115.31 119.30 2wbl h LEU 299 Ca 0.07 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2wbl h LEU 299 Cb 0.51 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2wbl h LEU 299 CO 0.02 0.05 0.19 0.58 0.09 0.00 0.00 178.44 179.37 2wbl h VAL 300 N 0.31 1.11 -0.90 1.22 2.07 -1.41 -1.74 116.25 116.92 2wbl h VAL 300 Ca 0.32 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.61 2wbl h VAL 300 Cb 0.46 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 2wbl h VAL 300 CO -0.38 0.11 0.59 -0.07 0.02 0.00 0.00 177.57 177.84 2wbl h LEU 301 N 0.40 1.01 -0.83 2.57 3.38 -0.90 -1.13 115.31 119.81 2wbl h LEU 301 Ca 0.11 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2wbl h LEU 301 Cb 0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 2wbl h LEU 301 CO -0.02 0.71 0.44 -0.07 0.09 0.00 0.00 178.44 179.59 2wbl h LEU 302 N 1.18 1.05 -1.03 1.67 3.38 -0.06 0.15 115.31 121.64 2wbl h LEU 302 Ca 0.34 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 2wbl h LEU 302 Cb -0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 2wbl h LEU 302 CO -0.09 0.86 0.09 0.50 0.09 0.00 0.00 178.44 179.89 2wbl h LYS 303 N 1.16 0.78 0.14 1.13 3.64 -0.47 -1.15 116.57 121.80 2wbl h LYS 303 Ca 0.29 -0.17 -0.25 0.00 -1.27 0.00 0.00 60.65 59.25 2wbl h LYS 303 Cb 0.05 -0.11 0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2wbl h LYS 303 CO -0.04 0.73 -1.08 1.96 -2.27 0.00 0.00 179.45 178.75 2wbl h GLN 304 N 0.75 0.49 0.00 1.90 4.20 -0.51 -2.80 115.11 119.14 2wbl h GLN 304 Ca 0.16 -0.71 0.00 0.00 0.06 0.00 0.00 58.65 58.16 2wbl h GLN 304 Cb 0.33 0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2wbl h GLN 304 CO 0.00 1.32 0.00 0.87 -0.67 0.00 0.00 178.83 180.35 2wbl h LYS 305 N 0.00 0.00 -2.07 1.46 1.57 -0.76 -3.37 116.57 113.41 2wbl h LYS 305 Ca -0.17 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.04 2wbl h LYS 305 Cb 1.80 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.72 2wbl h LYS 305 CO 0.20 0.00 -1.01 1.19 -0.57 0.00 0.00 179.45 179.27 2wbl n PHE 306 N -2.82 0.31 0.38 -1.35 3.01 -0.44 -4.95 117.46 111.60 2wbl n PHE 306 Ca 0.04 -3.65 0.07 0.00 1.01 0.00 0.00 57.45 54.91 2wbl n PHE 306 Cb 0.44 -0.35 0.32 0.00 -0.01 0.00 0.00 39.48 39.88 2wbl n PHE 306 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2wbl n PRO 307 N 1.42 0.05 -0.09 -1.08 -0.04 -1.06 -3.14 135.00 131.06 2wbl n PRO 307 Ca 0.23 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 64.16 2wbl n PRO 307 Cb 0.50 -1.61 0.21 0.00 -0.04 0.00 0.00 33.50 32.57 2wbl n PRO 307 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wbl n GLY 308 N -0.32 1.17 3.77 0.55 0.00 -1.26 -5.04 105.19 104.06 2wbl n GLY 308 Ca 0.02 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 2wbl n GLY 308 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbl s LEU 309 N -1.74 4.32 0.90 0.99 1.43 -1.19 -5.00 118.68 118.40 2wbl s LEU 309 Ca 0.34 3.03 -0.11 0.00 -1.03 0.00 0.00 54.13 56.36 2wbl s LEU 309 Cb 0.21 -3.66 0.11 0.00 0.03 0.00 0.00 46.19 42.88 2wbl s LEU 309 CO 0.31 -0.87 1.01 -0.81 0.23 0.00 0.00 176.35 176.22 