#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbl s PHE 6 N 0.00 -0.09 -0.11 2.89 0.40 -1.26 -2.64 117.98 117.16 2wbl s PHE 6 Ca 0.00 0.33 0.03 0.00 -0.60 0.00 0.00 56.93 56.69 2wbl s PHE 6 Cb 0.00 -0.10 0.00 0.00 0.51 0.00 0.00 43.02 43.43 2wbl s PHE 6 CO 0.00 -0.12 -0.22 0.42 0.70 0.00 0.00 175.22 176.00 2wbl s ILE 7 N 0.89 1.99 -0.26 0.64 1.01 0.08 -4.95 121.20 120.60 2wbl s ILE 7 Ca -0.07 -0.97 -0.10 0.00 0.00 0.00 0.00 60.65 59.51 2wbl s ILE 7 Cb -0.09 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.59 2wbl s ILE 7 CO -0.04 0.54 0.16 -0.75 0.00 0.00 0.00 174.94 174.85 2wbl s LYS 8 N 0.55 3.93 -0.16 2.79 2.20 -1.26 -0.30 119.74 127.50 2wbl s LYS 8 Ca -0.14 -0.33 0.02 0.00 -0.36 0.00 0.00 55.97 55.15 2wbl s LYS 8 Cb -0.17 -3.57 0.01 0.00 -1.51 0.00 0.00 37.83 32.60 2wbl s LYS 8 CO 0.04 -0.11 -0.21 0.00 -0.36 0.00 0.00 175.35 174.72 2wbl s VAL 10 N 1.05 2.11 -0.24 0.00 1.01 -0.57 -0.45 120.40 123.32 2wbl s VAL 10 Ca -0.01 -0.96 -0.22 0.00 0.00 0.00 0.00 61.98 60.79 2wbl s VAL 10 Cb -0.14 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 2wbl s VAL 10 CO -0.07 0.55 0.71 -0.89 0.00 0.00 0.00 175.10 175.39 2wbl s THR 11 N 0.86 4.93 0.15 3.92 2.01 -0.70 -0.38 115.64 126.42 2wbl s THR 11 Ca -0.06 1.31 0.07 0.00 0.31 0.00 0.00 61.69 63.32 2wbl s THR 11 Cb -0.15 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 2wbl s THR 11 CO -0.03 -0.00 -0.15 0.68 -0.69 0.00 0.00 174.62 174.43 2wbl s VAL 12 N 2.55 1.51 -5.00 3.82 -7.23 0.74 -3.42 120.40 113.38 2wbl s VAL 12 Ca 0.30 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 2wbl s VAL 12 Cb -0.15 -1.72 0.00 0.00 0.56 0.00 0.00 36.38 35.06 2wbl s VAL 12 CO 0.08 -0.45 0.00 0.61 -0.31 0.00 0.00 175.10 175.04 2wbl n GLY 13 N 0.26 -0.56 0.81 2.32 0.00 -1.26 -0.50 105.19 106.27 2wbl n GLY 13 Ca -0.13 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.21 2wbl n GLY 13 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wbl n ASP 14 N 3.00 -2.09 -4.92 1.61 9.92 -1.26 -4.69 116.55 118.12 2wbl n ASP 14 Ca 0.00 -0.37 -0.26 0.00 -0.53 0.00 0.00 54.79 53.62 2wbl n ASP 14 Cb 0.00 -0.25 0.01 0.00 -0.64 0.00 0.00 41.12 40.24 2wbl n ASP 14 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2wbl s GLY 15 N -2.52 1.53 -1.47 0.44 0.00 -1.26 -4.38 107.32 99.65 2wbl s GLY 15 Ca 0.17 -0.64 -0.14 0.00 0.00 0.00 0.00 44.72 44.11 2wbl s GLY 15 CO 0.14 -0.45 0.69 0.00 0.00 0.00 0.00 173.10 173.48 2wbl n ALA 16 N -2.31 -1.17 -0.04 3.20 0.00 -1.26 -4.84 120.51 114.10 2wbl n ALA 16 Ca 0.01 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2wbl n ALA 16 Cb 0.56 -3.34 -0.12 0.00 0.00 0.00 0.00 19.45 16.54 2wbl n ALA 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wbl n VAL 17 N -4.22 0.54 0.00 0.00 0.31 -1.26 -4.88 118.33 108.82 2wbl n VAL 17 Ca 0.03 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 63.85 2wbl n VAL 17 Cb 0.52 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 2wbl n VAL 17 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wbl n GLY 18 N 1.83 1.18 0.40 2.92 0.00 -1.26 -4.65 105.19 105.61 2wbl n GLY 18 Ca -0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 2wbl n GLY 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wbl n LYS 19 N -1.50 -0.42 -0.12 1.61 5.02 -1.26 -0.66 118.16 120.83 2wbl n LYS 19 Ca 0.00 1.48 -0.11 0.00 -2.02 0.00 0.00 58.31 57.67 2wbl n LYS 19 Cb 0.00 -2.18 -0.02 0.00 -0.02 0.00 0.00 35.03 32.80 2wbl n LYS 19 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2wbl h THR 20 N 0.00 1.27 -1.00 -0.18 2.02 -1.97 -2.88 112.91 110.17 2wbl h THR 20 Ca 0.15 -1.04 0.06 0.00 0.77 0.00 0.00 66.41 66.35 2wbl h THR 20 Cb 0.39 1.24 -0.07 0.00 -1.74 0.00 0.00 68.15 67.98 2wbl h THR 20 CO -0.90 0.34 0.65 0.00 0.37 0.00 0.00 175.52 175.98 2wbl h MET 22 N 1.18 0.40 -0.14 0.00 -1.53 -0.70 0.39 114.93 114.53 2wbl h MET 22 Ca 0.43 -0.02 -0.04 0.00 -3.44 0.00 0.00 59.70 56.63 2wbl h MET 22 Cb 0.16 -0.09 -0.00 0.00 -0.55 0.00 0.00 31.60 31.12 2wbl h MET 22 CO -0.17 0.26 -0.06 -0.07 0.14 0.00 0.00 176.91 177.01 2wbl h LEU 23 N 0.41 0.30 -0.57 3.39 3.38 -1.17 0.99 115.31 122.05 2wbl h LEU 23 Ca 0.17 -0.40 0.06 0.00 0.09 0.00 0.00 57.88 57.79 2wbl h LEU 23 Cb 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2wbl h LEU 23 CO -0.11 0.64 0.27 0.40 0.09 0.00 0.00 178.44 179.73 2wbl h ILE 24 N -0.03 0.91 0.25 1.22 2.04 -0.78 -1.46 117.51 119.66 2wbl h ILE 24 Ca 0.03 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.72 2wbl h ILE 24 Cb 0.52 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2wbl h ILE 24 CO 0.02 0.09 -0.51 -1.28 0.00 0.00 0.00 178.15 176.48 2wbl h SER 25 N 0.51 -1.48 -0.77 1.72 0.87 0.04 -1.42 113.55 113.03 2wbl h SER 25 Ca 0.26 0.14 0.12 0.00 -1.23 0.00 0.00 61.79 61.08 2wbl h SER 25 Cb 0.21 0.53 -0.08 0.00 -0.44 0.00 0.00 62.40 62.61 2wbl h SER 25 CO -0.20 -0.58 0.38 0.22 -0.53 0.00 0.00 176.83 176.12 2wbl h TYR 26 N -0.82 0.67 0.00 2.24 3.20 -0.23 -3.32 116.97 118.71 2wbl h TYR 26 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2wbl h TYR 26 Cb 0.77 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.86 2wbl h TYR 26 CO -0.38 0.19 0.00 2.41 -1.64 0.00 0.00 178.16 178.74 2wbl n THR 27 N -4.88 0.00 0.00 1.81 -1.04 -0.60 -5.04 114.28 104.53 2wbl n THR 27 Ca 0.14 0.38 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 2wbl n THR 27 Cb 0.35 -1.16 0.00 0.00 -1.82 0.00 0.00 70.33 67.70 2wbl n THR 27 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wbl n GLY 28 N 2.08 0.57 2.24 3.41 0.00 -0.54 -5.10 105.19 107.86 2wbl n GLY 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wbl n GLY 28 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wbl n PRO 37 N 0.00 0.00 -1.82 1.61 -0.07 -1.26 -4.99 