#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 3.30 0.25 0.00 5.36 -1.16 -3.73 117.98 122.00 1ybj s PHE 2 Ca 0.00 1.22 -0.22 0.00 -0.96 0.00 0.00 56.93 56.97 1ybj s PHE 2 Cb 0.00 -3.57 0.03 0.00 -0.34 0.00 0.00 43.02 39.14 1ybj s PHE 2 CO 0.00 -1.81 0.73 -1.12 -1.46 0.00 0.00 175.22 171.56 1ybj s SER 3 N 0.49 -0.30 -0.08 6.13 0.01 0.14 -4.69 113.70 115.40 1ybj s SER 3 Ca 0.57 -0.49 -0.22 0.00 1.31 0.00 0.00 55.95 57.12 1ybj s SER 3 Cb -0.35 0.68 -0.04 0.00 0.21 0.00 0.00 66.02 66.52 1ybj s SER 3 CO 0.36 -1.24 0.63 0.54 0.41 0.00 0.00 173.24 173.94 1ybj s VAL 4 N -3.82 5.08 -0.67 3.43 0.11 -1.26 -2.56 120.40 120.72 1ybj s VAL 4 Ca 0.10 1.29 0.00 0.00 -2.93 0.00 0.00 61.98 60.44 1ybj s VAL 4 Cb -0.05 -3.97 0.40 0.00 -1.53 0.00 0.00 36.38 31.23 1ybj s VAL 4 CO 0.03 0.28 1.75 0.59 -3.33 0.00 0.00 175.10 174.42 1ybj n ASN 5 N 3.71 6.71 -4.77 3.54 3.02 0.40 -4.89 115.26 122.98 1ybj n ASN 5 Ca -0.03 -3.79 -0.37 0.00 -0.03 0.00 0.00 54.58 50.35 1ybj n ASN 5 Cb 0.51 -0.85 -0.02 0.00 -0.61 0.00 0.00 39.78 38.82 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 -3.86 2.99 -0.41 3.10 1.13 -1.26 -0.88 117.35 118.17 1ybj s TYR 6 Ca 0.54 1.55 -0.27 0.00 -1.41 0.00 0.00 57.07 57.48 1ybj s TYR 6 Cb 0.44 -3.36 -0.04 0.00 -1.10 0.00 0.00 41.96 37.90 1ybj s TYR 6 CO -0.24 -1.35 2.12 0.34 -2.51 0.00 0.00 175.55 173.91 1ybj s ASP 7 N -1.29 5.19 0.00 -0.18 2.15 -1.19 -4.74 116.67 116.61 1ybj s ASP 7 Ca 0.60 1.19 0.00 0.00 0.43 0.00 0.00 52.55 54.78 1ybj s ASP 7 Cb -0.29 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 39.82 1ybj s ASP 7 CO 0.36 -2.28 0.17 -1.54 -0.17 0.00 0.00 175.17 171.71 1ybj n SER 8 N 12.95 -0.35 0.00 -0.34 3.41 -1.26 -2.21 113.62 125.82 1ybj n SER 8 Ca 0.29 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1ybj n SER 8 Cb 0.50 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1ybj n SER 8 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1ybj n SER 9 N 0.99 0.00 -1.34 4.04 2.88 -1.26 -4.96 113.62 113.97 1ybj n SER 9 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 1ybj n SER 9 Cb 0.09 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 63.82 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 -0.27 1.25 -1.20 0.66 3.72 -0.94 -4.81 117.46 115.88 1ybj n PHE 10 Ca 0.00 -0.47 -0.42 0.00 -0.05 0.00 0.00 57.45 56.51 1ybj n PHE 10 Cb 0.00 -0.27 -0.06 0.00 -0.94 0.00 0.00 39.48 38.21 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 0.73 2.38 0.40 1.37 0.00 -1.26 -3.21 105.19 105.59 1ybj n GLY 11 Ca 0.19 -1.22 -0.01 0.00 0.00 0.00 0.00 46.02 44.98 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 4.64 0.31 3.67 -0.02 0.00 -1.26 -4.27 105.19 108.26 1ybj n GLY 12 Ca 0.49 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.17 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 3.10 0.07 1.61 1.51 -1.20 -4.83 117.35 117.61 1ybj s TYR 13 Ca 0.00 0.13 -0.31 0.00 -1.01 0.00 0.00 57.07 55.89 1ybj s TYR 13 Cb 0.00 -1.74 -0.06 0.00 -0.11 0.00 0.00 41.96 40.05 1ybj s TYR 13 CO 0.00 0.44 1.26 -1.54 -1.11 0.00 0.00 175.55 174.61 1ybj s SER 14 N -1.07 6.99 0.29 2.29 1.04 -1.26 0.82 113.70 122.80 1ybj s SER 14 Ca 0.15 2.10 0.04 0.00 0.48 0.00 0.00 55.95 58.72 1ybj s SER 14 Cb -0.11 -2.58 0.74 0.00 0.10 0.00 0.00 66.02 64.16 1ybj s SER 14 CO 0.04 -0.54 1.68 0.40 0.98 0.00 0.00 173.24 175.81 1ybj h ILE 15 N 4.47 0.43 -0.27 -1.02 1.08 -0.07 0.48 117.51 122.62 1ybj h ILE 15 Ca -0.41 -0.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.90 1ybj h ILE 15 Cb 1.21 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 35.00 1ybj h ILE 15 CO 0.83 0.06 0.00 -0.74 -0.69 0.00 0.00 178.15 177.62 1ybj h HIS 16 N 0.34 0.41 -0.38 1.37 2.76 -1.53 0.23 115.15 118.36 1ybj h HIS 16 Ca 0.56 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.62 1ybj h HIS 16 Cb 1.10 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.92 1ybj h HIS 16 CO -0.16 0.41 -0.13 -0.44 -1.30 0.00 0.00 177.93 176.32 1ybj h ASP 17 N 0.39 0.65 -0.05 3.26 5.19 -0.34 0.88 116.42 126.41 1ybj h ASP 17 Ca 0.09 -0.19 -0.04 0.00 -0.62 0.00 0.00 57.03 56.27 1ybj h ASP 17 Cb 0.26 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.60 1ybj h ASP 17 CO 0.01 0.81 -0.12 0.22 -3.12 0.00 0.00 179.24 177.03 1ybj h TYR 18 N 0.61 0.21 -0.58 4.55 3.20 -0.72 -2.72 116.97 121.51 1ybj h TYR 18 Ca 0.10 -0.08 0.10 0.00 3.14 0.00 0.00 58.73 61.99 1ybj h TYR 18 Cb 0.57 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.72 1ybj h TYR 18 CO 0.03 0.73 0.16 -0.07 -1.64 0.00 0.00 178.16 177.36 1ybj h LEU 19 N -0.37 0.09 -0.58 2.82 3.38 -0.39 -0.74 115.31 119.52 1ybj h LEU 19 Ca -0.00 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1ybj h LEU 19 Cb 0.73 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1ybj h LEU 19 CO 0.03 0.06 0.34 1.23 0.09 0.00 0.00 178.44 180.19 1ybj h GLY 20 N 0.31 0.82 0.98 0.83 0.00 -0.87 -2.24 103.07 102.90 1ybj h GLY 20 Ca 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 1ybj h GLY 20 CO -0.34 0.20 0.23 -1.61 0.00 0.00 0.00 176.54 175.01 1ybj h GLN 21 N 0.66 0.79 -0.53 4.80 4.15 -0.90 0.04 115.11 124.13 1ybj h GLN 21 Ca 0.24 -0.14 0.02 0.00 0.77 0.00 0.00 58.65 59.55 1ybj h GLN 21 Cb 0.06 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 1ybj h GLN 21 CO -0.12 0.68 0.31 2.35 -1.93 0.00 0.00 178.83 180.13 1ybj h TRP 22 N 0.73 0.59 0.00 3.99 7.01 -1.01 -0.90 115.95 126.35 1ybj h TRP 22 Ca 0.18 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.16 1ybj h TRP 22 Cb 0.17 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.04 1ybj h TRP 22 CO 0.00 0.33 -0.17 0.00 -2.79 0.00 0.00 178.44 175.82 1ybj h ALA 23 N 1.23 1.12 0.29 2.65 0.00 -1.07 -0.81 119.26 122.67 1ybj h ALA 23 Ca 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ybj h ALA 23 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ybj