#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bu9 n ALA 2 N 0.00 -2.27 0.00 -5.12 0.00 -1.26 -5.02 120.51 106.84 1bu9 n ALA 2 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 53.44 54.43 1bu9 n ALA 2 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.16 1bu9 n ALA 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bu9 n GLU 3 N 1.92 0.00 -2.00 0.00 2.13 -1.26 -5.05 120.64 116.38 1bu9 n GLU 3 Ca -0.14 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.43 1bu9 n GLU 3 Cb 0.21 0.00 0.16 0.00 0.27 0.00 0.00 31.44 32.08 1bu9 n GLU 3 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1bu9 n PRO 4 N 0.00 -0.78 0.00 5.31 -0.04 -1.26 -3.77 135.00 134.45 1bu9 n PRO 4 Ca 0.00 -2.13 0.00 0.00 -0.04 0.00 0.00 63.50 61.33 1bu9 n PRO 4 Cb 0.00 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 1bu9 n PRO 4 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1bu9 n TRP 5 N -3.35 -0.56 0.00 0.54 8.01 -1.24 -3.68 117.44 117.16 1bu9 n TRP 5 Ca 0.15 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.34 1bu9 n TRP 5 Cb 0.54 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.84 1bu9 n TRP 5 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bu9 n GLY 6 N 0.00 0.31 0.00 6.99 0.00 -1.26 -4.14 105.19 107.09 1bu9 n GLY 6 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.57 1bu9 n GLY 6 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bu9 n ASN 7 N 3.53 0.00 -0.38 1.61 5.15 -1.26 0.23 115.26 124.14 1bu9 n ASN 7 Ca 0.00 0.00 0.32 0.00 -0.60 0.00 0.00 54.58 54.30 1bu9 n ASN 7 Cb 0.00 0.00 0.59 0.00 -0.53 0.00 0.00 39.78 39.84 1bu9 n ASN 7 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1bu9 h GLU 8 N 0.00 0.11 0.29 1.20 4.22 -1.74 -1.19 114.58 117.46 1bu9 h GLU 8 Ca 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.42 1bu9 h GLU 8 Cb 0.00 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1bu9 h GLU 8 CO 0.00 0.07 -0.14 -0.07 -2.18 0.00 0.00 179.01 176.69 1bu9 h LEU 9 N 0.11 -0.32 -1.31 1.64 -0.00 -1.63 -1.93 115.31 111.87 1bu9 h LEU 9 Ca 0.81 0.01 0.01 0.00 -0.00 0.00 0.00 57.88 58.71 1bu9 h LEU 9 Cb 2.27 0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 43.01 1bu9 h LEU 9 CO -0.58 -0.23 0.58 0.00 -0.00 0.00 0.00 178.44 178.21 1bu9 h ALA 10 N -1.81 1.62 -3.00 1.53 0.00 0.40 0.74 119.26 118.74 1bu9 h ALA 10 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bu9 h ALA 10 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1bu9 h ALA 10 CO 0.06 -0.60 0.00 0.45 0.00 0.00 0.00 179.25 179.17 1bu9 n SER 11 N -2.79 0.00 -0.31 0.00 2.88 -0.70 -2.06 113.62 110.63 1bu9 n SER 11 Ca -0.00 0.15 -0.04 0.00 -1.33 0.00 0.00 58.87 57.65 1bu9 n SER 11 Cb 0.62 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.17 1bu9 