135.00 128.48 2wbl n PRO 37 Ca 0.00 0.00 -0.23 0.00 -0.07 0.00 0.00 63.50 63.20 2wbl n PRO 37 Cb 0.00 0.00 -0.05 0.00 -0.07 0.00 0.00 33.50 33.38 2wbl n PRO 37 CO 0.00 0.00 0.00 -0.08 -0.07 0.00 0.00 175.50 175.35 2wbl s THR 38 N 0.00 3.23 -0.16 0.58 -1.32 -1.26 -4.92 115.64 111.80 2wbl s THR 38 Ca 0.00 -0.14 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 2wbl s THR 38 Cb 0.00 -3.53 0.03 0.00 -1.51 0.00 0.00 72.50 67.49 2wbl s THR 38 CO 0.00 -0.50 -0.13 -0.69 -2.21 0.00 0.00 174.62 171.10 2wbl s VAL 39 N 12.03 1.53 -0.31 5.08 1.01 -1.26 -5.02 120.40 133.45 2wbl s VAL 39 Ca 0.81 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 2wbl s VAL 39 Cb -0.11 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.83 2wbl s VAL 39 CO 0.07 0.38 0.05 0.12 0.00 0.00 0.00 175.10 175.72 2wbl s PHE 40 N 1.49 3.23 0.48 5.22 5.36 -1.26 -5.03 117.98 127.48 2wbl s PHE 40 Ca 0.04 -1.58 -0.15 0.00 -0.96 0.00 0.00 56.93 54.28 2wbl s PHE 40 Cb -0.14 -2.19 -0.08 0.00 -0.34 0.00 0.00 43.02 40.28 2wbl s PHE 40 CO -0.10 -0.75 0.92 -0.51 -1.46 0.00 0.00 175.22 173.33 2wbl s ASP 41 N 1.34 6.61 -0.03 6.13 1.01 -1.26 -4.79 116.67 125.68 2wbl s ASP 41 Ca -0.03 1.45 -0.37 0.00 0.71 0.00 0.00 52.55 54.31 2wbl s ASP 41 Cb -0.19 -2.46 -0.16 0.00 1.01 0.00 0.00 42.92 41.12 2wbl s ASP 41 CO 0.01 -0.53 1.53 0.59 0.21 0.00 0.00 175.17 176.98 2wbl n ASN 42 N -1.46 2.17 -4.26 0.27 5.03 -1.26 -4.93 115.26 110.81 2wbl n ASN 42 Ca 0.05 1.09 -0.28 0.00 0.87 0.00 0.00 54.58 56.32 2wbl n ASN 42 Cb 0.54 -1.21 -0.15 0.00 -1.02 0.00 0.00 39.78 37.94 2wbl n ASN 42 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2wbl s PHE 43 N 1.77 2.00 -0.07 3.10 2.19 -1.07 -4.99 117.98 120.91 2wbl s PHE 43 Ca 0.89 -0.38 -0.03 0.00 0.33 0.00 0.00 56.93 57.74 2wbl s PHE 43 Cb -0.94 -1.24 0.04 0.00 -1.31 0.00 0.00 43.02 39.56 2wbl s PHE 43 CO 0.52 0.03 0.14 0.45 1.83 0.00 0.00 175.22 178.19 2wbl s SER 44 N -0.83 -0.01 0.05 6.13 0.15 -1.26 -0.01 113.70 117.93 2wbl s SER 44 Ca 0.09 0.30 -0.09 0.00 0.70 0.00 0.00 55.95 56.94 2wbl s SER 44 Cb -0.09 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 2wbl s SER 44 CO 0.00 -0.16 0.19 0.00 1.20 0.00 0.00 173.24 174.48 2wbl s ALA 45 N 1.30 -0.32 0.16 5.45 0.00 -0.68 -4.96 121.76 122.71 2wbl s ALA 45 Ca -0.08 -0.37 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 2wbl s ALA 45 Cb -0.12 0.33 -0.07 0.00 0.00 0.00 0.00 23.12 23.26 2wbl s ALA 45 CO -0.06 -0.40 1.19 -0.80 0.00 0.00 0.00 175.76 175.70 2wbl s ASN 46 N -2.29 7.09 0.03 0.00 0.01 -1.26 -0.99 114.94 117.53 2wbl s ASN 46 Ca -0.02 2.18 0.04 0.00 -0.71 0.00 0.00 52.86 54.34 2wbl s ASN 46 Cb 0.01 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 39.05 2wbl s ASN 46 CO -0.06 -0.39 -0.11 0.68 -1.51 0.00 0.00 177.10 175.72 2wbl s VAL 47 N 0.20 0.85 -0.06 1.60 -7.23 -0.42 -4.95 120.40 110.39 2wbl s VAL 47 Ca 0.54 -0.87 -0.19 0.00 -1.81 0.00 0.00 61.98 59.65 2wbl s VAL 47 Cb -0.32 -0.79 -0.05 0.00 0.56 0.00 0.00 36.38 35.78 2wbl s VAL 47 CO 0.35 -0.06 0.52 0.68 -0.31 0.00 0.00 175.10 176.27 2wbl s VAL 48 N -0.84 5.07 -0.13 1.32 -7.23 -1.26 -0.46 120.40 116.87 2wbl s VAL 48 Ca -0.01 1.07 0.03 0.00 -1.81 0.00 0.00 61.98 61.26 2wbl s VAL 48 Cb -0.07 -3.86 0.01 0.00 0.56 0.00 0.00 36.38 33.02 2wbl s VAL 48 CO 0.01 0.38 -0.22 -0.69 -0.31 0.00 0.00 175.10 174.27 2wbl s VAL 49 N 0.17 2.00 -0.43 1.32 1.01 -0.59 -4.90 120.40 118.98 2wbl s VAL 49 Ca 0.28 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 2wbl s VAL 49 Cb -0.16 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.45 2wbl s VAL 49 CO 0.13 0.54 0.03 -0.90 0.00 0.00 0.00 175.10 174.91 2wbl n ASP 50 N 3.96 0.04 0.00 3.32 5.75 -1.26 -1.98 116.55 126.38 2wbl n ASP 50 Ca -0.20 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.22 2wbl n ASP 50 Cb 0.52 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2wbl n ASP 50 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wbl n GLY 51 N -1.42 2.36 3.81 6.12 0.00 -1.26 -5.09 105.19 109.70 2wbl n GLY 51 Ca -0.08 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 2wbl n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wbl s SER 52 N 0.00 5.05 -0.09 1.61 0.01 -0.84 -5.06 113.70 114.38 2wbl s SER 52 Ca 0.00 -0.60 -0.14 0.00 1.31 0.00 0.00 55.95 56.52 2wbl s SER 52 Cb 0.00 -0.88 -0.05 0.00 0.21 0.00 0.00 66.02 65.30 2wbl s SER 52 CO 0.00 -0.33 0.34 0.42 0.41 0.00 0.00 173.24 174.08 2wbl s THR 53 N -2.35 5.21 0.17 1.44 -4.23 -1.26 -1.54 115.64 113.08 2wbl s THR 53 Ca 0.40 0.67 0.09 0.00 -1.18 0.00 0.00 61.69 61.67 2wbl s THR 53 Cb -0.04 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 2wbl s THR 53 CO 0.25 0.48 -0.14 0.68 -0.54 0.00 0.00 174.62 175.35 2wbl s VAL 54 N -0.26 2.96 -0.34 2.29 -7.23 0.40 -4.60 120.40 113.61 2wbl s VAL 54 Ca 0.20 -1.72 -0.15 0.00 -1.81 0.00 0.00 61.98 58.51 2wbl s VAL 54 Cb -0.15 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.34 2wbl s VAL 54 CO 0.08 -0.08 0.33 0.21 -0.31 0.00 0.00 175.10 175.34 2wbl s ASN 55 N -2.69 6.15 -0.24 4.85 3.84 -1.08 -1.30 114.94 124.47 2wbl s ASN 55 Ca 0.23 -0.26 -0.13 0.00 0.21 0.00 0.00 52.86 52.90 2wbl s ASN 55 Cb -0.09 -2.18 -0.04 0.00 -0.55 0.00 0.00 41.25 38.39 2wbl s ASN 55 CO 0.13 -0.31 0.30 -0.22 -2.79 0.00 0.00 177.10 174.21 2wbl s LEU 56 N 1.95 4.09 -0.26 3.21 2.96 -0.16 -0.74 118.68 129.73 2wbl s LEU 56 Ca 0.11 0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 54.24 2wbl s LEU 56 Cb -0.17 -2.33 0.01 0.00 0.50 0.00 0.00 46.19 44.20 2wbl s LEU 56 CO 0.11 -0.07 -0.00 -0.83 -1.32 0.00 0.00 176.35 174.24 2wbl s GLY 57 N 1.34 1.68 -0.16 7.98 0.00 0.59 -1.68 107.32 117.08 2wbl s GLY 57 Ca 0.13 -1.36 -0.06 0.00 0.00 0.00 0.00 44.72 43.43 2wbl s GLY 57 CO 0.08 0.54 0.05 1.08 0.00 