#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ybj s PHE 2 N 0.00 3.59 -0.07 0.00 5.36 -1.24 -4.10 117.98 121.52 1ybj s PHE 2 Ca 0.00 1.29 -0.32 0.00 -0.96 0.00 0.00 56.93 56.95 1ybj s PHE 2 Cb 0.00 -2.71 0.12 0.00 -0.34 0.00 0.00 43.02 40.09 1ybj s PHE 2 CO 0.00 -0.60 1.19 -1.54 -1.46 0.00 0.00 175.22 172.82 1ybj s SER 3 N -3.95 -0.12 -0.17 6.13 1.04 0.11 -4.67 113.70 112.07 1ybj s SER 3 Ca 0.55 -0.10 -0.20 0.00 0.48 0.00 0.00 55.95 56.68 1ybj s SER 3 Cb -0.11 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.19 1ybj s SER 3 CO 0.49 -0.36 0.58 0.54 0.98 0.00 0.00 173.24 175.47 1ybj s VAL 4 N -2.56 5.08 -0.80 5.02 0.11 -1.26 -2.49 120.40 123.49 1ybj s VAL 4 Ca 0.11 1.12 -0.01 0.00 -2.93 0.00 0.00 61.98 60.27 1ybj s VAL 4 Cb 0.02 -3.91 0.36 0.00 -1.53 0.00 0.00 36.38 31.32 1ybj s VAL 4 CO -0.04 0.19 1.95 0.59 -3.33 0.00 0.00 175.10 174.46 1ybj n ASN 5 N 4.56 7.30 -4.79 3.54 3.02 0.71 -4.91 115.26 124.71 1ybj n ASN 5 Ca -0.03 -3.83 -0.35 0.00 -0.03 0.00 0.00 54.58 50.34 1ybj n ASN 5 Cb 0.50 -1.01 -0.03 0.00 -0.61 0.00 0.00 39.78 38.63 1ybj n ASN 5 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1ybj s TYR 6 N -4.02 3.06 -0.35 3.10 1.13 -1.26 -0.94 117.35 118.07 1ybj s TYR 6 Ca 0.52 1.59 -0.27 0.00 -1.41 0.00 0.00 57.07 57.50 1ybj s TYR 6 Cb 0.44 -3.12 -0.04 0.00 -1.10 0.00 0.00 41.96 38.14 1ybj s TYR 6 CO -0.38 -0.85 2.11 0.34 -2.51 0.00 0.00 175.55 174.27 1ybj s ASP 7 N -1.79 5.31 -0.05 -0.18 2.15 -1.25 -4.77 116.67 116.09 1ybj s ASP 7 Ca 0.64 1.38 -0.00 0.00 0.43 0.00 0.00 52.55 55.00 1ybj s ASP 7 Cb -0.19 -2.51 -0.02 0.00 -0.30 0.00 0.00 42.92 39.90 1ybj s ASP 7 CO 0.24 -2.15 1.02 -0.24 -0.17 0.00 0.00 175.17 173.86 1ybj n SER 8 N 12.42 -1.90 0.00 -0.34 2.88 -1.26 -1.93 113.62 123.48 1ybj n SER 8 Ca 0.29 -1.32 0.00 0.00 -1.33 0.00 0.00 58.87 56.51 1ybj n SER 8 Cb 0.48 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 1ybj n SER 8 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ybj n SER 9 N 4.38 0.00 -1.25 -3.46 2.88 -1.26 -4.93 113.62 109.98 1ybj n SER 9 Ca 0.03 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.64 1ybj n SER 9 Cb 0.46 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 64.19 1ybj n SER 9 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1ybj n PHE 10 N -0.14 1.12 -1.25 0.66 3.72 -0.81 -4.82 117.46 115.93 1ybj n PHE 10 Ca 0.00 -0.44 -0.41 0.00 -0.05 0.00 0.00 57.45 56.55 1ybj n PHE 10 Cb 0.00 -0.21 -0.04 0.00 -0.94 0.00 0.00 39.48 38.30 1ybj n PHE 10 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ybj n GLY 11 N 0.88 3.13 0.00 1.37 0.00 -1.26 -2.91 105.19 106.40 1ybj n GLY 11 Ca 0.19 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1ybj n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ybj n GLY 12 N 4.31 0.59 3.87 -0.02 0.00 -1.26 -4.25 105.19 108.43 1ybj n GLY 12 Ca 0.51 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.19 1ybj n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ybj s TYR 13 N 0.00 3.54 0.15 1.61 1.51 -1.14 -4.77 117.35 118.24 1ybj s TYR 13 Ca 0.00 0.85 -0.30 0.00 -1.01 0.00 0.00 57.07 56.60 1ybj s TYR 13 Cb 0.00 -2.22 -0.08 0.00 -0.11 0.00 0.00 41.96 39.56 1ybj s TYR 13 CO 0.00 0.43 1.28 -1.12 -1.11 0.00 0.00 175.55 175.03 1ybj s SER 14 N -1.98 6.96 0.19 2.29 0.01 -1.26 0.10 113.70 120.01 1ybj s SER 14 Ca 0.39 2.27 -0.19 0.00 1.31 0.00 0.00 55.95 59.72 1ybj s SER 14 Cb -0.13 -2.60 0.14 0.00 0.21 0.00 0.00 66.02 63.64 1ybj s SER 14 CO 0.20 -0.51 1.59 0.40 0.41 0.00 0.00 173.24 175.33 1ybj h ILE 15 N 4.02 0.21 0.00 1.44 1.08 0.01 0.44 117.51 124.70 1ybj h ILE 15 Ca -0.43 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.03 1ybj h ILE 15 Cb 1.21 0.21 -0.00 0.00 -3.07 0.00 0.00 36.82 35.17 1ybj h ILE 15 CO 0.80 0.00 -0.02 -0.74 -0.69 0.00 0.00 178.15 177.49 1ybj h HIS 16 N -0.14 0.00 0.04 1.37 2.76 -1.18 -1.86 115.15 116.14 1ybj h HIS 16 Ca 0.24 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.26 1ybj h HIS 16 Cb 0.54 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.51 1ybj h HIS 16 CO -0.61 0.02 -0.61 0.22 -1.30 0.00 0.00 177.93 175.65 1ybj h ASP 17 N 0.00 0.47 -0.24 3.26 3.58 -0.42 -2.61 116.42 120.45 1ybj h ASP 17 Ca -0.00 -0.82 -0.15 0.00 0.42 0.00 0.00 57.03 56.48 1ybj h ASP 17 Cb 0.07 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.98 1ybj h ASP 17 CO 0.00 1.24 -0.43 0.22 -2.88 0.00 0.00 179.24 177.40 1ybj h TYR 18 N -0.25 0.90 -0.99 0.28 5.03 -1.10 -2.82 116.97 118.03 1ybj h TYR 18 Ca -0.09 -0.31 0.09 0.00 2.58 0.00 0.00 58.73 60.99 1ybj h TYR 18 Cb 1.37 -0.17 -0.07 0.00 1.55 0.00 0.00 36.73 39.41 1ybj h TYR 18 CO 0.17 1.10 0.64 -0.07 -1.32 0.00 0.00 178.16 178.67 1ybj h LEU 19 N 0.45 0.98 -0.80 2.82 3.38 -1.42 0.17 115.31 120.88 1ybj h LEU 19 Ca 0.02 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ybj h LEU 19 Cb 1.03 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 1ybj h LEU 19 CO 0.10 0.59 0.52 1.23 0.09 0.00 0.00 178.44 180.96 1ybj h GLY 20 N 1.09 1.15 1.21 0.83 0.00 -1.40 -1.21 103.07 104.75 1ybj h GLY 20 Ca 0.45 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 1ybj h GLY 20 CO -0.20 0.35 0.37 -1.61 0.00 0.00 0.00 176.54 175.44 1ybj h GLN 21 N 1.02 1.03 -0.36 4.80 4.15 -0.52 0.57 115.11 125.80 1ybj h GLN 21 Ca 0.31 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.60 1ybj h GLN 21 Cb -0.02 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.45 1ybj h GLN 21 CO -0.10 0.78 0.23 2.35 -1.93 0.00 0.00 178.83 180.16 1ybj h TRP 22 N 1.03 0.46 0.00 3.99 7.01 -0.34 -2.17 115.95 125.93 1ybj h TRP 22 Ca 0.25 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.22 1ybj h TRP 22 Cb 0.08 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 1ybj h TRP 22 CO 0.01 0.31 -0.19 0.00 -2.79 0.00 0.00 178.44 175.78 1ybj h ALA 23 N 1.11 1.34 0.39 2.65 0.00 -0.58 -0.59 119.26 123.58 1ybj h ALA 23 Ca 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ybj h ALA 23 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ybj h ALA 23 CO -0.03 