n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bu9 h ALA 12 N -2.00 1.15 0.21 -1.46 0.00 -1.24 0.11 119.26 116.04 1bu9 h ALA 12 Ca 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1bu9 h ALA 12 Cb 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1bu9 h ALA 12 CO 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 179.25 179.61 1bu9 h ALA 13 N 1.26 -0.57 -0.20 0.00 0.00 0.33 0.21 119.26 120.30 1bu9 h ALA 13 Ca 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1bu9 h ALA 13 Cb 0.08 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1bu9 h ALA 13 CO -0.04 -0.86 0.00 0.00 0.00 0.00 0.00 179.25 178.35 1bu9 n ALA 14 N -2.62 2.58 0.42 0.00 0.00 -0.87 0.15 120.51 120.16 1bu9 n ALA 14 Ca -0.08 -0.41 0.06 0.00 0.00 0.00 0.00 53.44 53.01 1bu9 n ALA 14 Cb 0.32 -1.00 0.07 0.00 0.00 0.00 0.00 19.45 18.84 1bu9 n ALA 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bu9 n ARG 15 N 0.13 1.08 0.00 0.00 3.00 0.37 -4.42 116.66 116.81 1bu9 n ARG 15 Ca 0.07 -1.39 0.00 0.00 -0.00 0.00 0.00 57.85 56.53 1bu9 n ARG 15 Cb 0.26 -1.25 0.00 0.00 0.00 0.00 0.00 32.46 31.47 1bu9 n ARG 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bu9 n GLY 16 N 0.71 2.03 3.53 5.14 0.00 -0.76 -4.95 105.19 110.88 1bu9 n GLY 16 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1bu9 n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bu9 n ASP 17 N 0.00 1.13 -0.03 1.61 9.92 0.59 -4.77 116.55 125.00 1bu9 n ASP 17 Ca 0.00 -0.32 -0.14 0.00 -0.53 0.00 0.00 54.79 53.80 1bu9 n ASP 17 Cb 0.00 -1.24 -0.10 0.00 -0.64 0.00 0.00 41.12 39.15 1bu9 n ASP 17 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1bu9 h LEU 18 N 16.10 0.18 0.18 0.64 6.46 -1.93 -2.99 115.31 133.96 1bu9 h LEU 18 Ca -0.12 -0.63 -0.01 0.00 -0.12 0.00 0.00 57.88 57.01 1bu9 h LEU 18 Cb 1.25 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 41.13 1bu9 h LEU 18 CO 1.28 0.77 -0.09 -0.08 -0.62 0.00 0.00 178.44 179.71 1bu9 h GLU 19 N -0.40 -0.23 -0.90 1.25 4.57 -1.97 -2.85 114.58 114.04 1bu9 h GLU 19 Ca -0.01 0.02 0.23 0.00 -1.18 0.00 0.00 59.36 58.42 1bu9 h GLU 19 Cb 0.76 0.05 -0.16 0.00 -0.16 0.00 0.00 28.75 29.24 1bu9 h GLU 19 CO 0.03 0.18 0.03 0.37 -1.18 0.00 0.00 179.01 178.44 1bu9 h GLN 20 N -0.81 0.06 -0.84 1.92 5.75 -1.96 1.99 115.11 121.22 1bu9 h GLN 20 Ca -0.02 -0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.51 1bu9 h GLN 20 Cb 0.52 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.01 1bu9 h GLN 20 CO 0.04 0.04 0.55 1.25 -2.65 0.00 0.00 178.83 178.07 1bu9 h LEU 21 N 0.07 0.89 0.13 -2.39 5.85 -1.53 -2.21 115.31 116.12 1bu9 h LEU 21 Ca 0.53 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 59.23 1bu9 h LEU 21 Cb 1.02 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1bu9 h LEU 21 CO -0.81 0.60 -0.06 0.74 -0.34 