0.00 0.00 173.10 174.85 2wbl s LEU 58 N 1.44 3.80 -0.12 0.66 1.43 0.98 -0.25 118.68 126.62 2wbl s LEU 58 Ca 0.03 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 2wbl s LEU 58 Cb -0.16 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.13 2wbl s LEU 58 CO -0.01 0.24 -0.23 0.26 0.23 0.00 0.00 176.35 176.84 2wbl s TRP 59 N -0.02 2.58 0.34 0.29 0.52 0.41 -2.61 118.94 120.45 2wbl s TRP 59 Ca 0.06 -1.16 -0.15 0.00 0.02 0.00 0.00 56.10 54.87 2wbl s TRP 59 Cb -0.12 -1.74 -0.09 0.00 -1.15 0.00 0.00 33.47 30.37 2wbl s TRP 59 CO 0.01 -0.50 0.75 0.34 0.02 0.00 0.00 176.95 177.58 2wbl s ASP 60 N 0.54 6.75 0.00 2.95 2.15 -1.26 -1.72 116.67 126.08 2wbl s ASP 60 Ca -0.14 1.28 0.01 0.00 0.43 0.00 0.00 52.55 54.13 2wbl s ASP 60 Cb -0.17 -2.37 0.02 0.00 -0.30 0.00 0.00 42.92 40.10 2wbl s ASP 60 CO 0.04 -0.24 0.97 0.35 -0.17 0.00 0.00 175.17 176.13 2wbl n THR 61 N -0.51 0.91 -1.51 1.71 -2.24 -1.22 -4.88 114.28 106.54 2wbl n THR 61 Ca 0.04 -0.95 -0.57 0.00 -2.27 0.00 0.00 64.05 60.29 2wbl n THR 61 Cb 0.53 0.55 -0.07 0.00 -2.10 0.00 0.00 70.33 69.24 2wbl n THR 61 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wbl n ALA 62 N -0.38 -3.11 0.00 6.98 0.00 -1.26 -1.56 120.51 121.18 2wbl n ALA 62 Ca 0.01 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2wbl n ALA 62 Cb 0.24 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 17.88 2wbl n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wbl n GLY 63 N 1.71 3.22 0.21 0.00 0.00 -1.26 -4.89 105.19 104.17 2wbl n GLY 63 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 2wbl n GLY 63 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2wbl h GLN 64 N 1.51 0.65 -1.35 1.61 4.15 -1.48 -1.79 115.11 118.39 2wbl h GLN 64 Ca 0.00 -0.06 0.39 0.00 0.77 0.00 0.00 58.65 59.75 2wbl h GLN 64 Cb 0.00 -0.14 -0.06 0.00 0.21 0.00 0.00 27.48 27.49 2wbl h GLN 64 CO 0.00 0.48 0.96 0.93 -1.93 0.00 0.00 178.83 179.27 2wbl h GLU 65 N 0.64 0.04 0.17 1.69 3.07 -1.84 -1.36 114.58 116.98 2wbl h GLU 65 Ca 0.17 -0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.68 2wbl h GLU 65 Cb -0.01 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2wbl h GLU 65 CO -0.03 0.03 -1.77 -0.44 -1.40 0.00 0.00 179.01 175.39 2wbl h ASP 66 N 0.04 0.55 -2.07 1.42 3.32 -1.74 -3.46 116.42 114.48 2wbl h ASP 66 Ca 0.66 -0.93 -0.14 0.00 0.02 0.00 0.00 57.03 56.64 2wbl h ASP 66 Cb 2.54 -0.18 -0.29 0.00 0.22 0.00 0.00 39.33 41.62 2wbl h ASP 66 CO -0.06 1.79 -0.46 -0.47 -1.72 0.00 0.00 179.24 178.32 2wbl s TYR 67 N -2.56 -0.80 0.28 4.55 5.04 -0.52 -5.06 117.35 118.28 2wbl s TYR 67 Ca -0.18 0.99 -0.03 0.00 -2.44 0.00 0.00 57.07 55.42 2wbl s TYR 67 Cb 0.06 0.08 0.40 0.00 0.35 0.00 0.00 41.96 42.84 2wbl s TYR 67 CO 0.83 -0.65 1.91 -0.97 -1.34 0.00 0.00 175.55 175.33 2wbl h ASN 68 N 8.18 0.93 0.14 4.32 -1.24 -1.82 -2.56 115.58 123.54 2wbl h ASN 68 Ca -0.18 -0.07 0.00 0.00 0.71 0.00 0.00 56.30 56.76 2wbl h ASN 68 Cb 1.14 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.96 2wbl h ASN 68 CO 0.23 0.74 0.00 0.54 -1.29 0.00 0.00 177.43 177.66 2wbl n ARG 69 N -4.36 0.24 0.08 6.67 1.74 -1.26 -3.00 116.66 116.76 2wbl n ARG 69 Ca 0.08 0.11 -0.02 0.00 -0.77 0.00 0.00 57.85 57.25 2wbl n ARG 69 Cb 0.09 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.25 2wbl n ARG 69 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2wbl h LEU 70 N 0.00 0.29 -6.53 0.55 6.46 -1.81 -3.40 115.31 110.88 2wbl h LEU 70 Ca 0.00 -0.12 -0.60 0.00 -0.12 0.00 0.00 57.88 57.05 2wbl h LEU 70 Cb 0.07 -0.08 -0.39 0.00 -0.73 0.00 0.00 40.66 39.53 2wbl h LEU 70 CO 0.00 0.66 -0.87 0.54 -0.62 0.00 0.00 178.44 178.15 2wbl n ARG 71 N -4.05 0.72 0.29 1.25 1.74 -1.16 -4.97 116.66 110.48 2wbl n ARG 71 Ca -0.01 -3.57 0.17 0.00 -0.77 0.00 0.00 57.85 53.67 2wbl n ARG 71 Cb 0.47 -1.82 0.83 0.00 -1.02 0.00 0.00 32.46 30.91 2wbl n ARG 71 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2wbl h PRO 72 N 5.42 0.00 0.00 5.56 0.11 -1.82 -3.02 132.00 138.25 2wbl h PRO 72 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2wbl h PRO 72 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2wbl h PRO 72 CO 0.48 0.05 -0.76 1.28 -0.21 0.00 0.00 178.00 178.84 2wbl n LEU 73 N -3.26 0.72 -0.31 2.35 4.77 -1.26 -4.54 117.00 115.47 2wbl n LEU 73 Ca -0.01 -0.21 0.16 0.00 -0.03 0.00 0.00 56.01 55.92 2wbl n LEU 73 Cb 0.23 -0.13 0.33 0.00 -2.33 0.00 0.00 43.42 41.52 2wbl n LEU 73 CO 0.26 0.17 0.94 0.28 -1.33 0.00 0.00 177.39 177.71 2wbl h SER 74 N 0.00 -0.03 0.00 -1.43 0.02 -1.93 -2.61 113.55 107.57 2wbl h SER 74 Ca 0.00 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2wbl h SER 74 Cb 0.52 0.30 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2wbl h SER 74 CO 0.00 -0.22 -1.82 -1.22 -1.14 0.00 0.00 176.83 172.43 2wbl n TYR 75 N -5.27 0.00 -2.11 3.45 0.53 -1.26 -4.83 117.16 107.66 2wbl n TYR 75 Ca 0.24 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.70 2wbl n TYR 75 Cb 0.77 -0.41 -0.03 0.00 -1.03 0.00 0.00 39.34 38.64 2wbl n TYR 75 CO 0.00 0.00 0.00 0.50 -1.02 0.00 0.00 176.86 176.34 2wbl s ARG 76 N -3.36 4.26 -1.70 -0.72 6.06 -0.99 -2.91 118.95 119.60 2wbl s ARG 76 Ca -0.06 2.11 0.00 0.00 -2.50 0.00 0.00 55.73 55.28 2wbl s ARG 76 Cb 0.13 -3.51 0.00 0.00 0.06 0.00 0.00 34.95 31.63 2wbl s ARG 76 CO 0.85 -0.60 0.00 0.41 -2.50 0.00 0.00 175.30 173.45 2wbl n GLY 77 N 3.73 1.19 3.77 8.12 0.00 -1.26 -4.96 105.19 115.78 2wbl n GLY 77 Ca 0.14 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 2wbl n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbl s ALA 78 N -2.67 3.41 -0.17 4.61 0.00 -1.15 -4.57 121.76 121.22 2wbl s ALA 78 Ca 0.00 1.11 0.14 0.00 0.00 0.00 0.00 51.96 53.21 2wbl s ALA 78 Cb 0.00 -3.42 -0.20 0.00 0.00 0.00 0.00 23.12 19.50 2wbl s ALA 78 CO 