h ALA 23 CO -0.10 0.21 -0.14 1.03 0.00 0.00 0.00 179.25 180.26 1ybj h SER 24 N 0.00 -0.32 -0.13 0.00 0.87 0.42 -1.55 113.55 112.84 1ybj h SER 24 Ca -0.00 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.41 1ybj h SER 24 Cb 0.55 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 1ybj h SER 24 CO 0.02 -0.13 -0.13 0.71 -0.53 0.00 0.00 176.83 176.78 1ybj h THR 25 N -0.51 1.23 -0.80 2.23 1.35 -1.21 -2.79 112.91 112.41 1ybj h THR 25 Ca -0.04 -1.02 0.07 0.00 -0.55 0.00 0.00 66.41 64.87 1ybj h THR 25 Cb 0.38 1.16 -0.06 0.00 -1.73 0.00 0.00 68.15 67.90 1ybj h THR 25 CO 0.06 0.33 0.48 0.15 -0.25 0.00 0.00 175.52 176.30 1ybj h PHE 26 N 0.45 0.89 0.00 4.73 3.04 -0.92 -0.49 116.94 124.64 1ybj h PHE 26 Ca 0.08 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.04 1ybj h PHE 26 Cb 0.50 -0.28 -0.00 0.00 2.56 0.00 0.00 35.95 38.72 1ybj h PHE 26 CO 0.02 0.43 -0.09 0.78 -2.02 0.00 0.00 178.31 177.44 1ybj h GLY 27 N 0.87 0.00 -7.15 2.40 0.00 -1.03 -3.40 103.07 94.76 1ybj h GLY 27 Ca 0.36 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 47.15 1ybj h GLY 27 CO -0.18 0.00 1.12 -0.35 0.00 0.00 0.00 176.54 177.13 1ybj s ASP 28 N -5.94 6.04 0.00 0.19 -1.08 -0.19 -4.86 116.67 110.82 1ybj s ASP 28 Ca 0.02 0.22 0.09 0.00 -0.52 0.00 0.00 52.55 52.36 1ybj s ASP 28 Cb 0.09 -2.55 0.56 0.00 -1.46 0.00 0.00 42.92 39.56 1ybj s ASP 28 CO 0.60 -1.79 0.98 1.33 0.52 0.00 0.00 175.17 176.80 1ybj n VAL 29 N 6.85 0.00 0.92 1.11 0.24 -1.26 -3.73 118.33 122.45 1ybj n VAL 29 Ca 0.12 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.56 1ybj n VAL 29 Cb 0.49 -0.67 0.51 0.00 -1.47 0.00 0.00 33.84 32.71 1ybj n VAL 29 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1ybj n ASN 30 N -0.87 0.24 -1.80 -1.34 3.02 -1.26 -4.43 115.26 108.81 1ybj n ASN 30 Ca 0.07 0.39 -0.19 0.00 -0.03 0.00 0.00 54.58 54.82 1ybj n ASN 30 Cb 0.03 -0.42 -0.05 0.00 -0.61 0.00 0.00 39.78 38.73 1ybj n ASN 30 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1ybj n HIS 31 N -1.66 -0.42 -3.25 3.10 -0.00 -1.24 -4.93 115.22 106.82 1ybj n HIS 31 Ca 0.06 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.40 1ybj n HIS 31 Cb 0.36 -3.48 -0.06 0.00 -0.00 0.00 0.00 29.99 26.82 1ybj n HIS 31 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 1ybj s THR 32 N -2.83 5.12 -0.30 3.57 -4.23 -1.26 -4.97 115.64 110.74 1ybj s THR 32 Ca 0.00 1.09 -0.17 0.00 -1.18 0.00 0.00 61.69 61.44 1ybj s THR 32 Cb 0.00 -3.88 0.18 0.00 1.34 0.00 0.00 72.50 70.14 1ybj s THR 32 CO 0.00 0.33 1.10 0.21 -0.54 0.00 0.00 174.62 175.72 1ybj s ASN 33 N 0.52 -0.39 0.00 3.99 3.84 -1.26 -5.04 114.94 116.60 1ybj s ASN 33 Ca 0.29 0.53 0.17 0.00 0.21 0.00 0.00 52.86 54.07 1ybj s ASN 33 Cb -0.16 1.43 0.85 0.00 -0.55 0.00 0.00 41.25 42.81 1ybj s ASN 33 CO 0.13 -0.07 1.53 0.61 -2.79 0.00 0.00 177.10 176.50 1ybj n GLY 34 N 4.75 -0.92 0.09 1.21 0.00 -1.26 -3.02 105.19 106.05 1ybj n GLY 34 Ca -0.09 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.34 1.55 -4.50 1.61 3.02 -1.26 -4.97 115.26 109.38 1ybj n ASN 35 Ca 0.07 -1.44 -0.42 0.00 -0.03 0.00 0.00 54.58 52.76 1ybj n ASN 35 Cb 0.15 -0.02 -0.09 0.00 -0.61 0.00 0.00 39.78 39.21 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 -0.49 5.18 -0.04 2.41 1.01 -1.17 -4.80 120.40 122.51 1ybj s VAL 36 Ca 0.03 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 1ybj s VAL 36 Cb 0.02 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1ybj s VAL 36 CO 0.03 -0.25 -0.08 0.35 0.00 0.00 0.00 175.10 175.14 1ybj n THR 37 N 5.27 0.43 0.00 3.92 -2.24 -1.26 -4.87 114.28 115.52 1ybj n THR 37 Ca -0.09 0.34 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1ybj n THR 37 Cb 0.48 -1.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 1ybj n THR 37 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ybj n ASP 38 N -3.02 0.00 -2.76 3.42 9.92 -1.26 -4.95 116.55 117.90 1ybj n ASP 38 Ca -0.03 0.73 -0.07 0.00 -0.53 0.00 0.00 54.79 54.88 1ybj n ASP 38 Cb 0.12 -0.23 0.03 0.00 -0.64 0.00 0.00 41.12 40.41 1ybj n ASP 38 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ybj n ALA 39 N -1.65 -2.07 -2.15 2.24 0.00 -0.42 -4.99 120.51 111.47 1ybj n ALA 39 Ca 0.00 0.07 -0.34 0.00 0.00 0.00 0.00 53.44 53.17 1ybj n ALA 39 Cb 0.00 -3.36 -0.06 0.00 0.00 0.00 0.00 19.45 16.03 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 -3.11 6.86 -0.16 0.00 0.01 0.06 -4.81 114.94 113.80 1ybj s ASN 40 Ca 0.23 1.30 -0.02 0.00 -0.71 0.00 0.00 52.86 53.65 1ybj s ASN 40 Cb -0.03 -2.38 -0.23 0.00 0.41 0.00 0.00 41.25 39.02 1ybj s ASN 40 CO 0.55 -0.11 0.19 -1.20 -1.51 0.00 0.00 177.10 175.02 1ybj n SER 41 N 0.05 1.94 0.00 -1.22 7.64 -1.26 -3.67 113.62 117.10 1ybj n SER 41 Ca 0.01 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1ybj n SER 41 Cb 0.52 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 1ybj n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ybj n GLY 42 N 2.05 0.34 1.43 0.23 0.00 -1.26 -0.25 105.19 107.73 1ybj n GLY 42 Ca -0.36 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.19 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 0.64 1.32 -0.02 0.00 0.64 -4.94 105.19 102.83 1ybj n GLY 43 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.31 -3.44 -0.03 1.61 3.72 -1.26 -4.97 117.46 111.78 1ybj n PHE 44 Ca 0.00 1.79 0.01 0.00 -0.05 0.00 0.00 57.45 59.20 1ybj n PHE 44 Cb 0.48 -3.05 -0.10 0.00 -0.94 0.00 0.00 39.48 35.86 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 0.15 0.00 0.88 1.38 9.36 -1.08 -4.70 117.16 123.15 1ybj n TYR 45 Ca 0.00 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.23 1ybj n TYR 45 Cb 0.00 -0.44 0.03 0.00 -0.63 0.00 0.00 39.34 38.30 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 1.98 1.56 0.00 2.98 0.00 -1.26 -4.94 105.19 105.51 1ybj n GLY 46 Ca -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 