0.00 0.00 178.44 178.57 1bu9 h THR 22 N 1.02 0.00 -0.74 1.05 2.02 0.33 -2.99 112.91 113.61 1bu9 h THR 22 Ca 0.34 -0.20 0.07 0.00 0.77 0.00 0.00 66.41 67.39 1bu9 h THR 22 Cb 0.06 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.38 1bu9 h THR 22 CO -0.10 0.00 -0.44 -1.20 0.37 0.00 0.00 175.52 174.15 1bu9 n SER 23 N -3.02 -0.78 -0.26 4.18 7.64 0.54 -0.16 113.62 121.76 1bu9 n SER 23 Ca -0.02 1.56 0.03 0.00 1.01 0.00 0.00 58.87 61.44 1bu9 n SER 23 Cb 0.07 -0.29 0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1bu9 n SER 23 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1bu9 h LEU 24 N 0.00 -0.62 -2.61 -3.43 4.07 -1.54 1.59 115.31 112.76 1bu9 h LEU 24 Ca 0.12 0.22 0.01 0.00 0.08 0.00 0.00 57.88 58.31 1bu9 h LEU 24 Cb 0.30 0.44 -0.00 0.00 1.08 0.00 0.00 40.66 42.48 1bu9 h LEU 24 CO -0.69 -0.24 0.09 0.25 -1.08 0.00 0.00 178.44 176.77 1bu9 h LEU 25 N 0.02 0.00 -1.52 1.67 5.85 -0.39 0.53 115.31 121.47 1bu9 h LEU 25 Ca 0.38 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.10 1bu9 h LEU 25 Cb 0.60 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1bu9 h LEU 25 CO -0.76 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.34 1bu9 n GLN 26 N -3.28 2.00 0.00 1.25 1.13 0.54 -4.38 117.38 114.64 1bu9 n GLN 26 Ca -0.02 -1.50 0.00 0.00 -1.94 0.00 0.00 57.00 53.54 1bu9 n GLN 26 Cb 0.17 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.08 1bu9 n GLN 26 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1bu9 n ASN 27 N 0.74 1.93 0.00 1.08 3.02 0.15 -5.07 115.26 117.11 1bu9 n ASN 27 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1bu9 n ASN 27 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1bu9 n ASN 27 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1bu9 n ASN 28 N -2.56 0.00 -3.57 6.41 0.23 0.72 -4.92 115.26 111.57 1bu9 n ASN 28 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.58 54.04 1bu9 n ASN 28 Cb 0.41 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.07 1bu9 n ASN 28 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1bu9 s VAL 29 N 0.00 -0.98 -0.92 3.53 -7.23 -1.25 -4.29 120.40 109.26 1bu9 s VAL 29 Ca 0.00 0.01 -0.25 0.00 -1.81 0.00 0.00 61.98 59.93 1bu9 s VAL 29 Cb 0.00 -0.98 -0.07 0.00 0.56 0.00 0.00 36.38 35.89 1bu9 s VAL 29 CO 0.00 0.00 2.01 0.20 -0.31 0.00 0.00 175.10 177.01 1bu9 s ASN 30 N 2.87 4.91 0.50 4.85 -0.87 -1.26 -4.65 114.94 121.29 1bu9 s ASN 30 Ca -0.02 -0.70 0.38 0.00 -1.57 0.00 0.00 52.86 50.96 1bu9 s ASN 30 Cb -0.12 -2.56 1.31 0.00 -0.02 0.00 0.00 41.25 39.85 1bu9 s ASN 30 CO -0.19 -2.99 1.29 0.55 -2.57 0.00 0.00 177.10 173.19 1bu9 n VAL 31 N 8.03 0.00 -0.85 1.60 3.14 -1.26 0.31 118.33 129.29 1bu9 n VAL 31 Ca 0.42 1.24 0.08 0.00 -2.96 0.00 0.00 64.34 63.12 1bu9 n VAL 31 Cb 0.46 -2.11 0.19 0.00 -1.06 0.00 0.00 33.84 31.33 1bu9 n VAL 31 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1bu9 n ASN 32 N -3.47 3.19 -3.03 6.55 5.03 -1.26 -4.84 115.26 117.43 1bu9 n ASN 32 Ca 0.34 -2.85 0.00 0.00 0.87 0.00 0.00 54.58 52.94 1bu9 n ASN 32 Cb 1.64 -0.44 0.00 0.00 -1.02 0.00 0.00 39.78 39.97 1bu9 n ASN 32 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bu9 n ALA 33 N -0.66 0.00 -3.31 5.41 0.00 0.91 -5.00 120.51 117.87 1bu9 n ALA 33 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.64 1bu9 n ALA 33 Cb 0.72 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.13 1bu9 n ALA 33 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1bu9 s GLN 34 N -1.67 0.17 0.80 0.00 -0.21 -1.26 -4.56 119.66 112.93 1bu9 s GLN 34 Ca 0.00 0.41 -0.12 0.00 0.02 0.00 0.00 55.36 55.68 1bu9 s GLN 34 Cb 0.00 0.24 0.18 0.00 1.00 0.00 0.00 33.01 34.43 1bu9 s GLN 34 CO 0.00 -0.06 1.09 -1.71 -2.12 0.00 0.00 175.29 172.49 1bu9 n ASN 35 N 4.72 0.30 0.18 5.90 5.15 -1.19 -4.71 115.26 125.60 1bu9 n ASN 35 Ca -0.08 -1.53 0.11 0.00 -0.60 0.00 0.00 54.58 52.48 1bu9 n ASN 35 Cb 0.54 -0.81 0.58 0.00 -0.53 0.00 0.00 39.78 39.55 1bu9 n ASN 35 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1bu9 h GLY 36 N -1.31 0.00 0.97 8.20 0.00 -1.95 0.59 103.07 109.58 1bu9 h GLY 36 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1bu9 h GLY 36 CO 0.27 0.00 -0.02 0.33 0.00 0.00 0.00 176.54 177.12 1bu9 n PHE 37 N -2.27 0.00 -2.05 5.60 -0.00 -1.26 -4.83 117.46 112.65 1bu9 n PHE 37 Ca -0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.23 1bu9 n PHE 37 Cb 0.12 -0.09 -0.05 0.00 -0.00 0.00 0.00 39.48 39.46 1bu9 n PHE 37 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1bu9 n GLY 38 N 1.12 0.60 3.19 7.13 0.00 0.21 -3.88 105.19 113.56 1bu9 n GLY 38 Ca 0.20 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1bu9 n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bu9 s ARG 39 N -4.48 3.10 0.18 1.61 1.81 -1.25 -3.96 118.95 115.95 1bu9 s ARG 39 Ca 0.00 -0.79 -0.19 0.00 -1.72 0.00 0.00 55.73 53.02 1bu9 s ARG 39 Cb 0.00 -2.60 -0.08 0.00 -0.45 0.00 0.00 34.95 31.83 1bu9 s ARG 39 CO 0.00 -0.10 0.68 0.99 -0.68 0.00 0.00 175.30 176.19 1bu9 s THR 40 N 1.06 4.62 0.58 0.02 2.01 -1.26 -3.18 115.64 119.48 1bu9 s THR 40 Ca -0.01 1.24 0.39 0.00 0.31 0.00 0.00 61.69 63.62 1bu9 s THR 40 Cb -0.14 -3.88 0.57 0.00 0.01 0.00 0.00 72.50 69.06 1bu9 s THR 40 CO -0.06 0.30 1.55 0.00 -0.69 0.00 0.00 174.62 175.72 1bu9 h ALA 41 N 3.70 3.32 0.00 7.40 0.00 -1.88 3.59 119.26 135.39 1bu9 h ALA 41 Ca -0.48 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1bu9 h ALA 41 Cb 1.20 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1bu9 h ALA 41 CO 0.65 -1.92 0.00 1.25 0.00 0.00 0.00 179.25 179.23 1bu9 h LEU 42 N 0.00 0.00 