0.00 -0.49 0.04 -0.25 0.00 0.00 0.00 175.76 175.06 2wbl n ASP 79 N 0.76 0.95 -3.73 0.00 8.00 0.64 -4.95 116.55 118.23 2wbl n ASP 79 Ca 0.00 -0.01 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2wbl n ASP 79 Cb 0.43 0.84 -0.10 0.00 -0.02 0.00 0.00 41.12 42.28 2wbl n ASP 79 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wbl s VAL 80 N -2.41 0.00 -0.08 2.53 0.11 -0.94 -4.19 120.40 115.42 2wbl s VAL 80 Ca -0.09 -0.02 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 2wbl s VAL 80 Cb 0.05 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2wbl s VAL 80 CO 0.68 -0.01 -0.07 -0.36 -3.33 0.00 0.00 175.10 172.01 2wbl s PHE 81 N 0.15 2.95 -0.44 1.54 2.99 -0.49 -1.51 117.98 123.17 2wbl s PHE 81 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 56.93 56.77 2wbl s PHE 81 Cb -0.03 -1.75 0.09 0.00 0.00 0.00 0.00 43.02 41.32 2wbl s PHE 81 CO 0.01 0.25 0.29 -0.51 -0.00 0.00 0.00 175.22 175.27 2wbl s LEU 82 N -0.59 5.33 -0.15 -0.37 1.43 0.48 -0.55 118.68 124.26 2wbl s LEU 82 Ca 0.09 -1.57 -0.25 0.00 -1.03 0.00 0.00 54.13 51.36 2wbl s LEU 82 Cb -0.12 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 2wbl s LEU 82 CO 0.02 -0.59 0.82 -0.76 0.23 0.00 0.00 176.35 176.08 2wbl s LEU 83 N 1.44 4.19 -0.05 1.79 1.43 -0.62 -0.18 118.68 126.68 2wbl s LEU 83 Ca 0.04 1.19 0.05 0.00 -1.03 0.00 0.00 54.13 54.37 2wbl s LEU 83 Cb -0.24 -3.23 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 2wbl s LEU 83 CO 0.02 -0.37 -0.20 0.00 0.23 0.00 0.00 176.35 176.04 2wbl s ALA 84 N 1.99 1.72 0.12 4.21 0.00 0.35 0.62 121.76 130.77 2wbl s ALA 84 Ca 0.39 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.57 2wbl s ALA 84 Cb -0.17 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 2wbl s ALA 84 CO 0.13 0.32 -0.08 -0.59 0.00 0.00 0.00 175.76 175.54 2wbl s PHE 85 N -0.02 1.06 0.03 0.00 -0.12 -0.66 -4.04 117.98 114.23 2wbl s PHE 85 Ca -0.04 -0.83 -0.22 0.00 -0.05 0.00 0.00 56.93 55.79 2wbl s PHE 85 Cb -0.12 -0.57 -0.06 0.00 -0.63 0.00 0.00 43.02 41.64 2wbl s PHE 85 CO 0.03 -0.04 0.66 0.45 -0.05 0.00 0.00 175.22 176.26 2wbl s SER 86 N -3.06 7.08 0.00 1.98 0.15 -1.26 -1.62 113.70 116.97 2wbl s SER 86 Ca 0.13 1.29 0.17 0.00 0.70 0.00 0.00 55.95 58.25 2wbl s SER 86 Cb 0.04 -2.40 0.88 0.00 -1.71 0.00 0.00 66.02 62.82 2wbl s SER 86 CO -0.02 0.10 1.51 0.18 1.20 0.00 0.00 173.24 176.21 2wbl n LEU 87 N 2.56 0.00 -0.20 3.45 4.77 -0.51 -2.18 117.00 124.88 2wbl n LEU 87 Ca -0.06 0.28 0.09 0.00 -0.03 0.00 0.00 56.01 56.29 2wbl n LEU 87 Cb 0.51 -0.28 0.16 0.00 -2.33 0.00 0.00 43.42 41.47 2wbl n LEU 87 CO 0.45 -0.12 0.52 2.30 -1.33 0.00 0.00 177.39 179.20 2wbl n ILE 88 N -1.28 1.97 -3.49 -0.08 -5.35 -1.25 0.11 119.36 109.99 2wbl n ILE 88 Ca 0.08 -2.52 -0.21 0.00 -0.27 0.00 0.00 62.75 59.84 2wbl n ILE 88 Cb 0.14 -0.24 -0.13 0.00 -1.74 0.00 0.00 39.64 37.67 2wbl n ILE 88 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2wbl s SER 89 N -2.97 1.95 0.32 7.28 0.15 -0.93 -2.47 113.70 117.03 2wbl s SER 89 Ca 0.34 -0.60 0.09 0.00 0.70 0.00 0.00 55.95 56.47 2wbl s SER 89 Cb 0.30 0.22 0.54 0.00 -1.71 0.00 0.00 66.02 65.37 2wbl s SER 89 CO 0.00 -0.37 1.74 0.07 1.20 0.00 0.00 173.24 175.89 2wbl h LYS 90 N 8.33 0.14 -0.66 5.44 -0.00 -1.82 -2.50 116.57 125.50 2wbl h LYS 90 Ca -0.16 -0.06 -0.01 0.00 -0.00 0.00 0.00 60.65 60.41 2wbl h LYS 90 Cb 1.10 -0.00 -0.03 0.00 -0.00 0.00 0.00 32.23 33.30 2wbl h LYS 90 CO 0.33 0.53 0.37 0.00 -0.00 0.00 0.00 179.45 180.68 2wbl h ALA 91 N 1.46 0.84 -0.57 0.07 0.00 -1.94 0.30 119.26 119.43 2wbl h ALA 91 Ca 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2wbl h ALA 91 Cb 0.78 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2wbl h ALA 91 CO 0.06 0.35 0.21 0.66 0.00 0.00 0.00 179.25 180.53 2wbl h SER 92 N 0.90 0.75 -0.19 0.00 4.64 -1.79 -1.55 113.55 116.32 2wbl h SER 92 Ca 0.23 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 2wbl h SER 92 Cb 0.03 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2wbl h SER 92 CO -0.04 0.69 0.08 0.22 -0.87 0.00 0.00 176.83 176.91 2wbl h TYR 93 N 0.81 0.29 -0.59 4.77 3.20 -1.05 -3.02 116.97 121.38 2wbl h TYR 93 Ca 0.19 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2wbl h TYR 93 Cb 0.18 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 2wbl h TYR 93 CO 0.01 0.33 0.19 0.93 -1.64 0.00 0.00 178.16 177.98 2wbl h GLU 94 N 0.16 0.88 0.00 1.82 5.08 -0.50 -2.70 114.58 119.31 2wbl h GLU 94 Ca 0.06 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 2wbl h GLU 94 Cb 0.17 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2wbl h GLU 94 CO -0.01 0.75 -0.27 -0.91 -1.00 0.00 0.00 179.01 177.58 2wbl h ASN 95 N 0.85 0.00 -0.45 1.42 2.35 -1.29 0.05 115.58 118.51 2wbl h ASN 95 Ca 0.20 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 56.03 2wbl h ASN 95 Cb 0.24 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.53 2wbl h ASN 95 CO -0.01 0.27 -0.01 0.40 -1.65 0.00 0.00 177.43 176.43 2wbl h ILE 96 N 0.00 0.64 0.10 2.81 1.08 -1.34 0.27 117.51 121.06 2wbl h ILE 96 Ca -0.00 -0.03 -0.31 0.00 -0.39 0.00 0.00 64.86 64.12 2wbl h ILE 96 Cb 0.55 0.53 -0.02 0.00 -3.07 0.00 0.00 36.82 34.81 2wbl h ILE 96 CO 0.03 0.02 -1.62 1.12 -0.69 0.00 0.00 178.15 177.02 2wbl h HIS 97 N 0.10 0.38 -0.10 1.37 2.07 -1.59 -0.63 115.15 116.75 2wbl h HIS 97 Ca 0.23 -0.28 -0.23 0.00 -2.85 0.00 0.00 60.37 57.24 2wbl h HIS 97 Cb 0.33 -0.02 0.01 0.00 2.57 0.00 0.00 27.41 30.31 2wbl h HIS 97 CO -0.30 1.38 -0.85 0.87 -3.07 0.00 0.00 177.93 175.96 2wbl h LYS 98 N 0.06 0.70 0.00 5.12 6.56 -0.89 -3.40 116.57 124.72 2wbl h LYS 98 Ca -0.27 -0.62 -0.08 0.00 -1.06 0.00 0.00 60.65 58.61 2wbl h LYS 98 Cb 2.01 0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 33.80 2wbl h LYS 98 CO 0.14 1.23 -1.28 