0.24 -0.29 1.03 0.00 0.00 0.00 179.25 180.20 1ybj h SER 24 N 0.00 -0.75 0.07 0.00 0.87 -0.25 0.39 113.55 113.87 1ybj h SER 24 Ca -0.00 0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 1ybj h SER 24 Cb 0.44 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 1ybj h SER 24 CO 0.02 -0.44 -0.21 0.71 -0.53 0.00 0.00 176.83 176.38 1ybj h THR 25 N -0.67 1.22 -0.25 2.23 1.35 -1.27 -3.09 112.91 112.43 1ybj h THR 25 Ca -0.03 -1.03 -0.01 0.00 -0.55 0.00 0.00 66.41 64.79 1ybj h THR 25 Cb 0.58 1.35 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 1ybj h THR 25 CO 0.00 0.32 0.14 0.15 -0.25 0.00 0.00 175.52 175.87 1ybj h PHE 26 N 0.24 0.35 -0.04 4.73 3.04 -0.61 -2.95 116.94 121.70 1ybj h PHE 26 Ca 0.04 -0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.91 1ybj h PHE 26 Cb 0.52 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.91 1ybj h PHE 26 CO 0.01 0.31 -0.33 0.78 -2.02 0.00 0.00 178.31 177.06 1ybj h GLY 27 N 0.29 0.08 -6.85 2.40 0.00 -0.86 -3.40 103.07 94.73 1ybj h GLY 27 Ca 0.09 -0.06 -0.56 0.00 0.00 0.00 0.00 47.33 46.80 1ybj h GLY 27 CO -0.01 0.06 1.08 -0.35 0.00 0.00 0.00 176.54 177.31 1ybj s ASP 28 N -6.92 6.29 0.44 0.19 2.15 -1.12 -4.89 116.67 112.81 1ybj s ASP 28 Ca -0.03 0.71 0.15 0.00 0.43 0.00 0.00 52.55 53.81 1ybj s ASP 28 Cb 0.14 -2.54 1.00 0.00 -0.30 0.00 0.00 42.92 41.22 1ybj s ASP 28 CO 0.73 -1.50 1.97 -0.37 -0.17 0.00 0.00 175.17 175.83 1ybj h VAL 29 N 6.46 1.10 -0.10 1.11 -1.51 -1.84 -2.70 116.25 118.77 1ybj h VAL 29 Ca -0.27 -0.73 0.00 0.00 -1.23 0.00 0.00 66.70 64.46 1ybj h VAL 29 Cb 1.10 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 1ybj h VAL 29 CO 1.11 0.21 0.00 -0.46 -1.23 0.00 0.00 177.57 177.19 1ybj n ASN 30 N -4.21 2.34 -4.60 4.19 0.23 -1.26 -4.14 115.26 107.81 1ybj n ASN 30 Ca -0.02 -1.78 -0.43 0.00 -0.53 0.00 0.00 54.58 51.82 1ybj n ASN 30 Cb 0.27 -0.06 -0.03 0.00 -2.08 0.00 0.00 39.78 37.89 1ybj n ASN 30 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1ybj s HIS 31 N -1.89 1.73 0.45 -2.53 2.46 -1.02 -4.98 115.29 109.51 1ybj s HIS 31 Ca 0.34 0.64 0.07 0.00 0.47 0.00 0.00 55.06 56.58 1ybj s HIS 31 Cb 0.20 -4.10 0.07 0.00 -0.13 0.00 0.00 32.58 28.62 1ybj s HIS 31 CO 0.31 -3.01 0.54 0.25 -2.47 0.00 0.00 174.74 170.37 1ybj n THR 32 N 7.44 0.00 -3.66 0.89 -2.24 -1.26 -4.78 114.28 110.68 1ybj n THR 32 Ca 0.24 -1.58 -0.06 0.00 -2.27 0.00 0.00 64.05 60.38 1ybj n THR 32 Cb 0.47 -0.48 -0.07 0.00 -2.10 0.00 0.00 70.33 68.15 1ybj n THR 32 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ybj s ASN 33 N -3.75 -0.63 0.00 3.42 3.84 -1.26 -5.02 114.94 111.53 1ybj s ASN 33 Ca 0.41 1.23 0.12 0.00 0.21 0.00 0.00 52.86 54.84 1ybj s ASN 33 Cb -0.03 1.68 0.57 0.00 -0.55 0.00 0.00 41.25 42.92 1ybj s ASN 33 CO 0.26 -0.23 1.36 0.61 -2.79 0.00 0.00 177.10 176.32 1ybj n GLY 34 N 5.30 -0.83 0.36 1.21 0.00 -1.26 -1.42 105.19 108.55 1ybj n GLY 34 Ca -0.11 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1ybj n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ybj n ASN 35 N -1.41 1.67 -4.47 1.61 3.02 -1.26 -4.85 115.26 109.57 1ybj n ASN 35 Ca 0.04 -1.30 -0.40 0.00 -0.03 0.00 0.00 54.58 52.89 1ybj n ASN 35 Cb 0.12 0.51 -0.11 0.00 -0.61 0.00 0.00 39.78 39.70 1ybj n ASN 35 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ybj s VAL 36 N -2.59 4.94 0.00 2.41 1.01 -0.51 -4.79 120.40 120.87 1ybj s VAL 36 Ca 0.17 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1ybj s VAL 36 Cb 0.18 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1ybj s VAL 36 CO 0.62 -0.03 0.00 0.41 0.00 0.00 0.00 175.10 176.10 1ybj n THR 37 N 5.05 0.00 0.27 3.92 -1.04 -1.26 -4.85 114.28 116.37 1ybj n THR 37 Ca -0.13 0.32 -0.14 0.00 -2.04 0.00 0.00 64.05 62.06 1ybj n THR 37 Cb 0.49 -1.32 -0.08 0.00 -1.82 0.00 0.00 70.33 67.60 1ybj n THR 37 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1ybj h ASP 38 N 0.00 -0.59 -5.05 8.00 3.58 -1.93 -3.48 116.42 116.95 1ybj h ASP 38 Ca 0.00 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1ybj h ASP 38 Cb 0.00 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.20 1ybj h ASP 38 CO 0.00 -0.24 -0.15 0.00 -2.88 0.00 0.00 179.24 175.96 1ybj n ALA 39 N -2.57 -2.60 -2.36 -0.78 0.00 -0.87 -4.98 120.51 106.34 1ybj n ALA 39 Ca -0.11 0.37 -0.40 0.00 0.00 0.00 0.00 53.44 53.30 1ybj n ALA 39 Cb 0.32 -2.03 -0.05 0.00 0.00 0.00 0.00 19.45 17.69 1ybj n ALA 39 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ybj s ASN 40 N -2.71 7.23 0.08 0.00 0.01 0.79 -4.86 114.94 115.48 1ybj s ASN 40 Ca 0.08 1.47 -0.14 0.00 -0.71 0.00 0.00 52.86 53.56 1ybj s ASN 40 Cb -0.02 -2.47 -0.20 0.00 0.41 0.00 0.00 41.25 38.96 1ybj s ASN 40 CO 0.66 0.03 1.23 0.28 -1.51 0.00 0.00 177.10 177.80 1ybj h SER 41 N 5.55 0.91 0.00 -1.22 0.02 -1.91 -3.36 113.55 113.54 1ybj h SER 41 Ca -0.44 -0.69 0.00 0.00 -0.84 0.00 0.00 61.79 59.82 1ybj h SER 41 Cb 1.21 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.47 1ybj h SER 41 CO 0.70 1.47 0.00 0.61 -1.14 0.00 0.00 176.83 178.48 1ybj n GLY 42 N 0.92 0.24 1.70 -3.77 0.00 -1.26 -0.52 105.19 102.51 1ybj n GLY 42 Ca -0.10 -1.26 -0.02 0.00 0.00 0.00 0.00 46.02 44.65 1ybj n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ybj n GLY 43 N 0.00 0.66 2.29 -0.02 0.00 -0.72 -4.92 105.19 102.49 1ybj n GLY 43 Ca 0.00 -0.18 0.16 0.00 0.00 0.00 0.00 46.02 46.00 1ybj n GLY 43 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ybj n PHE 44 N -1.70 -3.37 0.01 1.61 3.72 -1.26 -4.94 117.46 111.53 1ybj n PHE 44 Ca -0.01 1.50 0.00 0.00 -0.05 0.00 0.00 57.45 58.89 1ybj n PHE 44 Cb 0.51 -2.73 0.00 0.00 -0.94 0.00 0.00 39.48 36.32 1ybj n PHE 44 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1ybj n TYR 45 N -3.85 -0.46 -1.83 1.38 9.36 -1.19 -4.73 117.16 115.85 1ybj n TYR 45 Ca 0.01 0.05 -0.35 0.00 3.32 0.00 0.00 57.90 60.93 1ybj n TYR 45 Cb 0.55 0.54 -0.02 0.00 -0.63 0.00 0.00 39.34 39.77 1ybj n TYR 45 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ybj n GLY 46 N 1.20 4.93 0.00 2.98 0.00 -1.26 -4.88 105.19 