0.06 0.23 0.08 -0.02 0.00 -1.26 -4.40 105.19 99.89 1ybj n GLY 47 Ca 0.02 -1.41 -0.12 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.05 0.00 1.61 0.02 -1.94 -3.44 113.55 109.74 1ybj h SER 48 Ca 0.00 -0.62 -0.02 0.00 -0.84 0.00 0.00 61.79 60.32 1ybj h SER 48 Cb 0.00 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1ybj h SER 48 CO 0.00 0.67 -0.03 0.00 -1.14 0.00 0.00 176.83 176.33 1ybj n LEU 49 N -4.76 -0.12 -3.47 5.07 -0.00 -1.26 -4.97 117.00 107.49 1ybj n LEU 49 Ca -0.08 -0.90 -0.13 0.00 -0.00 0.00 0.00 56.01 54.90 1ybj n LEU 49 Cb 0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.71 1ybj n LEU 49 CO 0.28 0.95 0.48 -0.94 -0.00 0.00 0.00 177.39 178.16 1ybj s SER 50 N -0.12 -0.55 0.00 1.45 1.04 -1.26 -0.50 113.70 113.76 1ybj s SER 50 Ca 0.00 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.65 1ybj s SER 50 Cb 0.00 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1ybj s SER 50 CO 0.00 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1ybj n GLY 51 N 0.06 2.35 0.00 7.32 0.00 -0.24 -4.01 105.19 110.67 1ybj n GLY 51 Ca -0.16 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1ybj n GLY 51 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ybj n SER 52 N 0.00 1.15 -4.45 1.61 2.88 -1.26 -3.98 113.62 109.57 1ybj n SER 52 Ca 0.00 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.09 1ybj n SER 52 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1ybj n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ybj n GLN 53 N 0.00 0.48 -3.73 -1.46 6.02 -0.65 -4.08 117.38 113.96 1ybj n GLN 53 Ca 0.00 0.17 -0.30 0.00 -0.01 0.00 0.00 57.00 56.86 1ybj n GLN 53 Cb 0.00 -1.33 -0.14 0.00 1.02 0.00 0.00 30.24 29.79 1ybj n GLN 53 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1ybj s TYR 54 N -1.17 1.86 0.19 1.08 5.04 -1.08 -2.64 117.35 120.62 1ybj s TYR 54 Ca 0.62 -1.98 -0.13 0.00 -2.44 0.00 0.00 57.07 53.13 1ybj s TYR 54 Cb -0.78 -1.80 -0.07 0.00 0.35 0.00 0.00 41.96 39.66 1ybj s TYR 54 CO 0.58 -0.86 0.58 0.00 -1.34 0.00 0.00 175.55 174.51 1ybj s ALA 55 N 1.23 3.54 -0.10 3.97 0.00 -1.26 -1.45 121.76 127.69 1ybj s ALA 55 Ca 0.12 -0.14 -0.04 0.00 0.00 0.00 0.00 51.96 51.90 1ybj s ALA 55 Cb -0.19 -2.54 0.05 0.00 0.00 0.00 0.00 23.12 20.44 1ybj s ALA 55 CO -0.17 0.45 0.21 0.42 0.00 0.00 0.00 175.76 176.68 1ybj s ILE 56 N -1.61 -0.31 0.35 0.00 -1.09 0.13 -0.26 121.20 118.41 1ybj s ILE 56 Ca 0.42 0.30 0.07 0.00 -2.23 0.00 0.00 60.65 59.22 1ybj s ILE 56 Cb -0.14 -0.36 -0.02 0.00 -1.58 0.00 0.00 42.46 40.36 1ybj s ILE 56 CO 0.20 0.13 0.35 -0.55 -1.23 0.00 0.00 174.94 173.84 1ybj s SER 57 N 2.23 5.41 0.71 3.58 0.15 0.66 0.06 113.70 126.50 1ybj s SER 57 Ca 0.01 -0.46 -0.16 0.00 0.70 0.00 0.00 55.95 56.04 1ybj s SER 57 Cb -0.12 -0.96 0.03 0.00 -1.71 0.00 0.00 66.02 63.26 1ybj s SER 57 CO -0.07 -0.43 1.24 -0.55 1.20 0.00 0.00 173.24 174.63 1ybj s SER 58 N -4.07 4.24 -0.01 5.45 0.15 0.71 -4.92 113.70 115.25 1ybj s SER 58 Ca 0.43 2.47 0.20 0.00 0.70 0.00 0.00 55.95 59.75 1ybj s SER 58 Cb -0.06 -2.60 -0.25 0.00 -1.71 0.00 0.00 66.02 61.39 1ybj s SER 58 CO 0.28 -2.24 0.67 0.35 1.20 0.00 0.00 173.24 173.50 1ybj n THR 59 N -2.50 0.00 0.01 6.45 -2.24 -1.26 -2.68 114.28 112.07 1ybj n THR 59 Ca 0.14 -0.21 -0.10 0.00 -2.27 0.00 0.00 64.05 61.62 1ybj n THR 59 Cb 0.49 0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 1ybj n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ybj h ALA 60 N 2.39 -0.14 -0.02 6.98 0.00 -1.92 -3.38 119.26 123.17 1ybj h ALA 60 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ybj h ALA 60 Cb 0.65 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ybj h ALA 60 CO 0.00 -0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.33 1ybj n ASN 61 N -4.84 1.57 -3.16 0.00 0.23 -1.26 -4.67 115.26 103.13 1ybj n ASN 61 Ca -0.07 -1.31 -0.19 0.00 -0.53 0.00 0.00 54.58 52.48 1ybj n ASN 61 Cb 0.26 -0.01 -0.04 0.00 -2.08 0.00 0.00 39.78 37.91 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 0.29 -0.90 0.02 -3.83 6.02 -1.09 -4.35 117.38 113.54 1ybj n GLN 62 Ca 0.04 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 1ybj n GLN 62 Cb 0.16 -2.16 0.00 0.00 1.02 0.00 0.00 30.24 29.26 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 -2.46 0.12 -1.75 5.09 3.14 -1.26 -4.79 118.33 116.41 1ybj n VAL 63 Ca -0.02 0.04 -0.41 0.00 -2.96 0.00 0.00 64.34 60.99 1ybj n VAL 63 Cb 0.27 -1.08 -0.03 0.00 -1.06 0.00 0.00 33.84 31.94 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 3.18 0.43 1.55 2.01 -1.26 0.11 115.64 119.65 1ybj s THR 64 Ca 0.00 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1ybj s THR 64 Cb 0.00 -3.28 -0.00 0.00 0.01 0.00 0.00 72.50 69.23 1ybj s THR 64 CO 0.00 -0.21 0.02 0.00 -0.69 0.00 0.00 174.62 173.74 1ybj n ALA 65 N 12.07 0.39 -3.63 7.40 0.00 0.09 -0.21 120.51 136.62 1ybj n ALA 65 Ca 0.28 -1.94 -0.09 0.00 0.00 0.00 0.00 53.44 51.69 1ybj n ALA 65 Cb 0.48 1.09 -0.09 0.00 0.00 0.00 0.00 19.45 20.93 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 -2.61 -0.83 -0.23 0.00 5.36 0.11 -2.40 117.98 117.39 1ybj s PHE 66 Ca 0.02 1.74 -0.04 0.00 -0.96 0.00 0.00 56.93 57.69 1ybj s PHE 66 Cb 0.00 0.43 -0.01 0.00 -0.34 0.00 0.00 43.02 43.10 1ybj s PHE 66 CO 0.02 -0.43 -0.02 0.08 -1.46 0.00 0.00 175.22 173.41 1ybj s VAL 67 N 1.32 3.53 0.59 3.12 1.01 0.52 0.22 120.40 130.70 1ybj s VAL 67 Ca -0.08 -0.44 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 1ybj s VAL 67 Cb -0.06 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.73 1ybj s VAL 67 CO -0.14 0.41 0.87 0.00 0.00 0.00 0.00 175.10 176.24 1ybj s ALA 68 N 1.50 3.44 0.00 5.51 0.00 -0.53 -0.53 121.76 131.16 1ybj s ALA 68 Ca 0.06 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.11 1ybj s ALA 68 Cb -0.14 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.54 1ybj