1.17 -2.06 0.00 0.00 179.45 178.64 2wbl n LYS 99 N -3.89 0.11 0.10 3.15 4.81 0.75 -4.75 118.16 118.44 2wbl n LYS 99 Ca -0.08 0.05 -0.19 0.00 -0.87 0.00 0.00 58.31 57.22 2wbl n LYS 99 Cb 0.78 -0.68 -0.12 0.00 0.02 0.00 0.00 35.03 35.03 2wbl n LYS 99 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 2wbl h TRP 100 N -0.18 0.79 -0.07 5.64 4.06 -1.03 -3.28 115.95 121.88 2wbl h TRP 100 Ca -0.13 -0.51 0.01 0.00 2.06 0.00 0.00 58.89 60.32 2wbl h TRP 100 Cb 1.11 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 29.21 2wbl h TRP 100 CO -0.02 1.37 0.02 1.25 -3.56 0.00 0.00 178.44 177.50 2wbl h LEU 101 N 0.20 0.01 -1.79 -4.49 5.85 -1.32 -2.45 115.31 111.32 2wbl h LEU 101 Ca -0.16 0.01 0.18 0.00 0.84 0.00 0.00 57.88 58.75 2wbl h LEU 101 Cb 1.90 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.90 2wbl h LEU 101 CO 0.22 0.02 0.51 -0.65 -0.34 0.00 0.00 178.44 178.20 2wbl h PRO 102 N 0.05 0.19 0.11 5.25 0.11 -1.79 -0.05 132.00 135.87 2wbl h PRO 102 Ca 0.03 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2wbl h PRO 102 Cb 0.02 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.09 2wbl h PRO 102 CO -0.04 0.13 -0.05 0.93 -0.21 0.00 0.00 178.00 178.76 2wbl h GLU 103 N 0.20 -0.14 -0.40 1.05 4.39 -1.51 -2.26 114.58 115.90 2wbl h GLU 103 Ca 0.36 0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.98 2wbl h GLU 103 Cb 1.15 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 2wbl h GLU 103 CO -0.07 0.29 -0.16 -0.07 -1.16 0.00 0.00 179.01 177.84 2wbl h LEU 104 N -0.63 0.73 -0.10 1.33 3.38 -1.04 -0.61 115.31 118.37 2wbl h LEU 104 Ca -0.01 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2wbl h LEU 104 Cb 0.49 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2wbl h LEU 104 CO 0.02 0.89 0.00 0.29 0.09 0.00 0.00 178.44 179.74 2wbl n LYS 105 N -4.15 0.04 -0.09 1.13 4.01 -0.07 -0.55 118.16 118.49 2wbl n LYS 105 Ca 0.01 0.22 -0.23 0.00 -0.51 0.00 0.00 58.31 57.80 2wbl n LYS 105 Cb 0.39 -1.57 -0.12 0.00 -0.51 0.00 0.00 35.03 33.22 2wbl n LYS 105 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 2wbl n HIS 106 N -1.65 0.87 0.03 2.13 -0.00 -0.64 -4.11 115.22 111.85 2wbl n HIS 106 Ca 0.04 0.32 -0.01 0.00 0.46 0.00 0.00 57.72 58.53 2wbl n HIS 106 Cb 0.23 -1.09 -0.09 0.00 -0.12 0.00 0.00 29.99 28.92 2wbl n HIS 106 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 2wbl h TYR 107 N -0.75 0.00 -0.62 1.57 -1.99 -1.11 -3.42 116.97 110.65 2wbl h TYR 107 Ca -0.43 0.00 -0.32 0.00 2.00 0.00 0.00 58.73 59.98 2wbl h TYR 107 Cb 1.52 0.00 -0.22 0.00 2.00 0.00 0.00 36.73 40.03 2wbl h TYR 107 CO 0.06 0.64 -0.68 0.00 -0.00 0.00 0.00 178.16 178.19 2wbl n ALA 108 N -2.41 -0.02 -0.83 3.88 0.00 0.29 -4.94 120.51 116.47 2wbl n ALA 108 Ca -0.10 -2.05 -0.31 0.00 0.00 0.00 0.00 53.44 50.98 2wbl n ALA 108 Cb 0.87 -1.12 0.15 0.00 0.00 0.00 0.00 19.45 19.35 2wbl n ALA 108 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wbl s PRO 109 N -0.34 1.24 0.00 0.00 0.04 -1.06 -3.23 135.00 131.65 2wbl s PRO 109 Ca 0.29 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2wbl s PRO 109 Cb 0.28 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 33.05 2wbl s PRO 109 CO -0.11 -2.44 0.00 0.41 0.04 0.00 0.00 177.00 174.90 2wbl n GLY 110 N -0.12 0.21 3.69 0.56 0.00 -1.26 -4.97 105.19 103.29 2wbl n GLY 110 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2wbl n GLY 110 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wbl s ILE 111 N -1.51 5.19 0.48 -0.61 -1.09 -1.20 -5.05 121.20 117.40 2wbl s ILE 111 Ca 0.00 0.81 -0.24 0.00 -2.23 0.00 0.00 60.65 58.99 2wbl s ILE 111 Cb 0.00 -3.77 -0.07 0.00 -1.58 0.00 0.00 42.46 37.04 2wbl s ILE 111 CO 0.00 0.27 1.41 -2.16 -1.23 0.00 0.00 174.94 173.23 2wbl s PRO 112 N 1.13 3.52 -0.05 2.79 0.04 -1.26 -4.81 135.00 136.36 2wbl s PRO 112 Ca 0.22 2.37 0.04 0.00 0.04 0.00 0.00 61.00 63.67 2wbl s PRO 112 Cb -0.15 -2.54 -0.02 0.00 0.04 0.00 0.00 34.50 31.84 2wbl s PRO 112 CO 0.08 -0.94 -0.18 0.42 0.04 0.00 0.00 177.00 176.43 2wbl s ILE 113 N -1.23 2.72 -0.24 0.56 1.01 -1.26 -1.40 121.20 121.36 2wbl s ILE 113 Ca 0.64 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 60.42 2wbl s ILE 113 Cb -0.43 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.02 2wbl s ILE 113 CO 0.54 0.58 -0.05 -0.69 0.00 0.00 0.00 174.94 175.31 2wbl s VAL 114 N -0.52 3.03 -0.05 2.92 1.01 0.29 -0.18 120.40 126.90 2wbl s VAL 114 Ca 0.07 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 2wbl s VAL 114 Cb -0.11 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2wbl s VAL 114 CO 0.01 0.27 1.21 -0.22 0.00 0.00 0.00 175.10 176.37 2wbl s LEU 115 N 1.38 4.28 -0.14 3.92 0.20 -0.11 -1.58 118.68 126.63 2wbl s LEU 115 Ca 0.02 1.83 0.02 0.00 0.69 0.00 0.00 54.13 56.69 2wbl s LEU 115 Cb -0.16 -3.56 0.01 0.00 -0.43 0.00 0.00 46.19 42.05 2wbl s LEU 115 CO -0.04 -0.59 -0.22 -0.69 -0.29 0.00 0.00 176.35 174.52 2wbl s VAL 116 N 2.24 2.10 -0.33 1.68 1.01 0.20 -1.50 120.40 125.80 2wbl s VAL 116 Ca 0.56 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 61.49 2wbl s VAL 116 Cb -0.25 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.31 2wbl s VAL 116 CO 0.22 0.55 0.13 -0.83 0.00 0.00 0.00 175.10 175.16 2wbl s GLY 117 N 0.79 1.85 0.51 4.51 0.00 0.15 -1.65 107.32 113.47 2wbl s GLY 117 Ca -0.07 -1.57 0.04 0.00 0.00 0.00 0.00 44.72 43.12 2wbl s GLY 117 CO -0.01 0.73 0.71 -0.51 0.00 0.00 0.00 173.10 174.01 2wbl s THR 118 N 1.51 2.74 -0.91 0.90 -4.23 -0.64 -0.06 115.64 114.95 2wbl s THR 118 Ca 0.02 -0.82 -0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2wbl s THR 118 Cb -0.18 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2wbl s THR 118 CO 0.04 0.00 0.24 0.29 -0.54 0.00 0.00 174.62 174.65 2wbl n LYS 119 N -2.16 -2.18 -0.01 