108.16 1ybj n GLY 46 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1ybj n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ybj n GLY 47 N 1.24 2.20 0.09 -0.02 0.00 -1.26 -3.74 105.19 103.71 1ybj n GLY 47 Ca 0.56 -0.68 -0.03 0.00 0.00 0.00 0.00 46.02 45.87 1ybj n GLY 47 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ybj h SER 48 N 0.00 0.00 0.00 1.61 0.02 -1.94 -3.44 113.55 109.79 1ybj h SER 48 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ybj h SER 48 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ybj h SER 48 CO 0.00 0.79 0.00 0.18 -1.14 0.00 0.00 176.83 176.66 1ybj n LEU 49 N -3.23 0.00 -4.48 5.07 4.77 -1.26 -4.98 117.00 112.89 1ybj n LEU 49 Ca -0.02 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.66 1ybj n LEU 49 Cb 0.87 0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.88 1ybj n LEU 49 CO 0.44 -0.05 -0.49 -0.94 -1.33 0.00 0.00 177.39 175.03 1ybj s SER 50 N -1.65 3.88 0.00 -1.43 1.04 -1.26 -4.01 113.70 110.27 1ybj s SER 50 Ca 0.00 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1ybj s SER 50 Cb 0.00 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.54 1ybj s SER 50 CO 0.00 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.04 1ybj n GLY 51 N 1.06 -0.59 0.09 7.32 0.00 -1.07 -4.01 105.19 107.99 1ybj n GLY 51 Ca -0.16 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 1ybj n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ybj n SER 52 N 0.00 1.88 -4.55 1.61 3.41 -1.24 0.10 113.62 114.83 1ybj n SER 52 Ca 0.00 0.47 -0.28 0.00 -0.26 0.00 0.00 58.87 58.80 1ybj n SER 52 Cb 0.00 -0.83 -0.10 0.00 -0.26 0.00 0.00 64.21 63.02 1ybj n SER 52 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1ybj s GLN 53 N -2.53 1.98 -0.33 4.33 0.74 -1.26 -0.69 119.66 121.91 1ybj s GLN 53 Ca -0.24 -1.20 0.00 0.00 0.05 0.00 0.00 55.36 53.98 1ybj s GLN 53 Cb 0.04 -2.17 0.14 0.00 1.10 0.00 0.00 33.01 32.12 1ybj s GLN 53 CO 0.36 0.46 0.28 1.52 -0.55 0.00 0.00 175.29 177.37 1ybj s TYR 54 N -1.45 -0.08 0.17 1.67 1.13 0.50 -3.14 117.35 116.16 1ybj s TYR 54 Ca 0.22 -0.77 -0.04 0.00 -1.41 0.00 0.00 57.07 55.07 1ybj s TYR 54 Cb -0.10 -0.59 -0.05 0.00 -1.10 0.00 0.00 41.96 40.12 1ybj s TYR 54 CO 0.13 -0.91 0.40 0.00 -2.51 0.00 0.00 175.55 172.66 1ybj s ALA 55 N 1.76 3.78 -0.10 9.51 0.00 -1.26 -1.47 121.76 133.97 1ybj s ALA 55 Ca 0.14 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 1ybj s ALA 55 Cb -0.16 -2.12 0.05 0.00 0.00 0.00 0.00 23.12 20.88 1ybj s ALA 55 CO -0.17 0.58 0.24 0.42 0.00 0.00 0.00 175.76 176.83 1ybj s ILE 56 N -1.75 -0.06 0.06 0.00 -1.09 0.99 -1.75 121.20 117.60 1ybj s ILE 56 Ca 0.41 0.16 0.06 0.00 -2.23 0.00 0.00 60.65 59.04 1ybj s ILE 56 Cb -0.12 -0.38 -0.04 0.00 -1.58 0.00 0.00 42.46 40.35 1ybj s ILE 56 CO 0.26 0.06 -0.10 -0.55 -1.23 0.00 0.00 174.94 173.38 1ybj s SER 57 N 1.33 4.36 -0.37 3.58 0.15 0.32 0.56 113.70 123.63 1ybj s SER 57 Ca -0.09 -0.32 -0.42 0.00 0.70 0.00 0.00 55.95 55.83 1ybj s SER 57 Cb -0.11 -0.87 -0.16 0.00 -1.71 0.00 0.00 66.02 63.17 1ybj s SER 57 CO -0.08 0.22 1.83 -0.24 1.20 0.00 0.00 173.24 176.16 1ybj n SER 58 N 1.12 1.89 0.09 5.45 2.88 0.56 -4.79 113.62 120.82 1ybj n SER 58 Ca -0.14 0.96 0.08 0.00 -1.33 0.00 0.00 58.87 58.44 1ybj n SER 58 Cb 0.52 -1.07 0.39 0.00 -0.75 0.00 0.00 64.21 63.31 1ybj n SER 58 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1ybj n THR 59 N 5.07 1.14 -0.05 2.46 -1.04 -1.26 0.99 114.28 121.59 1ybj n THR 59 Ca 0.33 0.43 -0.00 0.00 -2.04 0.00 0.00 64.05 62.77 1ybj n THR 59 Cb 0.08 -1.36 -0.00 0.00 -1.82 0.00 0.00 70.33 67.23 1ybj n THR 59 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ybj h ALA 60 N 2.19 0.00 -0.01 2.41 0.00 -1.87 -3.42 119.26 118.56 1ybj h ALA 60 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ybj h ALA 60 Cb 0.17 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ybj h ALA 60 CO 0.00 0.03 -0.02 0.27 0.00 0.00 0.00 179.25 179.54 1ybj n ASN 61 N -4.57 1.37 -3.64 0.00 0.23 -1.18 -4.70 115.26 102.78 1ybj n ASN 61 Ca -0.00 -1.18 -0.28 0.00 -0.53 0.00 0.00 54.58 52.59 1ybj n ASN 61 Cb 0.02 0.07 -0.06 0.00 -2.08 0.00 0.00 39.78 37.72 1ybj n ASN 61 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ybj n GLN 62 N 0.21 -0.84 0.02 -3.83 6.02 0.28 -4.74 117.38 114.50 1ybj n GLN 62 Ca 0.03 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1ybj n GLN 62 Cb 0.13 -3.07 0.00 0.00 1.02 0.00 0.00 30.24 28.33 1ybj n GLN 62 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1ybj n VAL 63 N -3.07 0.45 -1.78 5.09 3.14 -1.26 -4.80 118.33 116.10 1ybj n VAL 63 Ca 0.01 0.15 -0.39 0.00 -2.96 0.00 0.00 64.34 61.14 1ybj n VAL 63 Cb 0.35 -1.44 -0.03 0.00 -1.06 0.00 0.00 33.84 31.66 1ybj n VAL 63 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1ybj s THR 64 N -2.00 3.19 0.38 1.55 2.01 -1.26 0.60 115.64 120.11 1ybj s THR 64 Ca 0.00 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.17 1ybj s THR 64 Cb 0.00 -3.38 0.02 0.00 0.01 0.00 0.00 72.50 69.15 1ybj s THR 64 CO 0.00 -0.32 0.14 0.00 -0.69 0.00 0.00 174.62 173.75 1ybj n ALA 65 N 13.20 0.46 -3.65 7.40 0.00 0.54 -0.32 120.51 138.13 1ybj n ALA 65 Ca 0.28 -1.62 -0.01 0.00 0.00 0.00 0.00 53.44 52.09 1ybj n ALA 65 Cb 0.51 0.78 -0.04 0.00 0.00 0.00 0.00 19.45 20.70 1ybj n ALA 65 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ybj s PHE 66 N -2.14 -1.33 -0.40 0.00 5.36 0.19 -2.65 117.98 117.00 1ybj s PHE 66 Ca 0.11 2.32 -0.13 0.00 -0.96 0.00 0.00 56.93 58.27 1ybj s PHE 66 Cb -0.01 0.80 0.03 0.00 -0.34 0.00 0.00 43.02 43.50 1ybj s PHE 66 CO 0.07 -0.66 0.27 0.08 -1.46 0.00 0.00 175.22 173.51 1ybj s VAL 67 N 2.87 4.88 0.14 3.12 1.01 0.12 -0.01 120.40 132.54 1ybj s VAL 67 Ca -0.06 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 1ybj s VAL 67 Cb -0.12 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 1ybj s VAL 67 CO -0.19 -0.32 0.34 0.00 0.00 0.00 0.00 175.10 174.93 1ybj s ALA 68 N 1.60 3.86 -0.23 5.51 0.00 -0.54 -1.13 121.76 130.82 1ybj s ALA 68 Ca 0.03 -0.73 -0.21 0.00 0.00 0.00 