s ALA 68 CO -0.02 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.31 1ybj n GLY 69 N -2.54 -1.43 0.93 0.00 0.00 -0.09 -2.64 105.19 99.41 1ybj n GLY 69 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 1ybj n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ybj n GLY 70 N 0.65 -0.68 1.13 -0.02 0.00 -1.26 -1.63 105.19 103.38 1ybj n GLY 70 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.01 0.27 -4.78 1.61 4.05 -1.23 -4.19 115.26 110.98 1ybj n ASN 71 Ca -0.00 -1.92 -0.37 0.00 0.45 0.00 0.00 54.58 52.74 1ybj n ASN 71 Cb 0.36 -0.12 -0.06 0.00 1.23 0.00 0.00 39.78 41.19 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 0.00 4.31 -0.09 1.20 1.43 -1.25 -1.33 118.68 122.95 1ybj s LEU 72 Ca 0.17 1.88 -0.04 0.00 -1.03 0.00 0.00 54.13 55.12 1ybj s LEU 72 Cb 0.20 -4.04 0.05 0.00 0.03 0.00 0.00 46.19 42.43 1ybj s LEU 72 CO -0.09 -0.14 0.18 -0.89 0.23 0.00 0.00 176.35 175.64 1ybj s THR 73 N -1.62 -0.19 -0.17 5.49 2.01 -0.32 -1.08 115.64 119.76 1ybj s THR 73 Ca 0.51 0.26 -0.27 0.00 0.31 0.00 0.00 61.69 62.51 1ybj s THR 73 Cb -0.19 -0.31 -0.01 0.00 0.01 0.00 0.00 72.50 72.00 1ybj s THR 73 CO 0.25 0.11 0.93 -0.47 -0.69 0.00 0.00 174.62 174.75 1ybj s TYR 74 N 1.84 3.42 0.26 4.92 5.04 0.35 -0.39 117.35 132.80 1ybj s TYR 74 Ca -0.03 1.40 -0.04 0.00 -2.44 0.00 0.00 57.07 55.96 1ybj s TYR 74 Cb -0.12 -3.13 0.32 0.00 0.35 0.00 0.00 41.96 39.38 1ybj s TYR 74 CO -0.07 -0.30 1.89 1.79 -1.34 0.00 0.00 175.55 177.52 1ybj h THR 75 N 5.24 1.24 0.00 4.34 1.35 -0.30 -3.46 112.91 121.32 1ybj h THR 75 Ca -0.27 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 1ybj h THR 75 Cb 1.12 0.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 1ybj h THR 75 CO 0.88 0.27 0.00 -0.11 -0.25 0.00 0.00 175.52 176.30 1ybj n LEU 76 N -4.35 0.00 -1.26 3.87 7.94 -1.26 -0.86 117.00 121.08 1ybj n LEU 76 Ca 0.09 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.10 1ybj n LEU 76 Cb 0.09 0.00 0.28 0.00 0.53 0.00 0.00 43.42 44.33 1ybj n LEU 76 CO 0.38 0.00 0.74 0.49 -1.11 0.00 0.00 177.39 177.90 1ybj n PHE 77 N 0.00 0.81 -1.63 1.96 3.72 -1.26 -2.00 117.46 119.06 1ybj n PHE 77 Ca 0.00 -0.42 -0.30 0.00 -0.05 0.00 0.00 57.45 56.68 1ybj n PHE 77 Cb 0.00 -0.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.75 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 -1.15 2.15 0.12 4.37 0.01 -0.04 -4.88 114.94 115.53 1ybj s ASN 78 Ca 0.45 0.32 -0.29 0.00 -0.71 0.00 0.00 52.86 52.63 1ybj s ASN 78 Cb 0.24 -0.37 -0.07 0.00 0.41 0.00 0.00 41.25 41.46 1ybj s ASN 78 CO 0.32 -3.34 1.59 -0.33 -1.51 0.00 0.00 177.10 173.83 1ybj h GLU 79 N -2.05 -0.51 -0.80 -0.60 4.39 -1.89 -1.19 114.58 111.92 1ybj h GLU 79 Ca -0.44 0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.36 1ybj h GLU 79 Cb 1.24 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.96 1ybj h GLU 79 CO 0.33 -0.34 0.52 -1.35 -1.16 0.00 0.00 179.01 177.01 1ybj h PRO 80 N -0.53 0.85 -2.82 2.33 0.11 -1.88 -3.49 132.00 126.57 1ybj h PRO 80 Ca 0.06 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1ybj h PRO 80 Cb 0.63 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1ybj h PRO 80 CO -0.33 0.57 -0.61 0.00 -0.21 0.00 0.00 178.00 177.42 1ybj n ALA 81 N -2.43 -2.39 -3.80 -0.75 0.00 -0.45 -4.77 120.51 105.91 1ybj n ALA 81 Ca 0.12 0.30 -0.34 0.00 0.00 0.00 0.00 53.44 53.52 1ybj n ALA 81 Cb 0.21 -1.11 0.03 0.00 0.00 0.00 0.00 19.45 18.58 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 0.59 -1.76 -4.04 0.00 8.25 -0.85 -4.89 115.22 112.53 1ybj n HIS 82 Ca 0.00 0.39 -0.10 0.00 -0.26 0.00 0.00 57.72 57.76 1ybj n HIS 82 Cb 0.00 -3.32 -0.07 0.00 1.12 0.00 0.00 29.99 27.73 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 -3.54 0.01 -0.09 1.59 -4.23 -1.26 -4.94 115.64 103.19 1ybj s THR 83 Ca 0.43 -1.55 -0.01 0.00 -1.18 0.00 0.00 61.69 59.38 1ybj s THR 83 Cb -0.17 -2.20 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 1ybj s THR 83 CO 0.89 -0.06 -0.04 -0.22 -0.54 0.00 0.00 174.62 174.66 1ybj s LEU 84 N -3.04 3.35 -0.23 4.79 2.96 -1.26 0.47 118.68 125.72 1ybj s LEU 84 Ca 0.25 0.04 -0.21 0.00 -0.22 0.00 0.00 54.13 53.99 1ybj s LEU 84 Cb 0.02 -1.75 0.06 0.00 0.50 0.00 0.00 46.19 45.02 1ybj s LEU 84 CO 0.08 0.35 0.61 -0.72 -1.32 0.00 0.00 176.35 175.35 1ybj s TYR 85 N -0.70 -0.69 0.00 5.38 1.13 0.48 -4.35 117.35 118.59 1ybj s TYR 85 Ca 0.11 1.66 0.00 0.00 -1.41 0.00 0.00 57.07 57.43 1ybj s TYR 85 Cb -0.11 0.26 0.00 0.00 -1.10 0.00 0.00 41.96 41.00 1ybj s TYR 85 CO 0.02 -0.34 0.00 0.41 -2.51 0.00 0.00 175.55 173.13 1ybj n GLY 86 N 2.90 1.94 3.06 5.49 0.00 -1.26 -1.17 105.19 116.14 1ybj n GLY 86 Ca -0.14 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 4.12 0.45 -0.09 1.61 -0.44 -0.44 0.08 119.66 124.94 1ybj s GLN 87 Ca 0.00 -0.60 -0.03 0.00 -2.50 0.00 0.00 55.36 52.23 1ybj s GLN 87 Cb 0.00 0.17 0.04 0.00 -1.64 0.00 0.00 33.01 31.58 1ybj s GLN 87 CO 0.00 -0.10 0.06 -1.17 0.50 0.00 0.00 175.29 174.58 1ybj s LEU 88 N -1.66 0.34 -0.06 3.68 2.96 0.49 -3.52 118.68 120.90 1ybj s LEU 88 Ca -0.12 -0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 53.50 1ybj s LEU 88 Cb -0.06 -0.24 -0.04 0.00 0.50 0.00 0.00 46.19 46.35 1ybj s LEU 88 CO -0.01 -0.28 -0.16 -0.67 -1.32 0.00 0.00 176.35 173.91 1ybj n ASP 89 N 5.25 1.29 -4.75 3.68 -0.08 -1.26 -1.67 116.55 119.01 1ybj n ASP 89 Ca -0.05 0.20 -0.26 0.00 -1.51 0.00 0.00 54.79 53.17 1ybj n ASP 89 Cb 0.49 -0.47 -0.06 0.00 2.34 0.00 0.00 41.12 43.42 1ybj n ASP 89 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1ybj s SER 90 N -6.02 5.22 0.06 1.67 1.04 -1.26 -0.77 113.70 113.64 1ybj s SER 90 Ca -0.15 -0.24 -0.02 0.00 0.48 0.00 0.00 55.95 56.02 1ybj s SER 90 Cb 0.04 -1.27 -0.03 0.00 0.10 0.00 0.00 66.02 64.85 1ybj s SER 90 CO 0.21 0.07 0.01 -0.76 0.98 0.00 0.00 173.24 173.75 1ybj s LEU 91 N -3.08 2.25 -0.22 2.42 2.01 -0.14 -0.92 118.68 121.00 1ybj s LEU 91 Ca 0.30 -0.96 -0.03 0.00 0.01 0.00 0.00 54.13 53.44 1ybj s LEU 91 Cb -0.10 0.35 0.12 0.00 0.01 0.00 0.00 46.19 46.57 1ybj s LEU 91 CO 0.22 -0.63 0.34 -0.44 1.01 0.00 0.00 176.35 176.84 1ybj s SER 92 N -2.92 0.45 -0.20 2.29 0.01 0.31 0.06 113.70 113.70 1ybj s SER 92 Ca 0.08 0.21 -0.10 0.00 1.31 0.00 0.00 55.95 57.45 1ybj s SER 92 Cb 0.07 0.95 -0.05 0.00 0.21 0.00 0.00 66.02 67.21 1ybj s SER 92 CO -0.09 -0.30 0.15 -0.36 0.41 0.00 0.00 173.24 173.05 1ybj s PHE 93 N 2.50 3.40 -0.11 2.43 0.40 -0.68 -0.35 117.98 125.57 1ybj s PHE 93 Ca 0.10 0.34 -0.33 0.00 -0.60 0.00 0.00 56.93 56.43 1ybj s PHE 93 Cb -0.15 -2.19 0.13 0.00 0.51 0.00 0.00 43.02 41.33 1ybj s PHE 93 CO -0.14 0.26 1.28 0.20 0.70 0.00 0.00 175.22 177.51 1ybj s GLY 94 N 0.45 -0.36 -0.21 4.36 0.00 -1.01 -3.71 107.32 106.86 1ybj s GLY 94 Ca 0.09 1.16 -0.20 0.00 0.00 0.00 0.00 44.72 45.77 1ybj s GLY 94 CO -0.01 0.33 0.59 0.99 0.00 0.00 0.00 173.10 175.00 1ybj s ASP 95 N -2.59 6.63 0.00 1.64 1.01 -1.25 -0.73 116.67 121.38 1ybj s ASP 95 Ca 0.12 0.76 0.00 0.00 0.71 0.00 0.00 52.55 54.14 1ybj s ASP 95 Cb 0.02 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1ybj s ASP 95 CO -0.04 -0.26 0.00 0.61 0.21 0.00 0.00 175.17 175.69 1ybj n GLY 96 N 3.89 -2.31 3.86 0.21 0.00 0.12 -2.54 105.19 108.42 1ybj n GLY 96 Ca -0.02 -0.64 -0.32 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 4.01 0.10 0.99 1.43 -1.24 0.10 118.68 124.07 1ybj s LEU 97 Ca 0.00 1.15 0.05 0.00 -1.03 0.00 0.00 54.13 54.30 1ybj s LEU 97 Cb 0.00 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.21 1ybj s LEU 97 CO 0.00 -0.24 -0.12 -0.94 0.23 0.00 0.00 176.35 175.28 1ybj s SER 98 N -2.58 1.70 0.00 2.29 1.04 0.10 -0.76 113.70 115.49 1ybj s SER 98 Ca 0.52 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1ybj s SER 98 Cb -0.10 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 65.98 1ybj s SER 98 CO 0.23 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.87 1ybj n GLY 99 N 0.69 0.54 2.19 7.32 0.00 -1.26 -1.85 105.19 112.82 1ybj n GLY 99 Ca -0.17 -0.85 -0.21 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.12 3.65 0.00 -0.02 0.00 -1.26 -3.79 105.19 101.65 1ybj n GLY 100 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1ybj n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ybj n ASP 101 N 2.20 0.00 -0.04 1.61 8.00 -1.26 -4.88 116.55 122.18 1ybj n ASP 101 Ca 0.51 0.00 0.04 0.00 0.71 0.00 0.00 54.79 56.04 1ybj n ASP 101 Cb 0.69 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.84 1ybj n ASP 101 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1ybj n THR 102 N 0.00 1.23 -3.90 -3.53 -2.24 -1.26 -5.05 114.28 99.53 1ybj n THR 102 Ca 0.00 -1.36 -0.23 0.00 -2.27 0.00 0.00 64.05 60.19 1ybj n THR 102 Cb 0.00 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.44 1ybj n THR 102 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ybj s SER 103 N -1.61 4.79 0.35 3.42 0.01 -1.25 -5.10 113.70 114.31 1ybj s SER 103 Ca 0.11 -0.83 -0.27 0.00 1.31 0.00 0.00 55.95 56.28 1ybj s SER 103 Cb 0.10 -0.63 -0.09 0.00 0.21 0.00 0.00 66.02 65.61 1ybj s SER 103 CO 0.01 -0.49 1.12 -2.84 0.41 0.00 0.00 173.24 171.45 1ybj s PRO 104 N -3.97 4.33 0.58 12.44 0.02 -1.26 -4.56 135.00 142.57 1ybj s PRO 104 Ca 0.42 1.78 -0.19 0.00 0.02 0.00 0.00 61.00 63.04 1ybj s PRO 104 Cb -0.01 -2.87 -0.04 0.00 0.02 0.00 0.00 34.50 31.60 1ybj s PRO 104 CO 0.25 -0.06 1.16 0.71 -0.33 0.00 0.00 177.00 178.72 1ybj s TYR 105 N -1.35 2.53 0.02 6.54 2.02 -1.26 -4.75 117.35 121.10 1ybj s TYR 105 Ca 0.52 1.54 -0.06 0.00 -0.37 0.00 0.00 57.07 58.69 1ybj s TYR 105 Cb -0.30 -3.36 -0.01 0.00 -0.40 0.00 0.00 41.96 37.90 1ybj s TYR 105 CO 0.38 -1.87 0.11 -1.54 -1.57 0.00 0.00 175.55 171.06 1ybj s SER 106 N -1.80 0.12 -0.26 2.29 1.04 -0.77 -4.94 113.70 109.37 1ybj s SER 106 Ca 0.74 -0.40 -0.24 0.00 0.48 0.00 0.00 55.95 56.53 1ybj s SER 106 Cb -0.26 0.21 -0.00 0.00 0.10 0.00 0.00 66.02 66.07 1ybj s SER 106 CO 0.31 -0.45 0.80 -0.63 0.98 0.00 0.00 173.24 174.25 1ybj s ILE 107 N -2.09 4.84 0.08 -1.02 1.09 -1.26 0.00 121.20 122.84 1ybj s ILE 107 Ca -0.09 1.40 -0.20 0.00 -1.10 0.00 0.00 60.65 60.66 1ybj s ILE 107 Cb -0.04 -4.11 -0.10 0.00 -1.06 0.00 0.00 42.46 37.15 1ybj s ILE 107 CO -0.02 -0.12 1.55 1.56 -0.10 0.00 0.00 174.94 177.81 1ybj h GLN 108 N 7.85 0.31 -3.65 2.79 4.20 -0.47 -3.33 115.11 122.81 1ybj h GLN 108 Ca -0.24 -0.08 -0.75 0.00 0.06 0.00 0.00 58.65 57.64 1ybj h GLN 108 Cb 1.10 -0.04 -0.30 0.00 0.30 0.00 0.00 27.48 28.54 1ybj h GLN 108 CO 0.87 0.47 -0.03 0.08 -0.67 0.00 0.00 178.83 179.55 1ybj s VAL 109 N -5.20 4.92 -0.51 -0.54 1.01 -1.05 -5.02 120.40 114.00 1ybj s VAL 109 Ca -0.14 -2.91 -0.26 0.00 0.00 0.00 0.00 61.98 58.67 1ybj s VAL 109 Cb 0.07 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1ybj s VAL 109 CO 0.72 -1.01 2.22 -2.16 0.00 0.00 0.00 175.10 174.87 1ybj s PRO 110 N -0.27 2.33 0.00 2.72 0.04 -1.25 -3.80 135.00 134.77 1ybj s PRO 110 Ca 0.20 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.44 1ybj s PRO 110 Cb -0.13 -4.51 0.00 0.00 0.04 0.00 0.00 34.50 29.90 1ybj s PRO 110 CO -0.07 -3.04 0.00 -3.47 0.04 0.00 0.00 177.00 170.46 1ybj n ASP 111 N 14.67 0.00 -4.77 6.66 2.03 -1.25 -4.62 116.55 129.27 1ybj n ASP 111 Ca 0.31 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.27 1ybj n ASP 111 Cb 0.53 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1ybj n ASP 111 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ybj s VAL 112 N 3.26 3.16 0.26 5.18 1.01 -1.24 -3.16 120.40 128.86 1ybj s VAL 112 Ca 0.00 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.77 1ybj s VAL 112 Cb 0.00 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 1ybj s VAL 112 CO 0.00 -0.12 0.27 -1.20 0.00 0.00 0.00 175.10 174.05 1ybj n SER 113 N -1.08 -0.72 -4.12 3.32 7.64 -0.06 -1.68 113.62 116.91 1ybj n SER 113 Ca 0.10 -2.62 -0.14 0.00 1.01 0.00 0.00 58.87 57.23 1ybj n SER 113 Cb 0.50 1.52 -0.11 0.00 -1.01 0.00 0.00 64.21 65.11 1ybj n SER 113 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ybj s PHE 114 N -3.15 0.89 -0.28 1.43 0.40 0.11 -0.45 117.98 116.93 1ybj s PHE 114 Ca 0.28 -0.59 -0.21 0.00 -0.60 0.00 0.00 56.93 55.81 1ybj s PHE 114 Cb 0.01 -0.51 0.08 0.00 0.51 0.00 0.00 43.02 43.11 1ybj s PHE 114 CO 0.20 -0.05 0.76 0.20 0.70 0.00 0.00 175.22 177.03 1ybj s GLY 115 N -2.02 -0.51 0.00 4.36 0.00 -1.06 -0.96 107.32 107.13 1ybj s GLY 115 Ca -0.02 2.31 0.00 0.00 0.00 0.00 0.00 44.72 47.01 1ybj s GLY 115 CO -0.00 2.05 0.00 0.61 0.00 0.00 0.00 173.10 175.76 1ybj n GLY 116 N 3.30 1.07 0.18 0.20 0.00 0.05 0.23 105.19 110.21 1ybj n GLY 116 Ca -0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.41 -1.24 0.99 3.38 -1.48 -3.05 115.31 113.50 1ybj h LEU 117 Ca 0.00 0.08 -0.46 0.00 0.09 0.00 0.00 57.88 57.59 1ybj h LEU 117 Cb 0.00 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1ybj h LEU 117 CO 0.00 -0.18 -0.78 -3.20 0.09 0.00 0.00 178.44 174.37 1ybj n ASN 118 N -5.28 -3.64 -4.55 -0.43 5.15 -0.67 -4.95 115.26 100.88 1ybj n ASN 118 Ca -0.04 -0.79 -0.34 0.00 -0.60 0.00 0.00 54.58 52.81 1ybj n ASN 118 Cb 0.20 -3.92 -0.11 0.00 -0.53 0.00 0.00 39.78 35.41 1ybj n ASN 118 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 1ybj s LEU 119 N -7.10 3.53 -0.01 1.20 0.05 -0.91 -4.96 118.68 110.48 1ybj s LEU 119 Ca 0.45 -0.04 0.03 0.00 0.05 0.00 0.00 54.13 54.62 1ybj s LEU 119 Cb -0.23 -1.88 -0.01 0.00 -2.05 0.00 0.00 46.19 42.03 1ybj s LEU 119 CO 0.83 0.15 -0.11 -0.94 -0.55 0.00 0.00 176.35 175.72 1ybj s SER 120 N 0.51 1.35 0.11 1.48 1.04 -1.26 -0.38 113.70 116.55 1ybj s SER 120 Ca 0.00 -0.21 -0.01 0.00 0.48 0.00 0.00 55.95 56.22 1ybj s SER 120 Cb -0.13 -0.20 -0.04 0.00 0.10 0.00 0.00 66.02 65.74 1ybj s SER 120 CO 0.02 0.13 0.28 -0.94 0.98 0.00 0.00 173.24 173.71 1ybj s SER 121 N -0.17 6.39 0.72 7.02 1.04 0.11 -4.97 113.70 123.84 1ybj s SER 121 Ca 0.03 0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.69 1ybj s SER 121 Cb -0.05 -1.99 0.02 0.00 0.10 0.00 0.00 66.02 64.10 1ybj s SER 121 CO -0.00 0.09 1.08 -0.76 0.98 0.00 0.00 173.24 174.63 1ybj s LEU 122 N -2.78 2.91 0.16 2.42 1.43 -1.26 -4.50 118.68 117.06 1ybj s LEU 122 Ca 0.37 1.32 -0.25 0.00 -1.03 0.00 0.00 54.13 54.54 1ybj s LEU 122 Cb -0.12 -4.13 0.02 0.00 0.03 0.00 0.00 46.19 41.99 1ybj s LEU 122 CO 0.27 -1.46 1.59 -0.61 0.23 0.00 0.00 176.35 176.37 1ybj h GLN 123 N -0.73 -0.30 -0.21 1.70 5.75 -1.98 -2.14 115.11 117.19 1ybj h GLN 123 Ca -0.45 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 1ybj h GLN 123 Cb 1.24 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.86 1ybj h GLN 123 CO 0.61 -0.20 0.00 0.00 -2.65 0.00 0.00 178.83 176.59 1ybj n ALA 124 N -3.01 2.51 -1.02 3.38 0.00 -1.26 -4.40 120.51 116.72 1ybj n ALA 124 Ca -0.00 -0.19 -0.23 0.00 0.00 0.00 0.00 53.44 53.02 1ybj n ALA 124 Cb 0.35 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.72 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 2.55 -1.78 0.00 1.13 -0.81 -4.83 117.38 113.48 1ybj n GLN 125 Ca 0.03 -1.47 -0.40 0.00 -1.94 0.00 0.00 57.00 53.22 1ybj n GLN 125 Cb 0.12 -2.35 -0.03 0.00 0.11 0.00 0.00 30.24 28.10 1ybj n GLN 125 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1ybj s GLY 126 N 2.35 0.19 0.00 1.08 0.00 -1.26 -1.22 107.32 108.45 1ybj s GLY 126 Ca 0.60 0.07 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1ybj s GLY 126 CO -0.03 3.70 0.00 1.57 0.00 0.00 0.00 173.10 178.34 1ybj n HIS 127 N 13.02 0.00 0.13 1.90 -0.00 -1.26 -4.59 115.22 124.42 1ybj n HIS 127 Ca 0.28 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 58.06 1ybj n HIS 127 Cb 0.50 -0.05 0.03 0.00 -0.00 0.00 0.00 29.99 30.48 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 -2.44 0.26 3.58 -1.91 -3.36 116.42 112.56 1ybj h ASP 128 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 1ybj h ASP 128 Cb 0.00 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.08 1ybj h ASP 128 CO 0.00 0.32 1.18 -0.83 -2.88 0.00 0.00 179.24 177.04 1ybj s GLY 129 N -4.45 1.40 0.46 -0.78 0.00 -0.36 -4.85 107.32 98.74 1ybj s GLY 129 Ca 0.03 1.38 0.22 0.00 0.00 0.00 0.00 44.72 46.35 1ybj s GLY 129 CO 0.75 3.34 1.86 -0.39 0.00 0.00 0.00 173.10 178.66 1ybj h VAL 130 N 5.25 0.63 -0.36 1.40 -1.51 -1.89 0.15 116.25 119.91 1ybj h VAL 130 Ca -0.48 -0.09 -0.04 0.00 -1.23 0.00 0.00 66.70 64.86 1ybj h VAL 130 Cb 1.23 0.34 -0.01 0.00 -2.13 0.00 0.00 31.29 30.71 1ybj h VAL 130 CO 0.94 0.05 0.08 -0.37 -1.23 0.00 0.00 177.57 177.04 1ybj h VAL 131 N 0.26 1.23 -0.94 7.19 -1.51 -1.89 0.88 116.25 121.48 1ybj h VAL 131 Ca 0.46 -0.79 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 1ybj h VAL 131 Cb 1.37 1.06 -0.05 0.00 -2.13 0.00 0.00 31.29 31.54 1ybj h VAL 131 CO -0.13 0.27 0.60 -0.74 -1.23 0.00 0.00 177.57 176.34 1ybj h HIS 132 N 0.43 1.21 0.63 5.19 6.17 -0.97 -1.20 115.15 126.61 1ybj h HIS 132 Ca 0.11 0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.18 1ybj h HIS 132 Cb 0.33 -0.40 0.00 0.00 2.52 0.00 0.00 27.41 29.85 1ybj h HIS 132 CO 0.02 0.78 -0.33 1.96 0.71 0.00 0.00 177.93 181.07 1ybj h GLN 133 N 1.29 -0.85 -0.96 5.26 4.20 -0.77 -2.19 115.11 121.09 1ybj h GLN 133 Ca 0.34 0.06 0.01 0.00 0.06 0.00 0.00 58.65 59.12 1ybj h GLN 133 Cb -0.11 0.19 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 1ybj h GLN 133 CO -0.07 -0.57 0.64 -0.39 -0.67 0.00 0.00 178.83 177.77 1ybj h VAL 134 N -0.88 1.25 -0.20 -0.54 -1.51 -0.80 -0.35 116.25 113.22 1ybj h VAL 134 Ca -0.09 -0.45 -0.07 0.00 -1.23 0.00 0.00 66.70 64.87 1ybj h VAL 134 Cb 0.69 -0.17 -0.00 0.00 -2.13 0.00 0.00 31.29 29.68 1ybj h VAL 134 CO 0.12 0.24 -0.14 1.62 -1.23 0.00 0.00 177.57 178.18 