2wbl n PRO 310 N 0.71 -0.29 -2.35 1.29 -0.04 -1.26 -4.94 135.00 128.11 2wbl n PRO 310 Ca 0.02 -0.02 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 2wbl n PRO 310 Cb 0.39 -2.28 -0.02 0.00 -0.04 0.00 0.00 33.50 31.54 2wbl n PRO 310 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2wbl s GLN 311 N -4.31 4.01 0.87 0.54 0.00 -1.26 -5.01 119.66 114.50 2wbl s GLN 311 Ca 0.66 1.74 -0.12 0.00 -0.00 0.00 0.00 55.36 57.64 2wbl s GLN 311 Cb -0.24 -2.58 0.11 0.00 0.00 0.00 0.00 33.01 30.30 2wbl s GLN 311 CO 0.58 -0.33 1.11 -1.54 0.00 0.00 0.00 175.29 175.11 2wbl s SER 312 N -1.30 3.81 0.20 12.60 1.04 -1.26 -4.72 113.70 124.07 2wbl s SER 312 Ca 0.59 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 58.12 2wbl s SER 312 Cb -0.28 -1.91 0.23 0.00 0.10 0.00 0.00 66.02 64.15 2wbl s SER 312 CO 0.35 -2.39 1.65 0.28 0.98 0.00 0.00 173.24 174.10 2wbl h SER 313 N -1.38 -0.43 0.32 7.02 0.02 -1.94 0.42 113.55 117.57 2wbl h SER 313 Ca -0.49 0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2wbl h SER 313 Cb 1.30 0.32 -0.02 0.00 0.14 0.00 0.00 62.40 64.13 2wbl h SER 313 CO 0.59 -0.16 -0.30 0.25 -1.14 0.00 0.00 176.83 176.07 2wbl h LEU 314 N 0.04 -0.80 -0.53 5.07 6.46 -1.95 0.31 115.31 123.91 2wbl h LEU 314 Ca 0.29 0.07 0.09 0.00 -0.12 0.00 0.00 57.88 58.21 2wbl h LEU 314 Cb 0.45 0.27 -0.11 0.00 -0.73 0.00 0.00 40.66 40.54 2wbl h LEU 314 CO -0.56 -0.43 -0.35 0.44 -0.62 0.00 0.00 178.44 176.92 2wbl h ASP 315 N -0.64 -1.20 -0.42 1.25 3.32 -1.71 0.15 116.42 117.17 2wbl h ASP 315 Ca -0.02 0.22 0.07 0.00 0.02 0.00 0.00 57.03 57.33 2wbl h ASP 315 Cb 0.58 0.57 -0.06 0.00 0.22 0.00 0.00 39.33 40.64 2wbl h ASP 315 CO -0.05 -0.32 0.03 0.40 -1.72 0.00 0.00 179.24 177.59 2wbl h ILE 316 N -0.20 0.71 -0.81 0.35 2.04 -0.46 -1.82 117.51 117.31 2wbl h ILE 316 Ca 0.20 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 66.03 2wbl h ILE 316 Cb 0.55 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 2wbl h ILE 316 CO -0.64 0.03 0.53 -1.28 0.00 0.00 0.00 178.15 176.79 2wbl h SER 317 N 0.14 0.92 -0.01 1.72 0.87 0.17 0.84 113.55 118.20 2wbl h SER 317 Ca 0.21 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2wbl h SER 317 Cb 0.29 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2wbl h SER 317 CO -0.32 0.66 -0.01 0.11 -0.53 0.00 0.00 176.83 176.74 2wbl h LYS 318 N 1.08 -0.01 -0.52 2.24 1.57 -0.30 -2.26 116.57 118.37 2wbl h LYS 318 Ca 0.30 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 2wbl h LYS 318 Cb -0.10 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2wbl h LYS 318 CO -0.07 -0.01 0.23 0.82 -0.57 0.00 0.00 179.45 179.85 2wbl h ILE 319 N -0.01 1.21 -0.81 1.86 2.04 -0.87 -0.24 117.51 120.69 2wbl h ILE 319 Ca 0.01 -0.62 0.14 0.00 1.00 0.00 0.00 64.86 65.39 2wbl h ILE 319 Cb 0.02 0.64 -0.09 0.00 -0.74 0.00 0.00 36.82 36.65 2wbl h ILE 319 CO -0.02 0.24 0.39 -0.61 0.00 0.00 0.00 178.15 178.15 2wbl h GLN 320 N 0.71 0.55 0.00 2.37 4.15 -0.54 -3.23 115.11 119.12 2wbl h GLN 320 Ca 0.18 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.56 2wbl h GLN 320 Cb 0.16 