0.00 51.96 51.05 1ybj s ALA 68 Cb -0.20 -2.00 0.06 0.00 0.00 0.00 0.00 23.12 20.98 1ybj s ALA 68 CO 0.08 0.63 0.62 0.20 0.00 0.00 0.00 175.76 177.29 1ybj s GLY 69 N -2.71 -0.47 0.00 0.00 0.00 -0.59 -0.37 107.32 103.17 1ybj s GLY 69 Ca 0.39 1.77 0.00 0.00 0.00 0.00 0.00 44.72 46.88 1ybj s GLY 69 CO 0.27 1.54 0.00 0.61 0.00 0.00 0.00 173.10 175.52 1ybj n GLY 70 N 2.81 0.25 2.40 0.20 0.00 0.14 -2.50 105.19 108.49 1ybj n GLY 70 Ca -0.14 0.52 -0.20 0.00 0.00 0.00 0.00 46.02 46.20 1ybj n GLY 70 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ybj n ASN 71 N 0.00 -0.94 -4.89 1.61 4.05 -0.61 -4.65 115.26 109.83 1ybj n ASN 71 Ca 0.00 -2.77 -0.29 0.00 0.45 0.00 0.00 54.58 51.97 1ybj n ASN 71 Cb 0.00 0.10 0.01 0.00 1.23 0.00 0.00 39.78 41.13 1ybj n ASN 71 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1ybj s LEU 72 N -0.62 3.33 -0.24 1.20 1.43 0.11 -0.31 118.68 123.59 1ybj s LEU 72 Ca 0.33 1.13 -0.09 0.00 -1.03 0.00 0.00 54.13 54.48 1ybj s LEU 72 Cb 0.14 -4.09 0.10 0.00 0.03 0.00 0.00 46.19 42.37 1ybj s LEU 72 CO -0.15 -0.84 0.53 -0.89 0.23 0.00 0.00 176.35 175.22 1ybj s THR 73 N -3.03 -0.69 -0.32 5.49 2.01 -0.84 -2.59 115.64 115.67 1ybj s THR 73 Ca 0.53 0.08 -0.17 0.00 0.31 0.00 0.00 61.69 62.44 1ybj s THR 73 Cb -0.11 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 1ybj s THR 73 CO 0.50 0.04 0.44 -0.47 -0.69 0.00 0.00 174.62 174.43 1ybj s TYR 74 N 2.55 3.21 -0.08 4.92 6.14 -1.26 -2.12 117.35 130.72 1ybj s TYR 74 Ca -0.05 0.24 -0.04 0.00 0.64 0.00 0.00 57.07 57.86 1ybj s TYR 74 Cb -0.11 -2.76 -0.15 0.00 0.42 0.00 0.00 41.96 39.36 1ybj s TYR 74 CO -0.16 -0.41 3.13 0.25 0.64 0.00 0.00 175.55 179.00 1ybj n THR 75 N 5.28 2.84 0.43 4.34 -2.24 -0.06 -4.66 114.28 120.20 1ybj n THR 75 Ca -0.07 -1.51 -0.19 0.00 -2.27 0.00 0.00 64.05 60.01 1ybj n THR 75 Cb 0.50 -1.82 -0.09 0.00 -2.10 0.00 0.00 70.33 66.81 1ybj n THR 75 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 1ybj h LEU 76 N 4.36 -0.90 -1.03 3.22 -0.00 -1.91 0.20 115.31 119.26 1ybj h LEU 76 Ca 0.19 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 1ybj h LEU 76 Cb 1.28 0.23 0.00 0.00 -0.00 0.00 0.00 40.66 42.18 1ybj h LEU 76 CO 0.30 -0.64 0.00 0.49 -0.00 0.00 0.00 178.44 178.59 1ybj n PHE 77 N -5.55 0.09 -2.43 0.17 3.72 -1.26 -3.79 117.46 108.41 1ybj n PHE 77 Ca -0.15 -0.04 -0.25 0.00 -0.05 0.00 0.00 57.45 56.96 1ybj n PHE 77 Cb 0.42 0.00 0.14 0.00 -0.94 0.00 0.00 39.48 39.10 1ybj n PHE 77 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1ybj s ASN 78 N -1.83 3.89 0.02 4.37 0.01 -1.04 -4.99 114.94 115.38 1ybj s ASN 78 Ca 0.36 -0.28 -0.08 0.00 -0.71 0.00 0.00 52.86 52.14 1ybj s ASN 78 Cb 0.20 0.06 -0.04 0.00 0.41 0.00 0.00 41.25 41.88 1ybj s ASN 78 CO 0.31 -2.18 1.12 -0.33 -1.51 0.00 0.00 177.10 174.51 1ybj h GLU 79 N -0.88 -0.19 -0.27 -0.60 4.39 -1.91 -2.67 114.58 112.44 1ybj h GLU 79 Ca -0.37 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.42 1ybj h GLU 79 Cb 1.25 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 1ybj h GLU 79 CO 0.37 -0.13 0.23 -1.35 -1.16 0.00 0.00 179.01 176.97 1ybj h PRO 80 N -0.20 0.00 -2.66 2.33 0.11 -1.84 -3.48 132.00 126.26 1ybj h PRO 80 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1ybj h PRO 80 Cb 0.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.29 1ybj h PRO 80 CO -0.04 0.00 -0.38 0.00 -0.21 0.00 0.00 178.00 177.37 1ybj n ALA 81 N -2.49 -2.62 -3.67 -0.75 0.00 -1.01 -4.74 120.51 105.23 1ybj n ALA 81 Ca 0.04 0.19 -0.22 0.00 0.00 0.00 0.00 53.44 53.45 1ybj n ALA 81 Cb 0.38 -0.74 0.04 0.00 0.00 0.00 0.00 19.45 19.13 1ybj n ALA 81 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ybj n HIS 82 N 0.74 -1.94 -4.40 0.00 8.25 0.68 -4.90 115.22 113.63 1ybj n HIS 82 Ca 0.00 0.81 -0.23 0.00 -0.26 0.00 0.00 57.72 58.04 1ybj n HIS 82 Cb 0.00 -4.31 -0.08 0.00 1.12 0.00 0.00 29.99 26.72 1ybj n HIS 82 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ybj s THR 83 N -3.63 0.28 0.01 1.59 -4.23 -1.26 -4.93 115.64 103.47 1ybj s THR 83 Ca 0.06 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.64 1ybj s THR 83 Cb -0.02 -2.40 -0.02 0.00 1.34 0.00 0.00 72.50 71.40 1ybj s THR 83 CO 0.81 0.00 -0.19 -0.22 -0.54 0.00 0.00 174.62 174.48 1ybj s LEU 84 N -3.50 2.09 0.00 4.79 2.96 -1.26 -0.88 118.68 122.89 1ybj s LEU 84 Ca 0.31 -0.41 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1ybj s LEU 84 Cb 0.02 -0.93 0.00 0.00 0.50 0.00 0.00 46.19 45.78 1ybj s LEU 84 CO 0.21 0.19 0.00 0.00 -1.32 0.00 0.00 176.35 175.43 1ybj n TYR 85 N 2.29 0.00 -0.01 5.38 4.11 -0.90 -4.31 117.16 123.71 1ybj n TYR 85 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 1ybj n TYR 85 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.88 1ybj n TYR 85 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1ybj n GLY 86 N 0.00 -1.84 3.96 -7.48 0.00 -1.19 -2.00 105.19 96.65 1ybj n GLY 86 Ca 0.00 -2.02 -0.22 0.00 0.00 0.00 0.00 46.02 43.77 1ybj n GLY 86 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ybj s GLN 87 N 0.00 2.93 -0.23 1.61 -0.44 0.58 -0.48 119.66 123.63 1ybj s GLN 87 Ca 0.00 -0.58 -0.15 0.00 -2.50 0.00 0.00 55.36 52.14 1ybj s GLN 87 Cb 0.00 -2.54 0.07 0.00 -1.64 0.00 0.00 33.01 28.89 1ybj s GLN 87 CO 0.00 -0.38 0.57 -1.17 0.50 0.00 0.00 175.29 174.80 1ybj s LEU 88 N -4.60 -0.46 0.00 3.68 2.96 0.36 -1.58 118.68 119.03 1ybj s LEU 88 Ca 0.51 1.21 0.00 0.00 -0.22 0.00 0.00 54.13 55.63 1ybj s LEU 88 Cb -0.10 1.93 0.00 0.00 0.50 0.00 0.00 46.19 48.52 1ybj s LEU 88 CO 0.38 -0.21 0.00 -0.67 -1.32 0.00 0.00 176.35 174.53 1ybj n ASP 89 N 3.86 0.79 -4.00 3.68 2.03 -1.04 -0.29 116.55 121.57 1ybj n ASP 89 Ca -0.19 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 54.90 1ybj n ASP 89 Cb 0.57 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.81 1ybj n ASP 89 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1ybj s SER 90 N -4.20 1.33 0.50 1.67 1.04 -1.15 -1.23 113.70 111.66 1ybj s SER 90 Ca 0.00 -0.21 0.07 0.00 0.48 0.00 0.00 55.95 56.29 1ybj s SER 90 Cb 0.00 -0.42 