1ybj h VAL 135 N 1.30 1.32 0.00 7.19 3.04 -1.24 0.19 116.25 128.05 1ybj h VAL 135 Ca 0.35 -1.24 -0.03 0.00 -1.01 0.00 0.00 66.70 64.76 1ybj h VAL 135 Cb -0.15 1.70 -0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1ybj h VAL 135 CO -0.08 0.38 -0.16 1.88 -1.01 0.00 0.00 177.57 178.58 1ybj h TYR 136 N 0.13 0.00 0.32 3.17 -1.99 -1.29 0.14 116.97 117.45 1ybj h TYR 136 Ca 0.04 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1ybj h TYR 136 Cb 0.65 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.38 1ybj h TYR 136 CO 0.07 0.16 -0.15 0.78 -0.00 0.00 0.00 178.16 179.01 1ybj h GLY 137 N 2.43 -0.45 -0.20 3.88 0.00 -0.81 -2.66 103.07 105.25 1ybj h GLY 137 Ca -0.00 0.17 0.10 0.00 0.00 0.00 0.00 47.33 47.60 1ybj h GLY 137 CO 0.02 -0.16 -0.24 1.41 0.00 0.00 0.00 176.54 177.57 1ybj h LEU 138 N -0.78 -0.82 -1.64 3.11 -0.00 -0.12 0.64 115.31 115.71 1ybj h LEU 138 Ca -0.04 0.19 0.14 0.00 -0.00 0.00 0.00 57.88 58.17 1ybj h LEU 138 Cb 0.51 0.44 -0.04 0.00 -0.00 0.00 0.00 40.66 41.57 1ybj h LEU 138 CO 0.07 -0.26 0.48 0.24 -0.00 0.00 0.00 178.44 178.97 1ybj h MET 139 N -0.12 0.35 0.00 1.13 2.86 -0.79 -0.72 114.93 117.65 1ybj h MET 139 Ca 0.24 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1ybj h MET 139 Cb 0.49 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1ybj h MET 139 CO -0.59 0.23 -0.75 1.03 1.06 0.00 0.00 176.91 177.90 1ybj h SER 140 N 0.36 0.00 0.00 1.22 0.87 -0.57 -3.47 113.55 111.96 1ybj h SER 140 Ca 0.34 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1ybj h SER 140 Cb 0.83 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1ybj h SER 140 CO -0.10 0.11 0.00 0.61 -0.53 0.00 0.00 176.83 176.92 1ybj n GLY 141 N 1.32 0.93 3.65 5.77 0.00 0.09 -5.02 105.19 111.93 1ybj n GLY 141 Ca 0.03 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.08 5.91 0.00 1.61 -1.08 0.20 -4.77 116.67 116.46 1ybj s ASP 142 Ca 0.00 0.10 0.06 0.00 -0.52 0.00 0.00 52.55 52.19 1ybj s ASP 142 Cb 0.00 -2.04 0.12 0.00 -1.46 0.00 0.00 42.92 39.54 1ybj s ASP 142 CO 0.00 0.11 0.95 0.35 0.52 0.00 0.00 175.17 177.10 1ybj n THR 143 N 3.96 0.55 0.25 1.71 -2.24 -1.26 -2.41 114.28 114.83 1ybj n THR 143 Ca -0.16 -0.77 0.14 0.00 -2.27 0.00 0.00 64.05 60.99 1ybj n THR 143 Cb 0.52 0.79 0.51 0.00 -2.10 0.00 0.00 70.33 70.04 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 1.22 0.00 1.20 3.38 0.00 -1.95 -1.39 103.07 105.52 1ybj h GLY 144 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 1ybj h GLY 144 CO 0.00 0.00 -1.56 0.00 0.00 0.00 0.00 176.54 174.98 1ybj h ALA 145 N 1.94 0.32 -0.45 3.60 0.00 -1.92 -3.33 119.26 119.41 1ybj h ALA 145 Ca -0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 54.91 53.64 1ybj h ALA 145 Cb 0.70 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1ybj h ALA 145 CO 0.01 1.19 -0.18 1.25 0.00 0.00 0.00 179.25 181.51 1ybj h LEU 146 N 0.06 0.94 -1.55 0.00 5.85 -1.75 -2.28 115.31 116.58 1ybj h LEU 146 Ca -0.25 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.17 1ybj h LEU 146 Cb 2.01 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.74 1ybj h LEU 146 CO 0.15 1.12 0.42 1.05 -0.34 0.00 0.00 178.44 180.85 1ybj h GLU 147 N 0.76 0.50 -0.02 1.25 4.11 -1.43 0.23 114.58 119.98 1ybj h GLU 147 Ca 0.11 -0.03 -0.21 0.00 0.07 0.00 0.00 59.36 59.29 1ybj h GLU 147 Cb 0.75 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 1ybj h GLU 147 CO 0.06 0.33 -0.87 0.00 0.07 0.00 0.00 179.01 178.60 1ybj h THR 148 N 0.52 1.40 -0.21 -1.06 1.03 -1.57 -1.44 112.91 111.59 1ybj h THR 148 Ca 0.29 -2.36 -0.04 0.00 -0.01 0.00 0.00 66.41 64.28 1ybj h THR 148 Cb 0.46 2.33 -0.01 0.00 -1.07 0.00 0.00 68.15 69.86 1ybj h THR 148 CO -0.09 0.71 -0.04 0.00 -0.01 0.00 0.00 175.52 176.09 1ybj h ALA 149 N 0.81 0.28 -0.86 0.00 0.00 -0.74 -3.14 119.26 115.62 1ybj h ALA 149 Ca -0.06 -0.25 0.10 0.00 0.00 0.00 0.00 54.91 54.70 1ybj h ALA 149 Cb 1.49 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.13 1ybj h ALA 149 CO 0.15 0.05 0.51 -0.07 0.00 0.00 0.00 179.25 179.89 1ybj h LEU 150 N 0.12 0.73 -0.83 0.00 3.38 -0.49 -0.52 115.31 117.71 1ybj h LEU 150 Ca 0.05 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ybj h LEU 150 Cb 0.48 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1ybj h LEU 150 CO 0.02 0.42 0.26 0.59 0.09 0.00 0.00 178.44 179.82 1ybj n ASN 151 N -4.71 0.32 -0.04 -0.43 3.02 -0.55 -1.93 115.26 110.95 1ybj n ASN 151 Ca 0.14 0.55 -0.16 0.00 -0.03 0.00 0.00 54.58 55.09 1ybj n ASN 151 Cb 0.28 -0.51 -0.08 0.00 -0.61 0.00 0.00 39.78 38.86 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 0.58 0.78 7.41 0.00 -1.19 -1.03 103.07 109.62 1ybj h GLY 152 Ca 0.00 -0.78 -0.22 0.00 0.00 0.00 0.00 47.33 46.34 1ybj h GLY 152 CO 0.00 0.69 -0.95 -2.22 0.00 0.00 0.00 176.54 174.06 1ybj h ILE 153 N 0.14 1.46 -0.56 2.60 5.03 -1.56 -3.34 117.51 121.27 1ybj h ILE 153 Ca -0.02 -2.56 0.02 0.00 -0.12 0.00 0.00 64.86 62.17 1ybj h ILE 153 Cb 1.09 3.16 -0.03 0.00 -3.03 0.00 0.00 36.82 38.01 1ybj h ILE 153 CO 0.10 0.73 0.35 -0.07 -0.68 0.00 0.00 178.15 178.58 1ybj h LEU 154 N -0.28 0.59 -2.27 1.44 -0.00 -1.57 -2.31 115.31 110.90 1ybj h LEU 154 Ca -0.17 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.70 1ybj h LEU 154 Cb 1.74 -0.13 -0.00 0.00 -0.00 0.00 0.00 40.66 42.26 1ybj h LEU 154 CO 0.17 0.42 -0.04 -0.78 -0.00 0.00 0.00 178.44 178.21 1ybj h ASP 155 N 0.71 0.00 0.21 -0.43 3.58 -1.16 0.54 116.42 119.87 1ybj h ASP 155 Ca 0.22 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.63 1ybj h ASP 155 Cb -0.02 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 1ybj h ASP 155 CO -0.08 0.04 -0.19 -0.78 -2.88 0.00 0.00 179.24 175.34 1ybj h ASP 156 N 0.00 0.00 0.00 2.28 3.58 -1.53 -1.87 116.42 118.89 1ybj h ASP 156 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1ybj h ASP 156 