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.73 2wbl h GLN 320 CO -0.02 0.37 -0.96 1.19 -1.93 0.00 0.00 178.83 177.48 2wbl n PHE 321 N -4.91 0.00 -1.57 3.99 3.01 -0.88 -4.98 117.46 112.12 2wbl n PHE 321 Ca 0.16 0.00 -0.52 0.00 1.01 0.00 0.00 57.45 58.09 2wbl n PHE 321 Cb 0.42 -0.11 -0.06 0.00 -0.01 0.00 0.00 39.48 39.72 2wbl n PHE 321 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2wbl n ASN 322 N -1.54 1.36 -0.00 4.37 5.15 -0.11 -4.89 115.26 119.60 2wbl n ASN 322 Ca 0.00 1.13 0.06 0.00 -0.60 0.00 0.00 54.58 55.17 2wbl n ASN 322 Cb 0.23 -1.16 -0.07 0.00 -0.53 0.00 0.00 39.78 38.26 2wbl n ASN 322 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2wbl n LYS 323 N 2.27 2.82 -2.35 1.20 5.02 -1.26 -4.34 118.16 121.52 2wbl n LYS 323 Ca 0.18 -0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.05 2wbl n LYS 323 Cb 0.18 -1.09 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 2wbl n LYS 323 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wbl s ASP 324 N -2.21 6.11 0.45 4.39 -1.08 -1.26 -4.59 116.67 118.47 2wbl s ASP 324 Ca 0.04 0.43 0.19 0.00 -0.52 0.00 0.00 52.55 52.69 2wbl s ASP 324 Cb 0.09 -2.54 1.07 0.00 -1.46 0.00 0.00 42.92 40.08 2wbl s ASP 324 CO 0.51 -1.70 1.96 1.62 0.52 0.00 0.00 175.17 178.08 2wbl h VAL 325 N 6.44 0.95 0.05 1.11 3.04 -1.93 0.02 116.25 125.92 2wbl h VAL 325 Ca -0.27 -0.81 -0.00 0.00 -1.01 0.00 0.00 66.70 64.61 2wbl h VAL 325 Cb 1.10 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 2wbl h VAL 325 CO 1.16 0.21 -0.02 1.23 -1.01 0.00 0.00 177.57 179.14 2wbl h GLY 326 N 0.88 -0.06 1.19 3.17 0.00 -1.97 -1.98 103.07 104.29 2wbl h GLY 326 Ca -0.00 0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 2wbl h GLY 326 CO 0.03 -0.02 -0.14 1.46 0.00 0.00 0.00 176.54 177.86 2wbl h GLN 327 N -0.30 0.94 -0.58 4.80 4.20 -1.91 -1.92 115.11 120.34 2wbl h GLN 327 Ca -0.01 -0.35 0.12 0.00 0.06 0.00 0.00 58.65 58.47 2wbl h GLN 327 Cb 0.28 -0.06 -0.11 0.00 0.30 0.00 0.00 27.48 27.89 2wbl h GLN 327 CO 0.01 1.01 -0.16 0.00 -0.67 0.00 0.00 178.83 179.02 2wbl h ALA 328 N 1.00 0.35 -0.19 3.87 0.00 -0.93 0.94 119.26 124.30 2wbl h ALA 328 Ca 0.13 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 2wbl h ALA 328 Cb 0.69 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2wbl h ALA 328 CO 0.05 -0.45 -0.09 0.28 0.00 0.00 0.00 179.25 179.05 2wbl h VAL 329 N -0.02 1.30 -0.55 0.00 2.07 -0.98 -2.54 116.25 115.54 2wbl h VAL 329 Ca 0.28 -1.13 0.05 0.00 0.82 0.00 0.00 66.70 66.72 2wbl h VAL 329 Cb 0.44 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 2wbl h VAL 329 CO -0.60 0.34 0.27 -0.07 0.02 0.00 0.00 177.57 177.53 2wbl h LEU 330 N 0.09 0.37 -0.21 2.57 3.38 -1.03 -0.82 115.31 119.66 2wbl h LEU 330 Ca 0.04 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2wbl h LEU 330 Cb 0.56 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2wbl h LEU 330 CO 0.03 0.25 -0.04 -0.08 0.09 0.00 0.00 178.44 178.69 2wbl h GLU 331 N 0.51 0.40 0.09 1.13 4.57 -0.75 -2.15 114.58 118.39 2wbl h GLU 331 Ca 0.25 -0.15 -0.27 0.00 -1.18 0.00 0.00 59.36 58.00 2wbl