0.02 0.00 0.10 0.00 0.00 66.02 65.72 1ybj s SER 90 CO 0.00 0.06 0.43 -0.76 0.98 0.00 0.00 173.24 173.94 1ybj s LEU 91 N 0.32 2.97 -0.30 2.42 2.01 -0.24 -1.54 118.68 124.32 1ybj s LEU 91 Ca -0.06 -1.05 -0.04 0.00 0.01 0.00 0.00 54.13 52.99 1ybj s LEU 91 Cb -0.10 -1.50 0.19 0.00 0.01 0.00 0.00 46.19 44.78 1ybj s LEU 91 CO 0.01 -0.97 0.82 -0.55 1.01 0.00 0.00 176.35 176.68 1ybj s SER 92 N -4.26 -0.99 0.05 2.29 0.15 -0.29 -0.26 113.70 110.39 1ybj s SER 92 Ca 0.42 0.29 -0.08 0.00 0.70 0.00 0.00 55.95 57.28 1ybj s SER 92 Cb -0.02 1.70 -0.05 0.00 -1.71 0.00 0.00 66.02 65.93 1ybj s SER 92 CO 0.25 -0.18 0.34 -0.36 1.20 0.00 0.00 173.24 174.48 1ybj s PHE 93 N 2.90 3.57 0.00 3.44 0.08 0.54 0.15 117.98 128.67 1ybj s PHE 93 Ca 0.15 0.67 0.00 0.00 0.12 0.00 0.00 56.93 57.87 1ybj s PHE 93 Cb -0.08 -2.07 0.00 0.00 -0.57 0.00 0.00 43.02 40.30 1ybj s PHE 93 CO -0.21 0.56 0.00 0.41 -0.10 0.00 0.00 175.22 175.88 1ybj n GLY 94 N 0.95 0.40 3.55 4.36 0.00 -1.09 -2.56 105.19 110.81 1ybj n GLY 94 Ca -0.09 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1ybj n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ybj s ASP 95 N 0.00 6.31 0.00 1.61 1.11 -1.16 -0.34 116.67 124.20 1ybj s ASP 95 Ca 0.00 -0.06 0.00 0.00 0.18 0.00 0.00 52.55 52.67 1ybj s ASP 95 Cb 0.00 -2.27 0.00 0.00 1.07 0.00 0.00 42.92 41.72 1ybj s ASP 95 CO 0.00 -0.49 0.00 0.61 1.18 0.00 0.00 175.17 176.47 1ybj n GLY 96 N 4.81 -1.97 3.88 0.21 0.00 0.20 -2.56 105.19 109.77 1ybj n GLY 96 Ca -0.05 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 1ybj n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ybj s LEU 97 N 0.00 3.80 0.27 0.99 1.43 -1.26 0.72 118.68 124.63 1ybj s LEU 97 Ca 0.00 1.08 -0.03 0.00 -1.03 0.00 0.00 54.13 54.15 1ybj s LEU 97 Cb 0.00 -3.97 -0.02 0.00 0.03 0.00 0.00 46.19 42.23 1ybj s LEU 97 CO 0.00 -0.43 0.34 -0.44 0.23 0.00 0.00 176.35 176.05 1ybj s SER 98 N -3.34 0.51 0.30 2.29 0.01 0.49 -0.15 113.70 113.81 1ybj s SER 98 Ca 0.50 -1.35 0.00 0.00 1.31 0.00 0.00 55.95 56.42 1ybj s SER 98 Cb -0.10 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.67 1ybj s SER 98 CO 0.34 -1.08 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1ybj n GLY 99 N -0.43 1.03 3.54 3.44 0.00 -1.26 -1.96 105.19 109.54 1ybj n GLY 99 Ca 0.01 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.77 1ybj n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ybj n GLY 100 N 0.00 -0.36 1.97 -0.02 0.00 -0.28 -4.84 105.19 101.66 1ybj n GLY 100 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ybj n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ybj n ASP 101 N -3.09 0.00 0.00 1.61 2.03 -1.26 -4.93 116.55 110.90 1ybj n ASP 101 Ca -0.26 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.05 1ybj n ASP 101 Cb 0.66 0.12 0.00 0.00 -0.72 0.00 0.00 41.12 41.18 1ybj n ASP 101 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1ybj n THR 102 N -2.48 0.00 -4.39 5.18 -2.24 -1.26 -5.03 114.28 104.06 1ybj n THR 102 Ca 0.00 -0.43 -0.25 0.00 -2.27 0.00 0.00 64.05 61.10 1ybj n THR 102 Cb 0.00 1.02 -0.12 0.00 -2.10 0.00 0.00 70.33 69.14 1ybj n THR 102 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ybj s SER 103 N -0.72 3.14 0.83 3.42 1.04 -1.26 -5.14 113.70 115.00 1ybj s SER 103 Ca 0.00 -0.85 -0.10 0.00 0.48 0.00 0.00 55.95 55.47 1ybj s SER 103 Cb 0.00 -0.22 0.09 0.00 0.10 0.00 0.00 66.02 65.99 1ybj s SER 103 CO 0.00 0.07 1.10 -2.84 0.98 0.00 0.00 173.24 172.55 1ybj s PRO 104 N -2.65 1.80 0.36 4.02 0.02 -1.26 -1.13 135.00 136.17 1ybj s PRO 104 Ca 0.18 1.23 -0.27 0.00 0.02 0.00 0.00 61.00 62.16 1ybj s PRO 104 Cb -0.07 -1.84 -0.09 0.00 0.02 0.00 0.00 34.50 32.51 1ybj s PRO 104 CO 0.08 -1.99 1.25 0.71 -0.33 0.00 0.00 177.00 176.73 1ybj s TYR 105 N -2.83 3.03 -0.05 6.54 2.02 -1.26 -4.16 117.35 120.64 1ybj s TYR 105 Ca 0.63 1.47 -0.16 0.00 -0.37 0.00 0.00 57.07 58.64 1ybj s TYR 105 Cb -0.19 -3.57 0.03 0.00 -0.40 0.00 0.00 41.96 37.83 1ybj s TYR 105 CO 0.57 -1.68 0.36 -1.54 -1.57 0.00 0.00 175.55 171.69 1ybj s SER 106 N -0.75 -0.29 0.01 2.29 1.04 -0.83 -4.95 113.70 110.22 1ybj s SER 106 Ca 0.53 0.34 -0.30 0.00 0.48 0.00 0.00 55.95 57.00 1ybj s SER 106 Cb -0.36 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.19 1ybj s SER 106 CO 0.47 -0.37 1.00 -0.63 0.98 0.00 0.00 173.24 174.69 1ybj s ILE 107 N -0.87 4.77 0.14 -1.02 1.09 -1.26 -0.38 121.20 123.67 1ybj s ILE 107 Ca -0.09 2.00 -0.15 0.00 -1.10 0.00 0.00 60.65 61.30 1ybj s ILE 107 Cb -0.04 -4.28 0.00 0.00 -1.06 0.00 0.00 42.46 37.08 1ybj s ILE 107 CO 0.04 0.16 1.67 1.56 -0.10 0.00 0.00 174.94 178.26 1ybj h GLN 108 N 6.75 0.65 -3.40 2.79 4.20 0.17 -3.26 115.11 123.01 1ybj h GLN 108 Ca -0.41 -0.13 -0.71 0.00 0.06 0.00 0.00 58.65 57.45 1ybj h GLN 108 Cb 1.22 -0.10 -0.35 0.00 0.30 0.00 0.00 27.48 28.56 1ybj h GLN 108 CO 0.75 0.63 -0.11 0.08 -0.67 0.00 0.00 178.83 179.51 1ybj s VAL 109 N -5.45 4.38 -0.26 -0.54 1.01 -1.06 -5.05 120.40 113.43 1ybj s VAL 109 Ca -0.13 -3.60 -0.28 0.00 0.00 0.00 0.00 61.98 57.96 1ybj s VAL 109 Cb 0.10 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1ybj s VAL 109 CO 0.76 -1.05 1.89 -2.16 0.00 0.00 0.00 175.10 174.54 1ybj s PRO 110 N -1.02 3.39 0.00 2.72 0.04 -1.23 -3.00 135.00 135.90 1ybj s PRO 110 Ca 0.25 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1ybj s PRO 110 Cb -0.10 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1ybj s PRO 110 CO -0.10 -1.79 0.00 -0.25 0.04 0.00 0.00 177.00 174.90 1ybj n ASP 111 N 10.23 0.01 -4.76 6.66 8.00 -1.06 -4.63 116.55 131.00 1ybj n ASP 111 Ca 0.24 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.34 1ybj n ASP 111 Cb 0.46 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.58 1ybj n ASP 111 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1ybj n VAL 112 N 0.00 2.95 -4.26 2.53 0.31 -1.23 -3.96 118.33 114.67 1ybj n VAL 112 Ca 0.00 -0.50 -0.19 0.00 -0.01 0.00 0.00 64.34 63.64 1ybj n VAL 112 Cb 0.00 -1.81 -0.08 0.00 -0.91 0.00 0.00 33.84 31.04 1ybj n VAL 112 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1ybj