3.99 4.76 -1.10 -1.43 118.16 120.03 2wbl n LYS 119 Ca 0.09 0.53 0.20 0.00 -2.87 0.00 0.00 58.31 56.25 2wbl n LYS 119 Cb 0.60 -4.59 0.68 0.00 -1.84 0.00 0.00 35.03 29.88 2wbl n LYS 119 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2wbl h LEU 120 N -0.54 0.03 -1.51 -0.35 6.46 -1.34 0.19 115.31 118.24 2wbl h LEU 120 Ca -0.29 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.42 2wbl h LEU 120 Cb 1.20 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 2wbl h LEU 120 CO 0.32 0.01 -0.23 -2.24 -0.62 0.00 0.00 178.44 175.68 2wbl h ASP 121 N 0.03 0.00 0.50 1.25 2.03 -1.92 -3.11 116.42 115.20 2wbl h ASP 121 Ca 0.26 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.56 2wbl h ASP 121 Cb 1.02 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.52 2wbl h ASP 121 CO -0.01 0.23 -0.94 0.18 -1.03 0.00 0.00 179.24 177.67 2wbl n LEU 122 N -3.75 0.63 -0.23 0.15 4.77 0.65 -4.48 117.00 114.73 2wbl n LEU 122 Ca -0.01 0.02 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 2wbl n LEU 122 Cb 0.34 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.36 2wbl n LEU 122 CO 0.34 0.03 1.10 -0.09 -1.33 0.00 0.00 177.39 177.44 2wbl h ARG 123 N 0.00 0.88 -0.39 3.23 2.43 -1.44 -2.83 114.38 116.27 2wbl h ARG 123 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2wbl h ARG 123 Cb 0.72 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2wbl h ARG 123 CO 0.00 0.64 0.00 -0.25 -1.51 0.00 0.00 179.97 178.85 2wbl n ASP 124 N -4.57 4.18 -4.56 -3.80 9.92 -1.26 -4.73 116.55 111.72 2wbl n ASP 124 Ca 0.05 -2.75 -0.36 0.00 -0.53 0.00 0.00 54.79 51.20 2wbl n ASP 124 Cb 0.06 -0.52 -0.03 0.00 -0.64 0.00 0.00 41.12 39.98 2wbl n ASP 124 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2wbl s ASP 125 N -1.43 6.04 0.36 -2.24 3.68 -1.07 -4.82 116.67 117.19 2wbl s ASP 125 Ca 0.43 -1.37 0.13 0.00 2.13 0.00 0.00 52.55 53.87 2wbl s ASP 125 Cb 0.32 -2.57 0.94 0.00 -1.45 0.00 0.00 42.92 40.15 2wbl s ASP 125 CO 0.14 -1.94 1.80 0.07 0.13 0.00 0.00 175.17 175.36 2wbl h LYS 126 N 9.95 0.55 0.06 4.34 2.10 -1.90 -1.43 116.57 130.23 2wbl h LYS 126 Ca 0.20 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.82 2wbl h LYS 126 Cb 0.99 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 2wbl h LYS 126 CO 1.35 0.36 -0.03 0.37 -2.00 0.00 0.00 179.45 179.51 2wbl h GLN 127 N 0.56 -0.08 -0.63 0.07 5.75 -1.98 -2.51 115.11 116.30 2wbl h GLN 127 Ca 0.55 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 59.08 2wbl h GLN 127 Cb 1.14 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.67 2wbl h GLN 127 CO -0.30 0.21 0.39 0.35 -2.65 0.00 0.00 178.83 176.83 2wbl h PHE 128 N -0.37 0.74 -0.18 3.99 3.57 -1.66 -1.29 116.94 121.73 2wbl h PHE 128 Ca -0.01 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2wbl h PHE 128 Cb 0.33 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2wbl h PHE 128 CO 0.02 0.43 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.28 2wbl h LEU 129 N 0.78 0.30 -0.22 0.59 3.38 -1.37 0.51 115.31 119.28 2wbl h LEU 129 Ca 0.25 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2wbl h LEU 129 Cb 0.00 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2wbl h LEU 129 CO -0.09 0.50 -0.38 0.50 0.09 0.00 0.00 178.44 179.06 2wbl h LYS 130 N 0.29 0.64 -0.02 1.13 1.63 -1.16 -3.10 116.57 115.97 2wbl h LYS 130 Ca 0.05 -0.40 -0.07 0.00 -0.85 0.00 0.00 60.65 59.39 2wbl h LYS 130 Cb 0.48 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2wbl h LYS 130 CO 0.03 1.01 -0.31 -0.44 -3.45 0.00 0.00 179.45 176.29 2wbl h ASP 131 N 0.33 0.03 -2.27 4.20 3.32 -0.77 -3.34 116.42 117.93 2wbl h ASP 131 Ca 0.01 -0.01 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2wbl h ASP 131 Cb 0.97 -0.01 -0.41 0.00 0.22 0.00 0.00 39.33 40.10 2wbl h ASP 131 CO 0.09 0.35 -0.71 1.41 -1.72 0.00 0.00 179.24 178.65 2wbl n HIS 132 N -4.15 2.58 -0.15 4.55 8.25 0.13 -4.96 115.22 121.46 2wbl n HIS 132 Ca -0.02 -4.02 0.28 0.00 -0.26 0.00 0.00 57.72 53.71 2wbl n HIS 132 Cb 0.37 -0.49 0.71 0.00 1.12 0.00 0.00 29.99 31.70 2wbl n HIS 132 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2wbl h PRO 133 N 4.34 0.00 0.00 -0.41 0.13 -1.67 0.31 132.00 134.70 2wbl h PRO 133 Ca 0.17 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.22 2wbl h PRO 133 Cb 0.73 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 2wbl h PRO 133 CO 0.73 0.00 -0.36 0.78 -0.23 0.00 0.00 178.00 178.91 2wbl h GLY 134 N 0.00 0.00 -2.18 1.56 0.00 -1.93 -3.44 103.07 97.08 2wbl h GLY 134 Ca 0.41 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 47.27 2wbl h GLY 134 CO -0.00 0.00 0.39 0.00 0.00 0.00 0.00 176.54 176.92 2wbl s ALA 135 N -3.87 2.92 -0.14 3.60 0.00 0.11 -4.95 121.76 119.42 2wbl s ALA 135 Ca -0.01 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.48 2wbl s ALA 135 Cb 0.12 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 20.06 2wbl s ALA 135 CO 0.69 -0.26 0.34 0.00 0.00 0.00 0.00 175.76 176.53 2wbl s ALA 136 N -1.94 -0.84 -0.05 0.00 0.00 -1.03 -4.98 121.76 112.92 2wbl s ALA 136 Ca 0.65 1.28 -0.27 0.00 0.00 0.00 0.00 51.96 53.63 2wbl s ALA 136 Cb -0.17 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.06 2wbl s ALA 136 CO 0.20 -0.32 0.84 -1.54 0.00 0.00 0.00 175.76 174.95 2wbl s SER 137 N 1.55 7.16 -0.13 0.00 1.04 -1.26 -3.33 113.70 118.73 2wbl s SER 137 Ca -0.08 1.40 -0.19 0.00 0.48 0.00 0.00 55.95 57.56 2wbl s SER 137 Cb -0.10 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 2wbl s SER 137 CO -0.11 -0.22 0.53 -0.63 0.98 0.00 0.00 173.24 173.80 2wbl s ILE 138 N 1.06 5.14 0.54 -1.02 -1.09 0.12 -4.99 121.20 120.96 2wbl s ILE 138 Ca 0.44 1.05 -0.16 0.00 -2.23 0.00 0.00 60.65 59.75 2wbl s ILE 138 Cb -0.19 -3.87 -0.07 0.00 -1.58 0.00 0.00 42.46 36.76 2wbl s ILE 138 CO 