h GLU 331 Cb 0.17 -0.03 0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2wbl h GLU 331 CO -0.18 0.64 -1.17 0.66 -1.18 0.00 0.00 179.01 177.78 2wbl h SER 332 N 0.13 0.66 -0.55 1.04 4.64 -1.41 -1.57 113.55 116.49 2wbl h SER 332 Ca 0.05 -0.61 0.01 0.00 -0.47 0.00 0.00 61.79 60.77 2wbl h SER 332 Cb 0.48 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 2wbl h SER 332 CO 0.02 1.44 0.36 0.22 -0.87 0.00 0.00 176.83 178.00 2wbl h TYR 333 N 0.21 0.68 -0.32 4.77 3.20 -1.24 -0.62 116.97 123.65 2wbl h TYR 333 Ca -0.15 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.68 2wbl h TYR 333 Cb 1.84 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.87 2wbl h TYR 333 CO 0.09 0.42 -0.06 0.66 -1.64 0.00 0.00 178.16 177.62 2wbl h SER 334 N 0.72 0.49 -0.04 -2.11 4.64 -1.35 -2.47 113.55 113.43 2wbl h SER 334 Ca 0.21 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2wbl h SER 334 Cb -0.06 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 61.90 2wbl h SER 334 CO -0.06 0.60 -0.01 -0.09 -0.87 0.00 0.00 176.83 176.40 2wbl h ARG 335 N 0.48 0.09 -0.06 4.77 2.43 -0.69 -0.85 114.38 120.55 2wbl h ARG 335 Ca 0.10 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2wbl h ARG 335 Cb 0.40 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2wbl h ARG 335 CO 0.02 0.45 -0.27 -0.84 -1.51 0.00 0.00 179.97 177.82 2wbl h ILE 336 N -0.28 1.22 -0.24 1.20 3.07 -1.07 -1.96 117.51 119.44 2wbl h ILE 336 Ca 0.01 -1.05 -0.18 0.00 1.55 0.00 0.00 64.86 65.19 2wbl h ILE 336 Cb 0.42 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.46 2wbl h ILE 336 CO 0.01 0.31 -0.57 -0.07 -1.05 0.00 0.00 178.15 176.77 2wbl h LEU 337 N 0.09 0.92 -0.95 0.16 3.38 -1.37 0.23 115.31 117.77 2wbl h LEU 337 Ca 0.01 -0.56 0.12 0.00 0.09 0.00 0.00 57.88 57.54 2wbl h LEU 337 Cb 0.54 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 2wbl h LEU 337 CO 0.04 1.31 0.58 -0.08 0.09 0.00 0.00 178.44 180.38 2wbl h GLU 338 N 0.57 0.89 0.00 1.13 4.81 -0.71 -0.14 114.58 121.13 2wbl h GLU 338 Ca -0.00 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2wbl h GLU 338 Cb 1.19 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.36 2wbl h GLU 338 CO 0.12 0.59 -0.72 0.66 -0.73 0.00 0.00 179.01 178.93 2wbl h SER 339 N 0.92 0.00 0.20 1.04 4.64 -0.92 -1.40 113.55 118.02 2wbl h SER 339 Ca 0.47 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.78 2wbl h SER 339 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2wbl h SER 339 CO -0.27 0.09 -0.10 0.25 -0.87 0.00 0.00 176.83 175.93 2wbl h LEU 340 N 0.00 -0.23 -0.91 5.97 5.85 -0.25 -1.90 115.31 123.83 2wbl h LEU 340 Ca -0.02 -0.29 0.26 0.00 0.84 0.00 0.00 57.88 58.67 2wbl h LEU 340 Cb 1.08 0.06 -0.15 0.00 0.37 0.00 0.00 40.66 42.02 2wbl h LEU 340 CO 0.01 0.23 0.26 0.00 -0.34 0.00 0.00 178.44 178.60 2wbl h ALA 341 N -0.16 1.38 -0.56 1.25 0.00 -1.00 0.23 119.26 120.41 2wbl h ALA 341 Ca -0.03 0.24 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2wbl h ALA 341 Cb 0.51 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2wbl h ALA 341 CO 0.05 -0.51 -0.03 -0.92 0.00 