s SER 113 N -0.54 1.55 0.04 4.52 0.01 -0.11 -0.34 113.70 118.83 1ybj s SER 113 Ca 0.63 -1.72 0.03 0.00 1.31 0.00 0.00 55.95 56.19 1ybj s SER 113 Cb -0.45 0.56 -0.02 0.00 0.21 0.00 0.00 66.02 66.32 1ybj s SER 113 CO 0.56 -1.08 -0.08 -0.36 0.41 0.00 0.00 173.24 172.69 1ybj s PHE 114 N -3.44 0.72 -0.26 2.43 0.40 0.63 -0.20 117.98 118.26 1ybj s PHE 114 Ca 0.40 -0.43 -0.25 0.00 -0.60 0.00 0.00 56.93 56.05 1ybj s PHE 114 Cb 0.02 -0.43 0.09 0.00 0.51 0.00 0.00 43.02 43.21 1ybj s PHE 114 CO 0.26 -0.05 0.82 0.20 0.70 0.00 0.00 175.22 177.15 1ybj s GLY 115 N -1.35 -0.42 0.00 4.36 0.00 -1.04 -1.07 107.32 107.79 1ybj s GLY 115 Ca -0.07 2.20 0.00 0.00 0.00 0.00 0.00 44.72 46.85 1ybj s GLY 115 CO 0.01 1.74 0.00 0.61 0.00 0.00 0.00 173.10 175.45 1ybj n GLY 116 N 2.45 0.98 0.10 0.20 0.00 -0.56 0.04 105.19 108.40 1ybj n GLY 116 Ca -0.14 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 1ybj n GLY 116 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ybj h LEU 117 N 0.00 -0.16 -1.96 0.99 3.38 -1.43 -3.29 115.31 112.85 1ybj h LEU 117 Ca 0.00 0.03 -0.37 0.00 0.09 0.00 0.00 57.88 57.63 1ybj h LEU 117 Cb 0.00 0.08 0.11 0.00 0.09 0.00 0.00 40.66 40.94 1ybj h LEU 117 CO 0.00 -0.07 -0.83 -3.20 0.09 0.00 0.00 178.44 174.43 1ybj n ASN 118 N -5.17 -2.50 -4.19 -0.43 5.15 -1.06 -4.92 115.26 102.14 1ybj n ASN 118 Ca -0.05 -0.76 -0.35 0.00 -0.60 0.00 0.00 54.58 52.81 1ybj n ASN 118 Cb 0.10 -4.46 -0.13 0.00 -0.53 0.00 0.00 39.78 34.75 1ybj n ASN 118 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ybj s LEU 119 N -6.39 3.95 -0.12 1.20 1.43 0.60 -4.97 118.68 114.38 1ybj s LEU 119 Ca 0.10 -1.23 0.01 0.00 -1.03 0.00 0.00 54.13 51.98 1ybj s LEU 119 Cb -0.02 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1ybj s LEU 119 CO 0.78 -0.27 -0.15 -0.94 0.23 0.00 0.00 176.35 176.01 1ybj s SER 120 N 1.28 3.87 0.05 2.29 1.04 -1.26 -0.49 113.70 120.48 1ybj s SER 120 Ca -0.04 -0.35 -0.04 0.00 0.48 0.00 0.00 55.95 55.99 1ybj s SER 120 Cb -0.20 -1.52 -0.05 0.00 0.10 0.00 0.00 66.02 64.36 1ybj s SER 120 CO -0.00 0.18 0.27 -0.94 0.98 0.00 0.00 173.24 173.72 1ybj s SER 121 N 0.27 6.44 0.95 7.02 1.04 0.37 -4.94 113.70 124.85 1ybj s SER 121 Ca -0.11 0.47 -0.13 0.00 0.48 0.00 0.00 55.95 56.66 1ybj s SER 121 Cb -0.16 -2.05 0.16 0.00 0.10 0.00 0.00 66.02 64.07 1ybj s SER 121 CO 0.06 0.19 1.15 -0.76 0.98 0.00 0.00 173.24 174.86 1ybj s LEU 122 N -2.15 1.92 0.15 2.42 1.43 -1.26 -3.16 118.68 118.03 1ybj s LEU 122 Ca 0.32 0.89 -0.26 0.00 -1.03 0.00 0.00 54.13 54.05 1ybj s LEU 122 Cb -0.13 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.96 1ybj s LEU 122 CO 0.21 -2.74 1.60 -0.61 0.23 0.00 0.00 176.35 175.03 1ybj h GLN 123 N -1.63 -0.34 -0.13 1.70 5.75 -1.99 -1.60 115.11 116.87 1ybj h GLN 123 Ca -0.50 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.03 1ybj h GLN 123 Cb 1.32 0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.95 1ybj h GLN 123 CO 0.57 -0.23 0.00 0.00 -2.65 0.00 0.00 178.83 176.53 1ybj n ALA 124 N -2.94 2.49 -1.63 3.38 0.00 -1.26 -4.38 120.51 116.18 1ybj n ALA 124 Ca -0.02 -0.19 -0.41 0.00 0.00 0.00 0.00 53.44 52.82 1ybj n ALA 124 Cb 0.34 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.79 1ybj n ALA 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ybj n GLN 125 N -0.17 3.02 0.00 0.00 1.13 -0.60 -4.86 117.38 115.89 1ybj n GLN 125 Ca 0.04 -2.50 0.00 0.00 -1.94 0.00 0.00 57.00 52.60 1ybj n GLN 125 Cb 0.10 -3.18 0.00 0.00 0.11 0.00 0.00 30.24 27.27 1ybj n GLN 125 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ybj n GLY 126 N 3.99 -2.12 0.09 1.08 0.00 -1.26 -3.21 105.19 103.76 1ybj n GLY 126 Ca 0.58 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.72 1ybj n GLY 126 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ybj n HIS 127 N 0.00 0.78 0.24 1.61 -0.00 -1.26 -3.55 115.22 113.03 1ybj n HIS 127 Ca 0.00 0.23 0.12 0.00 -0.00 0.00 0.00 57.72 58.06 1ybj n HIS 127 Cb 0.00 -0.83 0.08 0.00 -0.00 0.00 0.00 29.99 29.24 1ybj n HIS 127 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 1ybj h ASP 128 N 0.00 0.00 -2.59 0.26 3.58 -1.92 -3.38 116.42 112.37 1ybj h ASP 128 Ca 0.00 -0.04 -0.54 0.00 0.42 0.00 0.00 57.03 56.87 1ybj h ASP 128 Cb 0.74 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.80 1ybj h ASP 128 CO 0.00 0.02 1.09 -0.83 -2.88 0.00 0.00 179.24 176.64 1ybj s GLY 129 N -4.17 1.53 0.48 -0.78 0.00 -1.20 -4.87 107.32 98.32 1ybj s GLY 129 Ca 0.03 1.08 0.27 0.00 0.00 0.00 0.00 44.72 46.09 1ybj s GLY 129 CO 0.75 3.07 1.82 -0.39 0.00 0.00 0.00 173.10 178.34 1ybj h VAL 130 N 5.37 0.51 -0.63 1.40 -1.51 -1.89 0.18 116.25 119.69 1ybj h VAL 130 Ca -0.42 -0.06 -0.05 0.00 -1.23 0.00 0.00 66.70 64.94 1ybj h VAL 130 Cb 1.19 0.32 -0.03 0.00 -2.13 0.00 0.00 31.29 30.64 1ybj h VAL 130 CO 0.94 0.03 0.19 -0.37 -1.23 0.00 0.00 177.57 177.14 1ybj h VAL 131 N 0.18 1.25 -0.53 7.19 -1.51 -1.90 0.18 116.25 121.11 1ybj h VAL 131 Ca 0.53 -0.86 -0.08 0.00 -1.23 0.00 0.00 66.70 65.07 1ybj h VAL 131 Cb 1.74 0.61 -0.02 0.00 -2.13 0.00 0.00 31.29 31.49 1ybj h VAL 131 CO -0.13 0.33 0.02 -0.74 -1.23 0.00 0.00 177.57 175.82 1ybj h HIS 132 N 0.91 0.94 0.61 5.19 6.17 -0.88 -2.65 115.15 125.44 1ybj h HIS 132 Ca 0.20 -0.13 -0.03 0.00 0.71 0.00 0.00 60.37 61.12 1ybj h HIS 132 Cb 0.30 -0.26 0.01 0.00 2.52 0.00 0.00 27.41 29.98 1ybj h HIS 132 CO 0.02 0.84 -0.29 1.96 0.71 0.00 0.00 177.93 181.17 1ybj h GLN 133 N 0.82 -0.78 -0.95 5.26 4.20 -0.68 -2.71 115.11 120.27 1ybj h GLN 133 Ca 0.16 0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.97 1ybj h GLN 133 Cb 0.46 0.18 -0.06 0.00 0.30 0.00 0.00 27.48 28.36 1ybj h GLN 133 CO 0.02 -0.47 0.62 -0.39 -0.67 0.00 0.00 178.83 177.94 1ybj h VAL 134 N -1.08 1.14 0.00 -0.54 -1.51 -0.72 0.27 116.25 113.81 1ybj h VAL 134 Ca -0.08 -0.40 -0.00 0.00 -1.23 0.00 0.00 66.70 64.98 1ybj h VAL 134 Cb 0.67 -0.14 0.00 0.00 -2.13 0.00 0.00 31.29 29.70 1ybj h VAL 134 CO 0.14 0.21 -0.00 1.62 -1.23 0.00 0.00 177.57 178.31 1ybj h VAL 135 N 