0.22 0.27 1.01 0.42 -1.23 0.00 0.00 174.94 175.62 2wbl s THR 139 N 0.96 4.40 0.16 2.92 -4.23 -1.26 -4.90 115.64 113.69 2wbl s THR 139 Ca 0.28 1.10 -0.20 0.00 -1.18 0.00 0.00 61.69 61.69 2wbl s THR 139 Cb -0.16 -3.66 0.06 0.00 1.34 0.00 0.00 72.50 70.08 2wbl s THR 139 CO 0.11 -0.70 1.65 0.74 -0.54 0.00 0.00 174.62 175.88 2wbl h THR 140 N 0.67 0.50 -0.57 3.99 2.02 -1.98 0.65 112.91 118.19 2wbl h THR 140 Ca -0.46 0.00 0.11 0.00 0.77 0.00 0.00 66.41 66.83 2wbl h THR 140 Cb 1.19 0.50 -0.09 0.00 -1.74 0.00 0.00 68.15 68.02 2wbl h THR 140 CO 0.61 0.00 0.06 0.00 0.37 0.00 0.00 175.52 176.55 2wbl h ALA 141 N 1.11 0.61 -0.89 6.16 0.00 -1.99 0.20 119.26 124.46 2wbl h ALA 141 Ca 0.16 0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.30 2wbl h ALA 141 Cb 0.37 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2wbl h ALA 141 CO -0.40 -0.35 0.58 1.96 0.00 0.00 0.00 179.25 181.04 2wbl h GLN 142 N 0.18 0.93 0.00 0.00 4.20 -1.66 -0.76 115.11 118.00 2wbl h GLN 142 Ca 0.30 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.86 2wbl h GLN 142 Cb 0.45 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2wbl h GLN 142 CO -0.44 0.61 -0.41 0.78 -0.67 0.00 0.00 178.83 178.71 2wbl h GLY 143 N 0.95 0.00 0.93 3.46 0.00 0.15 -2.77 103.07 105.80 2wbl h GLY 143 Ca 0.40 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.56 2wbl h GLY 143 CO -0.16 0.00 -0.63 -2.09 0.00 0.00 0.00 176.54 173.66 2wbl h GLU 144 N 0.00 0.55 -0.88 4.80 4.57 0.42 -1.47 114.58 122.58 2wbl h GLU 144 Ca -0.00 -0.50 0.18 0.00 -1.18 0.00 0.00 59.36 57.86 2wbl h GLU 144 Cb 0.86 0.12 -0.11 0.00 -0.16 0.00 0.00 28.75 29.46 2wbl h GLU 144 CO 0.05 1.13 0.42 0.93 -1.18 0.00 0.00 179.01 180.36 2wbl h GLU 145 N 0.16 0.51 -0.21 1.92 5.08 -1.16 -0.56 114.58 120.31 2wbl h GLU 145 Ca -0.06 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 2wbl h GLU 145 Cb 1.29 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2wbl h GLU 145 CO 0.13 0.33 -0.41 1.25 -1.00 0.00 0.00 179.01 179.32 2wbl h LEU 146 N 0.52 0.51 -0.15 1.33 7.12 -1.34 -1.73 115.31 121.58 2wbl h LEU 146 Ca 0.51 -0.22 -0.01 0.00 0.13 0.00 0.00 57.88 58.29 2wbl h LEU 146 Cb 0.86 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 40.84 2wbl h LEU 146 CO -0.44 0.86 0.06 -0.09 -0.13 0.00 0.00 178.44 178.70 2wbl h ARG 147 N 0.40 0.22 0.00 1.25 2.43 -0.05 -2.08 114.38 116.55 2wbl h ARG 147 Ca 0.03 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2wbl h ARG 147 Cb 0.88 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2wbl h ARG 147 CO 0.08 0.29 -0.12 0.87 -1.51 0.00 0.00 179.97 179.58 2wbl h LYS 148 N 0.09 0.00 0.07 0.20 1.57 -1.17 0.21 116.57 117.55 2wbl h LYS 148 Ca 0.05 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 2wbl h LYS 148 Cb 0.15 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.48 2wbl h LYS 148 CO -0.00 0.12 -0.54 1.98 -0.57 0.00 0.00 179.45 180.43 2wbl h MET 149 N 0.00 0.24 -0.34 3.15 1.85 -1.09 -3.28 114.93 115.46 2wbl h MET 149 Ca -0.00 -0.35 0.00 0.00 -0.61 0.00 0.00 59.70 58.74 2wbl h MET 149 Cb 0.72 0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.87 2wbl h MET 149 CO 0.02 1.13 0.00 0.44 -0.40 0.00 0.00 176.91 178.10 2wbl n ILE 150 N -4.29 0.46 -2.34 1.77 -5.35 -0.80 -4.92 119.36 103.88 2wbl n ILE 150 Ca -0.12 -0.50 -0.21 0.00 -0.27 0.00 0.00 62.75 61.66 2wbl n ILE 150 Cb 0.69 0.32 -0.02 0.00 -1.74 0.00 0.00 39.64 38.89 2wbl n ILE 150 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wbl n GLY 151 N 1.15 -0.31 3.76 3.28 0.00 -0.71 -4.96 105.19 107.40 2wbl n GLY 151 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2wbl n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbl s ALA 152 N -3.00 2.83 0.06 4.61 0.00 -0.02 -4.79 121.76 121.45 2wbl s ALA 152 Ca 0.00 1.18 0.22 0.00 0.00 0.00 0.00 51.96 53.36 2wbl s ALA 152 Cb 0.00 -3.50 0.75 0.00 0.00 0.00 0.00 23.12 20.37 2wbl s ALA 152 CO 0.00 -1.14 1.75 -0.24 0.00 0.00 0.00 175.76 176.13 2wbl h VAL 153 N 1.50 0.58 -1.67 0.00 3.04 -0.89 -3.45 116.25 115.37 2wbl h VAL 153 Ca -0.50 -1.30 0.05 0.00 -1.01 0.00 0.00 66.70 63.93 2wbl h VAL 153 Cb 1.28 1.88 -0.23 0.00 -2.01 0.00 0.00 31.29 32.21 2wbl h VAL 153 CO 0.58 0.26 0.44 -0.60 -1.01 0.00 0.00 177.57 177.23 2wbl s ARG 154 N -3.52 0.65 -0.17 4.17 3.52 -1.26 -5.06 118.95 117.28 2wbl s ARG 154 Ca 0.01 0.37 -0.02 0.00 -0.13 0.00 0.00 55.73 55.96 2wbl s ARG 154 Cb 0.10 0.31 -0.01 0.00 -1.56 0.00 0.00 34.95 33.78 2wbl s ARG 154 CO 0.66 -0.16 -0.07 -0.47 -0.81 0.00 0.00 175.30 174.44 2wbl s TYR 155 N -0.57 2.92 -0.00 5.12 5.04 -1.26 -0.93 117.35 127.66 2wbl s TYR 155 Ca -0.01 -0.69 0.05 0.00 -2.44 0.00 0.00 57.07 53.97 2wbl s TYR 155 Cb -0.02 -1.98 -0.01 0.00 0.35 0.00 0.00 41.96 40.30 2wbl s TYR 155 CO 0.00 -0.31 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.24 2wbl s LEU 156 N 0.82 2.06 -0.17 6.97 1.43 -0.56 -5.01 118.68 124.21 2wbl s LEU 156 Ca -0.02 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 2wbl s LEU 156 Cb -0.15 -0.76 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 2wbl s LEU 156 CO 0.01 0.16 -0.03 -1.61 0.23 0.00 0.00 176.35 175.11 2wbl s GLU 157 N -0.51 3.62 0.31 1.70 2.02 -1.26 -0.68 118.70 123.91 2wbl s GLU 157 Ca 0.05 -0.54 0.05 0.00 0.02 0.00 0.00 54.97 54.55 2wbl s GLU 157 Cb -0.06 -2.94 -0.03 0.00 0.10 0.00 0.00 34.13 31.19 2wbl s GLU 157 CO -0.00 0.15 0.21 0.00 0.02 0.00 0.00 175.26 175.65 2wbl s SER 159 N -3.36 -0.17 0.24 0.00 0.15 -1.13 -1.07 113.70 108.36 2wbl s SER 159 Ca 0.38 0.76 -0.03 0.00 0.70 0.00 0.00 55.95 57.76 2wbl s SER 159 Cb 0.04 0.81 0.27 0.00 -1.71 0.00 0.00 66.02 65.43 2wbl s SER 159 CO 0.22 -0.21 1.70 0.28 1.20 0.00 0.00 173.24 176.43 2wbl h SER 160 N 7.70 0.76 0.56 5.45 0.02 -1.91 0.69 113.55 126.83 