0.00 0.00 179.25 177.83 2wbl h TYR 342 N 0.19 1.10 -0.41 0.00 3.20 -1.24 -1.34 116.97 118.47 2wbl h TYR 342 Ca 0.59 -0.20 0.04 0.00 3.14 0.00 0.00 58.73 62.29 2wbl h TYR 342 Cb 1.24 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 2wbl h TYR 342 CO -0.25 1.00 0.19 1.15 -1.64 0.00 0.00 178.16 178.61 2wbl h THR 343 N 0.88 0.95 -0.22 1.81 2.02 0.27 0.35 112.91 118.97 2wbl h THR 343 Ca 0.15 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 2wbl h THR 343 Cb 0.59 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2wbl h THR 343 CO 0.04 0.07 0.01 0.58 0.37 0.00 0.00 175.52 176.58 2wbl h VAL 344 N 0.39 1.25 -0.67 3.16 2.07 -1.19 0.15 116.25 121.41 2wbl h VAL 344 Ca 0.18 -0.86 0.10 0.00 0.82 0.00 0.00 66.70 66.94 2wbl h VAL 344 Cb 0.11 1.38 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 2wbl h VAL 344 CO -0.14 0.27 0.30 0.24 0.02 0.00 0.00 177.57 178.26 2wbl h MET 345 N 0.16 0.50 0.27 1.57 2.07 -0.96 0.10 114.93 118.64 2wbl h MET 345 Ca 0.06 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.66 2wbl h MET 345 Cb 0.39 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 29.99 2wbl h MET 345 CO 0.01 0.33 -0.19 1.03 1.07 0.00 0.00 176.91 179.16 2wbl h SER 346 N 0.51 -0.49 -0.02 1.22 0.87 0.03 -1.33 113.55 114.34 2wbl h SER 346 Ca 0.33 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.88 2wbl h SER 346 Cb 0.38 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2wbl h SER 346 CO -0.29 -0.30 -0.11 0.03 -0.53 0.00 0.00 176.83 175.63 2wbl h ARG 347 N -0.46 0.28 0.49 2.24 -0.00 -0.05 -1.84 114.38 115.04 2wbl h ARG 347 Ca -0.02 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.98 59.37 2wbl h ARG 347 Cb 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.33 2wbl h ARG 347 CO 0.01 0.40 -0.24 0.82 0.00 0.00 0.00 179.97 180.96 2wbl h ILE 348 N 0.27 0.35 -0.61 2.04 2.04 -0.77 -3.24 117.51 117.59 2wbl h ILE 348 Ca 0.06 -0.46 0.18 0.00 1.00 0.00 0.00 64.86 65.63 2wbl h ILE 348 Cb 0.36 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2wbl h ILE 348 CO 0.02 0.06 0.64 -0.33 0.00 0.00 0.00 178.15 178.53 2wbl h GLU 349 N -1.00 0.00 0.56 2.37 4.39 -0.84 -0.20 114.58 119.86 2wbl h GLU 349 Ca -0.07 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 2wbl h GLU 349 Cb 0.60 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.25 2wbl h GLU 349 CO 0.11 0.00 -0.27 -0.44 -1.16 0.00 0.00 179.01 177.25 2wbl h ASP 350 N 0.00 -0.64 -0.64 1.42 5.19 -1.37 -1.32 116.42 119.05 2wbl h ASP 350 Ca 0.29 -0.04 0.13 0.00 -0.62 0.00 0.00 57.03 56.79 2wbl h ASP 350 Cb 1.56 0.17 -0.12 0.00 0.18 0.00 0.00 39.33 41.11 2wbl h ASP 350 CO -0.00 -0.28 -0.16 0.58 -3.12 0.00 0.00 179.24 176.26 2wbl h VAL 351 N -1.06 0.35 -0.07 -1.35 2.07 -1.10 0.16 116.25 115.25 2wbl h VAL 351 Ca -0.08 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2wbl h VAL 351 Cb 0.64 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2wbl h VAL 351 CO 0.13 0.00 0.03 -0.07 0.02 0.00 0.00 177.57 177.68 2wbl h LEU 352 N -0.00 0.09 -0.76 2.57 3.38 -1.43 0.37 115.31 119.53 2wbl h LEU 352 Ca 0.31 -0.15 