1.17 1.30 0.00 7.19 3.04 -1.51 0.15 116.25 127.59 1ybj h VAL 135 Ca 0.39 -0.90 -0.08 0.00 -1.01 0.00 0.00 66.70 65.10 1ybj h VAL 135 Cb 0.06 1.91 -0.01 0.00 -2.01 0.00 0.00 31.29 31.24 1ybj h VAL 135 CO -0.13 0.23 -0.40 1.88 -1.01 0.00 0.00 177.57 178.15 1ybj h TYR 136 N -0.39 0.00 0.59 3.17 -1.99 -1.24 0.13 116.97 117.24 1ybj h TYR 136 Ca -0.00 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 1ybj h TYR 136 Cb 0.39 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.12 1ybj h TYR 136 CO 0.06 0.40 -0.28 0.78 -0.00 0.00 0.00 178.16 179.11 1ybj h GLY 137 N 1.81 -0.83 -0.05 3.88 0.00 -0.35 -2.34 103.07 105.19 1ybj h GLY 137 Ca -0.00 0.31 0.10 0.00 0.00 0.00 0.00 47.33 47.73 1ybj h GLY 137 CO 0.05 -0.30 -0.15 1.41 0.00 0.00 0.00 176.54 177.55 1ybj h LEU 138 N -0.94 -0.54 -1.69 3.11 -0.00 -0.34 0.64 115.31 115.55 1ybj h LEU 138 Ca -0.08 0.16 0.14 0.00 -0.00 0.00 0.00 57.88 58.10 1ybj h LEU 138 Cb 0.66 0.34 -0.04 0.00 -0.00 0.00 0.00 40.66 41.61 1ybj h LEU 138 CO 0.13 -0.19 0.45 0.24 -0.00 0.00 0.00 178.44 179.08 1ybj h MET 139 N -0.03 0.31 -0.01 1.13 2.86 -0.75 0.13 114.93 118.57 1ybj h MET 139 Ca 0.24 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1ybj h MET 139 Cb 0.40 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1ybj h MET 139 CO -0.53 0.21 -0.45 0.43 1.06 0.00 0.00 176.91 177.62 1ybj n SER 140 N -4.45 1.21 0.00 1.22 7.64 -0.21 -4.68 113.62 114.35 1ybj n SER 140 Ca 0.12 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 59.03 1ybj n SER 140 Cb 0.51 0.36 0.00 0.00 -1.01 0.00 0.00 64.21 64.07 1ybj n SER 140 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ybj n GLY 141 N 1.41 0.92 3.60 0.23 0.00 0.03 -4.99 105.19 106.39 1ybj n GLY 141 Ca 0.09 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 1ybj n GLY 141 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ybj s ASP 142 N -2.44 5.05 -0.00 1.61 2.15 0.20 -4.76 116.67 118.48 1ybj s ASP 142 Ca 0.00 0.02 0.03 0.00 0.43 0.00 0.00 52.55 53.03 1ybj s ASP 142 Cb 0.00 -1.59 0.07 0.00 -0.30 0.00 0.00 42.92 41.10 1ybj s ASP 142 CO 0.00 0.28 1.06 0.35 -0.17 0.00 0.00 175.17 176.69 1ybj n THR 143 N 2.77 1.02 0.29 1.71 -2.24 -1.26 -2.42 114.28 114.15 1ybj n THR 143 Ca -0.18 -1.02 0.16 0.00 -2.27 0.00 0.00 64.05 60.74 1ybj n THR 143 Cb 0.53 0.49 0.58 0.00 -2.10 0.00 0.00 70.33 69.82 1ybj n THR 143 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1ybj h GLY 144 N 0.45 0.00 0.68 3.38 0.00 -1.95 -0.59 103.07 105.04 1ybj h GLY 144 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 1ybj h GLY 144 CO 0.00 0.00 -1.94 0.00 0.00 0.00 0.00 176.54 174.60 1ybj n ALA 145 N -2.05 1.16 -0.17 3.60 0.00 -1.26 -4.06 120.51 117.73 1ybj n ALA 145 Ca 0.01 -0.71 -0.10 0.00 0.00 0.00 0.00 53.44 52.64 1ybj n ALA 145 Cb 0.34 -0.69 0.03 0.00 0.00 0.00 0.00 19.45 19.13 1ybj n ALA 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ybj h LEU 146 N 0.04 1.01 -1.48 0.00 6.46 -1.79 -2.27 115.31 117.28 1ybj h LEU 146 Ca -0.39 -0.34 0.09 0.00 -0.12 0.00 0.00 57.88 57.12 1ybj h LEU 146 Cb 2.03 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 41.64 1ybj h LEU 146 CO 0.07 1.13 0.46 1.05 -0.62 0.00 0.00 178.44 180.53 1ybj h GLU 147 N 0.88 0.58 0.06 1.25 4.11 -1.29 0.33 114.58 120.50 1ybj h GLU 147 Ca 0.13 -0.03 -0.25 0.00 0.07 0.00 0.00 59.36 59.28 1ybj h GLU 147 Cb 0.70 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.82 1ybj h GLU 147 CO 0.05 0.38 -1.07 0.00 0.07 0.00 0.00 179.01 178.44 1ybj h THR 148 N 0.60 1.43 -0.33 -1.06 1.03 -1.61 -1.85 112.91 111.11 1ybj h THR 148 Ca 0.31 -2.67 -0.06 0.00 -0.01 0.00 0.00 66.41 63.98 1ybj h THR 148 Cb 0.44 2.63 -0.01 0.00 -1.07 0.00 0.00 68.15 70.14 1ybj h THR 148 CO -0.10 0.79 -0.01 0.00 -0.01 0.00 0.00 175.52 176.19 1ybj h ALA 149 N 0.66 0.45 -0.84 0.00 0.00 -0.75 -3.00 119.26 115.78 1ybj h ALA 149 Ca -0.11 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.63 1ybj h ALA 149 Cb 1.74 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.34 1ybj h ALA 149 CO 0.18 0.22 0.50 -0.07 0.00 0.00 0.00 179.25 180.09 1ybj h LEU 150 N 0.40 0.75 -0.08 0.00 3.38 -0.34 0.13 115.31 119.54 1ybj h LEU 150 Ca 0.09 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ybj h LEU 150 Cb 0.47 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1ybj h LEU 150 CO 0.02 0.45 0.14 0.59 0.09 0.00 0.00 178.44 179.73 1ybj n ASN 151 N -4.69 0.03 -0.03 -0.43 3.02 -0.70 -1.93 115.26 110.53 1ybj n ASN 151 Ca 0.13 0.39 -0.17 0.00 -0.03 0.00 0.00 54.58 54.90 1ybj n ASN 151 Cb 0.24 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1ybj n ASN 151 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1ybj h GLY 152 N 0.00 0.89 0.32 7.41 0.00 -1.04 -1.24 103.07 109.42 1ybj h GLY 152 Ca 0.00 -1.21 -0.21 0.00 0.00 0.00 0.00 47.33 45.91 1ybj h GLY 152 CO 0.00 1.08 -1.08 -2.22 0.00 0.00 0.00 176.54 174.32 1ybj h ILE 153 N 0.57 1.17 -0.63 2.60 5.03 -1.56 -3.37 117.51 121.33 1ybj h ILE 153 Ca -0.04 -2.34 0.06 0.00 -0.12 0.00 0.00 64.86 62.42 1ybj h ILE 153 Cb 1.36 2.75 -0.06 0.00 -3.03 0.00 0.00 36.82 37.84 1ybj h ILE 153 CO 0.15 0.59 0.32 -0.07 -0.68 0.00 0.00 178.15 178.47 1ybj h LEU 154 N -0.61 0.46 -2.22 1.44 -0.00 -1.58 -1.79 115.31 111.01 1ybj h LEU 154 Ca -0.25 0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 57.66 1ybj h LEU 154 Cb 1.50 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 42.11 1ybj h LEU 154 CO -0.01 0.29 -0.05 -0.78 -0.00 0.00 0.00 178.44 177.89 1ybj h ASP 155 N 0.60 0.00 -0.17 -0.43 3.58 -1.27 0.63 116.42 119.36 1ybj h ASP 155 Ca 0.29 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.66 1ybj h ASP 155 Cb 0.22 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 1ybj h ASP 155 CO -0.20 0.05 -0.14 -0.78 -2.88 0.00 0.00 179.24 175.29 1ybj h ASP 156 N 0.00 0.55 0.29 2.28 3.58 -1.47 -2.69 116.42 118.96 1ybj h ASP 156 Ca -0.00 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.29 1ybj h ASP 156 Cb 0.22 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.12 1ybj h ASP 