2wbl h SER 160 Ca -0.27 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.43 2wbl h SER 160 Cb 1.14 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 63.48 2wbl h SER 160 CO 0.23 0.90 -0.27 0.50 -1.14 0.00 0.00 176.83 177.05 2wbl h LYS 161 N 0.70 -0.72 -0.04 3.45 3.64 -1.96 -3.29 116.57 118.35 2wbl h LYS 161 Ca 0.12 0.05 -0.25 0.00 -1.27 0.00 0.00 60.65 59.30 2wbl h LYS 161 Cb 0.58 0.16 0.02 0.00 -0.41 0.00 0.00 32.23 32.59 2wbl h LYS 161 CO 0.04 -0.42 -0.96 1.15 -2.27 0.00 0.00 179.45 176.98 2wbl h THR 162 N -0.92 1.29 0.00 1.00 2.02 -1.98 -3.48 112.91 110.84 2wbl h THR 162 Ca -0.08 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 64.91 2wbl h THR 162 Cb 0.63 2.28 0.00 0.00 -1.74 0.00 0.00 68.15 69.32 2wbl h THR 162 CO 0.13 0.68 0.00 0.00 0.37 0.00 0.00 175.52 176.70 2wbl n GLN 163 N -3.86 0.00 -1.68 6.66 6.02 0.24 -5.04 117.38 119.72 2wbl n GLN 163 Ca -0.10 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.45 2wbl n GLN 163 Cb 0.84 -1.88 -0.04 0.00 1.02 0.00 0.00 30.24 30.18 2wbl n GLN 163 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2wbl n GLN 164 N -2.21 2.45 -0.65 -1.09 7.27 -1.22 -2.57 117.38 119.36 2wbl n GLN 164 Ca 0.00 0.89 0.00 0.00 0.07 0.00 0.00 57.00 57.96 2wbl n GLN 164 Cb 0.00 -2.73 0.00 0.00 2.41 0.00 0.00 30.24 29.92 2wbl n GLN 164 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2wbl n ASN 165 N 5.03 -0.01 0.09 1.69 3.02 -1.26 -2.84 115.26 120.97 2wbl n ASN 165 Ca 0.19 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.61 2wbl n ASN 165 Cb 0.33 -1.77 -0.08 0.00 -0.61 0.00 0.00 39.78 37.65 2wbl n ASN 165 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2wbl h VAL 166 N 0.00 0.93 -0.52 2.41 2.07 -1.81 0.21 116.25 119.53 2wbl h VAL 166 Ca 0.00 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 2wbl h VAL 166 Cb 0.00 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2wbl h VAL 166 CO 0.00 0.03 0.22 0.50 0.02 0.00 0.00 177.57 178.34 2wbl h LYS 167 N -0.20 0.74 -0.67 1.57 3.64 -1.89 -1.25 116.57 118.51 2wbl h LYS 167 Ca -0.01 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2wbl h LYS 167 Cb 0.16 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2wbl h LYS 167 CO 0.02 0.60 0.44 0.00 -2.27 0.00 0.00 179.45 178.24 2wbl h ALA 168 N 1.51 1.63 0.55 5.00 0.00 -1.71 0.10 119.26 126.35 2wbl h ALA 168 Ca 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2wbl h ALA 168 Cb 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2wbl h ALA 168 CO -0.02 0.30 -0.31 0.28 0.00 0.00 0.00 179.25 179.49 2wbl h VAL 169 N 0.79 0.35 -0.09 0.00 2.07 0.61 -1.47 116.25 118.52 2wbl h VAL 169 Ca 0.27 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.63 2wbl h VAL 169 Cb 0.08 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2wbl h VAL 169 CO -0.08 0.00 -0.62 -0.26 0.02 0.00 0.00 177.57 176.64 2wbl h PHE 170 N -0.81 0.43 -0.86 1.57 -1.00 -1.31 -1.38 116.94 113.57 2wbl h PHE 170 Ca -0.07 -0.17 0.12 0.00 2.81 0.00 0.00 57.97 60.67 2wbl h PHE 170 Cb 0.65 -0.07 -0.08 0.00 3.61 0.00 0.00 35.95 40.05 2wbl h PHE 170 CO -0.08 0.86 0.48 -0.44 -1.61 0.00 0.00 178.31 177.52 2wbl h ASP 171 N 0.24 0.65 0.17 2.17 5.19 -0.77 0.23 116.42 124.30 2wbl h ASP 171 Ca -0.01 0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2wbl h ASP 171 Cb 1.14 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.61 2wbl h ASP 171 CO 0.10 0.32 -0.08 0.74 -3.12 0.00 0.00 179.24 177.20 2wbl h THR 172 N 0.74 0.94 -0.37 0.35 2.02 -0.36 -1.70 112.91 114.53 2wbl h THR 172 Ca 0.44 -0.67 0.08 0.00 0.77 0.00 0.00 66.41 67.04 2wbl h THR 172 Cb 0.52 1.34 -0.08 0.00 -1.74 0.00 0.00 68.15 68.19 2wbl h THR 172 CO -0.30 0.15 -0.18 0.00 0.37 0.00 0.00 175.52 175.56 2wbl h ALA 173 N 0.18 0.10 -0.15 6.16 0.00 -1.07 0.21 119.26 124.69 2wbl h ALA 173 Ca -0.02 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.07 2wbl h ALA 173 Cb 0.43 0.43 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 2wbl h ALA 173 CO 0.04 -0.55 -0.25 0.82 0.00 0.00 0.00 179.25 179.31 2wbl h ILE 174 N -0.11 0.41 -0.41 0.00 2.04 -0.55 -1.11 117.51 117.77 2wbl h ILE 174 Ca 0.18 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.00 2wbl h ILE 174 Cb 0.40 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2wbl h ILE 174 CO -0.44 0.00 0.08 -0.09 0.00 0.00 0.00 178.15 177.69 2wbl h ARG 175 N -0.30 0.67 -0.15 2.37 9.65 -0.56 -3.00 114.38 123.05 2wbl h ARG 175 Ca 0.11 -0.17 -0.12 0.00 -1.10 0.00 0.00 59.98 58.69 2wbl h ARG 175 Cb 0.46 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 2wbl h ARG 175 CO -0.32 0.71 -0.43 -0.24 2.80 0.00 0.00 179.97 182.49 2wbl h VAL 176 N 0.53 1.31 0.00 0.20 3.04 -0.41 -2.62 116.25 118.30 2wbl h VAL 176 Ca 0.13 -1.58 0.00 0.00 -1.01 0.00 0.00 66.70 64.23 2wbl h VAL 176 Cb 0.36 1.66 0.00 0.00 -2.01 0.00 0.00 31.29 31.30 2wbl h VAL 176 CO 0.01 0.48 0.00 0.00 -1.01 0.00 0.00 177.57 177.05 2wbl n ALA 177 N -2.48 1.96 -0.75 3.17 0.00 -0.44 -2.32 120.51 119.64 2wbl n ALA 177 Ca -0.02 -0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.42 2wbl n ALA 177 Cb 0.51 -1.31 0.29 0.00 0.00 0.00 0.00 19.45 18.94 2wbl n ALA 177 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wbl n LEU 178 N -1.39 4.30 -4.78 0.00 4.77 -0.99 -4.93 117.00 113.99 2wbl n LEU 178 Ca 0.07 -2.70 -0.39 0.00 -0.03 0.00 0.00 56.01 52.97 2wbl n LEU 178 Cb 0.19 -0.53 -0.06 0.00 -2.33 0.00 0.00 43.42 40.69 2wbl n LEU 178 CO 0.16 0.71 0.25 -0.13 -1.33 0.00 0.00 177.39 177.05 2wbl s ARG 179 N -2.28 4.24 0.00 3.23 1.81 -0.98 -5.10 118.95 119.87 2wbl s ARG 179 Ca 0.44 0.67 0.00 0.00 -1.72 0.00 0.00 55.73 55.11 2wbl s ARG 179 Cb 0.32 -3.31 0.00 0.00 -0.45 0.00 0.00 34.95 31.51 2wbl s ARG 179 CO 0.15 0.46 0.00 -2.30 -0.68 0.00 0.00 175.30 172.93