0.08 0.00 0.09 0.00 0.00 57.88 58.21 2wbl h LEU 352 Cb 0.47 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 2wbl h LEU 352 CO -0.66 0.22 0.43 0.22 0.09 0.00 0.00 178.44 178.73 2wbl h TYR 353 N -0.03 0.77 -0.55 1.13 3.20 -0.86 0.14 116.97 120.76 2wbl h TYR 353 Ca 0.02 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.82 2wbl h TYR 353 Cb 0.15 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.17 2wbl h TYR 353 CO -0.02 0.33 -0.04 1.15 -1.64 0.00 0.00 178.16 177.94 2wbl h THR 354 N 0.74 1.27 0.11 1.81 2.02 0.13 -0.98 112.91 118.01 2wbl h THR 354 Ca 0.36 -1.17 0.01 0.00 0.77 0.00 0.00 66.41 66.37 2wbl h THR 354 Cb 0.30 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2wbl h THR 354 CO -0.23 0.42 -0.12 -0.78 0.37 0.00 0.00 175.52 175.18 2wbl h ASP 355 N 0.88 -0.32 -0.50 4.18 -0.00 0.09 -2.53 116.42 118.23 2wbl h ASP 355 Ca 0.15 0.03 0.09 0.00 -0.00 0.00 0.00 57.03 57.31 2wbl h ASP 355 Cb 0.59 0.11 -0.07 0.00 -0.00 0.00 0.00 39.33 39.96 2wbl h ASP 355 CO 0.04 -0.18 0.06 0.74 -0.00 0.00 0.00 179.24 179.90 2wbl h THR 356 N -0.26 0.68 -0.63 2.25 2.02 -0.64 -2.04 112.91 114.28 2wbl h THR 356 Ca 0.01 -0.07 0.03 0.00 0.77 0.00 0.00 66.41 67.15 2wbl h THR 356 Cb 0.26 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2wbl h THR 356 CO -0.04 0.03 0.39 -0.07 0.37 0.00 0.00 175.52 176.20 2wbl h LEU 357 N 0.19 0.64 -1.60 2.58 3.38 -1.06 -0.93 115.31 118.51 2wbl h LEU 357 Ca 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 2wbl h LEU 357 Cb 0.36 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2wbl h LEU 357 CO -0.36 0.44 -0.21 0.00 0.09 0.00 0.00 178.44 178.40 2wbl h ALA 358 N 1.27 1.57 -0.02 1.53 0.00 -0.97 -1.95 119.26 120.70 2wbl h ALA 358 Ca 0.25 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.74 2wbl h ALA 358 Cb 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.80 2wbl h ALA 358 CO -0.10 0.27 -0.89 -0.07 0.00 0.00 0.00 179.25 178.45 2wbl h LEU 359 N 0.00 0.82 -0.21 0.00 3.38 -0.89 -3.18 115.31 115.23 2wbl h LEU 359 Ca -0.00 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.24 2wbl h LEU 359 Cb 0.39 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2wbl h LEU 359 CO 0.03 1.43 0.00 0.29 0.09 0.00 0.00 178.44 180.28 2wbl n LYS 360 N -3.97 0.04 -0.11 1.13 5.02 -0.40 -1.47 118.16 118.41 2wbl n LYS 360 Ca -0.10 0.38 0.01 0.00 -2.02 0.00 0.00 58.31 56.58 2wbl n LYS 360 Cb 0.81 -1.59 0.06 0.00 -0.02 0.00 0.00 35.03 34.28 2wbl n LYS 360 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2wbl n GLN 361 N -1.66 1.46 0.00 1.97 7.27 -0.77 -4.72 117.38 120.93 2wbl n GLN 361 Ca 0.02 -0.44 0.00 0.00 0.07 0.00 0.00 57.00 56.65 2wbl n GLN 361 Cb 0.12 -1.44 0.00 0.00 2.41 0.00 0.00 30.24 31.33 2wbl n GLN 361 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 2wbl n THR 362 N 0.00 0.00 -1.18 1.69 -2.24 -0.54 -5.09 114.28 106.92 2wbl n THR 362 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2wbl n THR 362 Cb 0.29 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2wbl n THR 362 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50