156 CO 0.01 0.72 -1.18 -1.22 -2.88 0.00 0.00 179.24 174.69 1ybj n TYR 157 N -4.18 0.18 -0.06 0.28 4.01 0.14 -4.98 117.16 112.56 1ybj n TYR 157 Ca 0.01 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1ybj n TYR 157 Cb 0.35 -0.37 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 1ybj n TYR 157 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ybj n GLY 158 N 1.37 1.37 0.00 2.72 0.00 0.19 -5.08 105.19 105.76 1ybj n GLY 158 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1ybj n GLY 158 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ybj n LEU 159 N 0.00 0.00 0.00 0.99 7.99 0.85 -4.90 117.00 121.93 1ybj n LEU 159 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 56.01 55.93 1ybj n LEU 159 Cb 0.01 0.00 0.03 0.00 -0.11 0.00 0.00 43.42 43.35 1ybj n LEU 159 CO 0.00 -0.08 0.62 -1.54 -1.51 0.00 0.00 177.39 174.89 1ybj n SER 160 N -0.50 -2.14 0.34 -1.43 3.41 -1.26 -3.56 113.62 108.46 1ybj n SER 160 Ca 0.00 -2.39 0.22 0.00 -0.26 0.00 0.00 58.87 56.43 1ybj n SER 160 Cb 0.00 3.55 1.15 0.00 -0.26 0.00 0.00 64.21 68.65 1ybj n SER 160 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1ybj h VAL 161 N 1.99 0.03 -0.31 -3.33 3.04 -1.90 -1.08 116.25 114.70 1ybj h VAL 161 Ca -0.32 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 1ybj h VAL 161 Cb 1.23 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.47 1ybj h VAL 161 CO 0.41 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.56 1ybj n ASN 162 N -3.10 2.25 -4.83 3.17 3.02 -1.26 -0.65 115.26 113.85 1ybj n ASN 162 Ca -0.03 -2.15 -0.33 0.00 -0.03 0.00 0.00 54.58 52.04 1ybj n ASN 162 Cb 0.12 -0.35 -0.06 0.00 -0.61 0.00 0.00 39.78 38.87 1ybj n ASN 162 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ybj s SER 163 N -0.77 6.90 0.50 6.41 0.15 -0.41 -4.66 113.70 121.81 1ybj s SER 163 Ca 0.23 1.44 -0.20 0.00 0.70 0.00 0.00 55.95 58.11 1ybj s SER 163 Cb 0.14 -2.43 -0.08 0.00 -1.71 0.00 0.00 66.02 61.94 1ybj s SER 163 CO 0.12 -0.19 1.08 -0.89 1.20 0.00 0.00 173.24 174.56 1ybj s THR 164 N -1.93 3.52 0.63 6.45 2.01 -1.25 -1.02 115.64 124.05 1ybj s THR 164 Ca 0.54 0.98 0.29 0.00 0.31 0.00 0.00 61.69 63.81 1ybj s THR 164 Cb -0.12 -3.41 0.33 0.00 0.01 0.00 0.00 72.50 69.32 1ybj s THR 164 CO 0.17 -0.18 1.92 -0.26 -0.69 0.00 0.00 174.62 175.59 1ybj h PHE 165 N 1.54 0.00 0.00 4.92 0.04 0.36 0.24 116.94 124.04 1ybj h PHE 165 Ca -0.50 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.20 1ybj h PHE 165 Cb 1.24 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.38 1ybj h PHE 165 CO 0.55 0.00 -0.41 0.22 -0.60 0.00 0.00 178.31 178.06 1ybj h ASP 166 N 0.00 0.00 -0.37 2.17 3.58 -1.83 -3.27 116.42 116.70 1ybj h ASP 166 Ca 0.09 -0.74 -0.07 0.00 0.42 0.00 0.00 57.03 56.73 1ybj h ASP 166 Cb 0.85 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 1ybj h ASP 166 CO -0.00 1.11 -0.04 1.56 -2.88 0.00 0.00 179.24 178.99 1ybj h GLN 167 N -1.00 0.68 0.46 0.28 4.20 -1.54 0.48 115.11 118.66 1ybj h GLN 167 Ca -0.11 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.35 1ybj h GLN 167 Cb 1.01 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 1ybj h GLN 167 CO -0.07 0.81 -0.44 0.28 -0.67 0.00 0.00 178.83 178.74 1ybj h VAL 168 N 0.48 0.12 -0.78 -0.54 2.07 -0.81 0.30 116.25 117.09 1ybj h VAL 168 Ca 0.10 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.71 1ybj h VAL 168 Cb 0.53 0.12 -0.07 0.00 -1.52 0.00 0.00 31.29 30.35 1ybj h VAL 168 CO 0.03 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.04 1ybj h ALA 169 N -0.63 1.10 -0.34 1.67 0.00 -1.60 0.12 119.26 119.58 1ybj h ALA 169 Ca -0.05 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ybj h ALA 169 Cb 0.80 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1ybj h ALA 169 CO -0.06 0.04 -0.18 0.00 0.00 0.00 0.00 179.25 179.05 1ybj h ALA 170 N 1.45 1.06 0.00 0.00 0.00 -0.65 0.61 119.26 121.73 1ybj h ALA 170 Ca 0.38 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1ybj h ALA 170 Cb 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1ybj h ALA 170 CO -0.26 0.57 -0.85 0.00 0.00 0.00 0.00 179.25 178.71 1ybj h ALA 171 N 1.25 0.59 0.00 0.00 0.00 0.80 -1.04 119.26 120.85 1ybj h ALA 171 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1ybj h ALA 171 Cb 0.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ybj h ALA 171 CO 0.04 1.01 -0.40 1.79 0.00 0.00 0.00 179.25 181.69 1ybj h THR 172 N 0.03 0.00 -0.15 0.00 1.35 -0.68 -2.08 112.91 111.38 1ybj h THR 172 Ca -0.02 -0.53 -0.08 0.00 -0.55 0.00 0.00 66.41 65.24 1ybj h THR 172 Cb 1.49 1.27 -0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1ybj h THR 172 CO 0.12 0.00 -0.21 0.00 -0.25 0.00 0.00 175.52 175.18 1ybj h ALA 173 N 2.47 0.23 0.00 6.62 0.00 -0.64 -3.43 119.26 124.51 1ybj h ALA 173 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ybj h ALA 173 Cb 0.76 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1ybj h ALA 173 CO 0.00 0.17 0.00 1.55 0.00 0.00 0.00 179.25 180.97 1ybj n VAL 174 N -4.48 0.00 0.00 0.00 3.14 -0.92 -5.08 118.33 110.99 1ybj n VAL 174 Ca -0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 1ybj n VAL 174 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.19 1ybj n VAL 174 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ybj n GLY 175 N -0.32 1.43 1.05 7.55 0.00 -0.44 -4.94 105.19 109.52 1ybj n GLY 175 Ca 0.00 -1.07 0.05 0.00 0.00 0.00 0.00 46.02 45.00 1ybj n GLY 175 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ybj n VAL 176 N 2.34 1.04 1.57 1.61 0.24 -1.26 -4.80 118.33 119.08 1ybj n VAL 176 Ca 0.00 -2.03 0.13 0.00 -2.04 0.00 0.00 64.34 60.40 1ybj n VAL 176 Cb 0.00 0.41 0.57 0.00 -1.47 0.00 0.00 33.84 33.35 1ybj n VAL 176 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ybj n GLN 177 N -0.28 1.50 0.00 7.34 6.02 -1.26 -5.05 117.38 125.65 1ybj n GLN 177 Ca 0.12 -0.73 0.00 0.00 -0.01 0.00 0.00 57.00 56.38 1ybj n GLN 177 Cb 0.92 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.74 1ybj n GLN 177 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63