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1ybj h ASP 156 CO 0.00 0.19 -1.23 -1.22 -2.88 0.00 0.00 179.24 174.11 1ybj n TYR 157 N -4.24 0.00 -0.13 0.28 4.01 0.64 -4.98 117.16 112.74 1ybj n TYR 157 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1ybj n TYR 157 Cb 0.26 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 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 1.44 0.92 0.00 2.72 0.00 0.15 -4.97 105.19 105.45 1ybj n GLY 158 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.86 -4.88 117.00 121.96 1ybj n LEU 159 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 56.01 55.95 1ybj n LEU 159 Cb 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.33 1ybj n LEU 159 CO 0.00 -0.13 0.40 -1.54 -1.51 0.00 0.00 177.39 174.61 1ybj n SER 160 N -0.83 -1.48 0.28 -1.43 3.41 -1.26 -3.25 113.62 109.06 1ybj n SER 160 Ca 0.00 -1.98 0.18 0.00 -0.26 0.00 0.00 58.87 56.81 1ybj n SER 160 Cb 0.00 2.45 0.97 0.00 -0.26 0.00 0.00 64.21 67.37 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 1.67 0.28 -0.27 -3.33 3.04 -1.89 -1.36 116.25 114.40 1ybj h VAL 161 Ca -0.22 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 1ybj h VAL 161 Cb 0.83 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 1ybj h VAL 161 CO 0.28 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.43 1ybj n ASN 162 N -3.48 2.88 -4.80 3.17 3.02 -1.26 -0.81 115.26 113.99 1ybj n ASN 162 Ca -0.01 -2.35 -0.37 0.00 -0.03 0.00 0.00 54.58 51.82 1ybj n ASN 162 Cb 0.20 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 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 -0.45 7.21 0.29 6.41 0.15 -0.51 -4.69 113.70 122.12 1ybj s SER 163 Ca 0.24 1.59 -0.29 0.00 0.70 0.00 0.00 55.95 58.19 1ybj s SER 163 Cb 0.17 -2.48 -0.09 0.00 -1.71 0.00 0.00 66.02 61.91 1ybj s SER 163 CO 0.08 0.05 1.07 -0.89 1.20 0.00 0.00 173.24 174.75 1ybj s THR 164 N -1.46 3.61 0.28 6.45 2.01 -1.25 -1.70 115.64 123.58 1ybj s THR 164 Ca 0.43 1.56 -0.08 0.00 0.31 0.00 0.00 61.69 63.91 1ybj s THR 164 Cb -0.19 -3.96 0.46 0.00 0.01 0.00 0.00 72.50 68.81 1ybj s THR 164 CO 0.23 0.32 1.55 0.49 -0.69 0.00 0.00 174.62 176.51 1ybj n PHE 165 N 1.02 0.36 -0.16 4.92 3.72 0.24 0.19 117.46 127.75 1ybj n PHE 165 Ca -0.00 1.21 -0.07 0.00 -0.05 0.00 0.00 57.45 58.53 1ybj n PHE 165 Cb 0.46 -1.08 0.08 0.00 -0.94 0.00 0.00 39.48 38.00 1ybj n PHE 165 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1ybj h ASP 166 N 0.00 0.92 -0.04 4.37 2.03 -1.86 -1.52 116.42 120.32 1ybj h ASP 166 Ca 0.48 -0.26 -0.23 0.00 -0.73 0.00 0.00 57.03 56.29 1ybj h ASP 166 Cb 0.73 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 38.99 1ybj h ASP 166 CO -1.02 1.00 -0.83 1.56 -1.03 0.00 0.00 179.24 178.92 1ybj h GLN 167 N 0.85 0.70 0.21 4.15 4.20 -0.63 -0.92 115.11 123.68 1ybj h GLN 167 Ca 0.15 -0.61 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 1ybj h GLN 167 Cb 0.56 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.48 1ybj h GLN 167 CO 0.03 1.22 -0.10 0.28 -0.67 0.00 0.00 178.83 179.59 1ybj h VAL 168 N 0.46 0.83 -0.55 -0.54 2.07 -0.36 0.20 116.25 118.35 1ybj h VAL 168 Ca -0.06 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.30 1ybj h VAL 168 Cb 1.45 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 1ybj h VAL 168 CO 0.16 0.05 0.28 0.00 0.02 0.00 0.00 177.57 178.08 1ybj h ALA 169 N 0.38 0.72 -0.34 1.67 0.00 -1.29 0.96 119.26 121.35 1ybj h ALA 169 Ca -0.03 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1ybj h ALA 169 Cb 0.30 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1ybj h ALA 169 CO 0.05 -0.07 -0.11 0.00 0.00 0.00 0.00 179.25 179.11 1ybj h ALA 170 N 1.31 1.16 0.00 0.00 0.00 -1.05 0.51 119.26 121.20 1ybj h ALA 170 Ca 0.25 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1ybj h ALA 170 Cb 0.17 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ybj h ALA 170 CO -0.18 0.53 -0.59 0.00 0.00 0.00 0.00 179.25 179.01 1ybj h ALA 171 N 1.34 0.83 0.00 0.00 0.00 0.34 -2.54 119.26 119.22 1ybj h ALA 171 Ca 0.10 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1ybj h ALA 171 Cb 0.52 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ybj h ALA 171 CO 0.03 0.74 -0.64 0.25 0.00 0.00 0.00 179.25 179.63 1ybj n THR 172 N -3.55 0.18 -0.04 0.00 -2.24 0.24 -1.07 114.28 107.80 1ybj n THR 172 Ca -0.00 -0.16 -0.08 0.00 -2.27 0.00 0.00 64.05 61.53 1ybj n THR 172 Cb 0.66 0.07 0.08 0.00 -2.10 0.00 0.00 70.33 69.04 1ybj n THR 172 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ybj h ALA 173 N 2.71 0.81 0.00 6.98 0.00 -0.49 -3.45 119.26 125.82 1ybj h ALA 173 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ybj h ALA 173 Cb 0.65 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ybj h ALA 173 CO 0.00 0.65 0.00 1.55 0.00 0.00 0.00 179.25 181.45 1ybj n VAL 174 N -4.05 0.00 0.00 0.00 3.14 -1.06 -5.08 118.33 111.28 1ybj n VAL 174 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 1ybj n VAL 174 Cb 0.51 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.29 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 -0.16 3.38 3.36 7.55 0.00 -0.24 -4.99 105.19 114.09 1ybj n GLY 175 Ca 0.00 -1.10 -0.16 0.00 0.00 0.00 0.00 46.02 44.76 1ybj n GLY 175 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ybj s VAL 176 N 0.00 0.00 -0.52 1.61 -7.23 -1.26 -4.85 120.40 108.15 1ybj s VAL 176 Ca 0.00 -1.82 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 1ybj s VAL 176 Cb 0.00 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.41 1ybj s VAL 176 CO 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.79 1ybj n GLN 177 N -0.53 -1.08 -0.33 4.82 1.13 -1.26 -4.86 117.38 115.27 1ybj n GLN 177 Ca 0.04 0.55 0.00 0.00 -1.94 0.00 0.00 57.00 55.65 1ybj n GLN 177 Cb 0.63 -4.51 0.00 0.00 0.11 0.00 0.00 30.24 26.47 1ybj n GLN 177 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34