0.00 0.00 5.85 -1.93 2.45 115.31 121.67 1bu9 h LEU 42 Ca 0.67 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 59.11 1bu9 h LEU 42 Cb 3.04 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 44.03 1bu9 h LEU 42 CO -0.01 0.00 -1.54 0.00 -0.34 0.00 0.00 178.44 176.55 1bu9 n GLN 43 N -2.97 0.57 0.17 1.25 3.00 1.19 -4.38 117.38 116.21 1bu9 n GLN 43 Ca -0.01 0.51 0.11 0.00 -0.01 0.00 0.00 57.00 57.60 1bu9 n GLN 43 Cb 0.16 -1.69 0.10 0.00 0.00 0.00 0.00 30.24 28.81 1bu9 n GLN 43 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.06 176.67 1bu9 h VAL 44 N -1.00 0.05 -0.21 5.09 -1.51 -1.25 -3.44 116.25 113.98 1bu9 h VAL 44 Ca -0.43 -1.08 -0.31 0.00 -1.23 0.00 0.00 66.70 63.65 1bu9 h VAL 44 Cb 1.37 1.86 -0.00 0.00 -2.13 0.00 0.00 31.29 32.39 1bu9 h VAL 44 CO -0.26 0.03 0.36 1.15 -1.23 0.00 0.00 177.57 177.62 1bu9 n MET 45 N -2.97 0.00 -1.49 5.19 0.00 0.82 -3.94 117.12 114.74 1bu9 n MET 45 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.45 1bu9 n MET 45 Cb 0.55 -0.56 -0.20 0.00 0.00 0.00 0.00 33.22 33.01 1bu9 n MET 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1bu9 n LYS 46 N 2.06 0.00 0.28 3.17 3.00 0.39 -4.61 118.16 122.46 1bu9 n LYS 46 Ca 0.15 0.00 0.13 0.00 -0.00 0.00 0.00 58.31 58.60 1bu9 n LYS 46 Cb -0.02 -1.14 0.71 0.00 0.00 0.00 0.00 35.03 34.58 1bu9 n LYS 46 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1bu9 h LEU 47 N 11.21 0.00 -0.70 3.14 -0.00 -1.88 -1.46 115.31 125.62 1bu9 h LEU 47 Ca 0.01 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 57.96 1bu9 h LEU 47 Cb 1.18 0.00 -0.09 0.00 -0.00 0.00 0.00 40.66 41.74 1bu9 h LEU 47 CO 1.54 0.00 -0.51 1.23 -0.00 0.00 0.00 178.44 180.71 1bu9 h GLY 48 N 0.00 -1.10 -5.17 0.83 0.00 -1.96 -3.27 103.07 92.40 1bu9 h GLY 48 Ca 0.00 0.81 -0.59 0.00 0.00 0.00 0.00 47.33 47.55 1bu9 h GLY 48 CO 0.00 -0.12 -0.15 0.54 0.00 0.00 0.00 176.54 176.81 1bu9 s ASN 49 N -5.04 6.79 0.08 0.19 2.20 -0.55 -4.91 114.94 113.70 1bu9 s ASN 49 Ca -0.11 0.94 0.24 0.00 -0.94 0.00 0.00 52.86 52.99 1bu9 s ASN 49 Cb 0.09 -2.28 0.22 0.00 -2.00 0.00 0.00 41.25 37.28 1bu9 s ASN 49 CO 0.54 0.18 1.20 -0.81 -2.94 0.00 0.00 177.10 175.26 1bu9 n PRO 50 N 2.62 0.27 0.21 3.55 -0.04 -1.24 -3.38 135.00 137.00 1bu9 n PRO 50 Ca -0.10 0.04 0.09 0.00 -0.04 0.00 0.00 63.50 63.49 1bu9 n PRO 50 Cb 0.52 -1.63 0.41 0.00 -0.04 0.00 0.00 33.50 32.75 1bu9 n PRO 50 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1bu9 h GLU 51 N 0.00 0.00 -0.52 0.54 4.11 -1.91 -2.86 114.58 113.95 1bu9 h GLU 51 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.48 1bu9 h GLU 51 Cb 0.72 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.89 1bu9 h GLU 51 CO 0.00 0.25 -0.48 0.82 0.07 0.00 0.00 179.01 179.67 1bu9 h ILE 52 N 0.00 0.00 -0.04 -1.06 1.08 -1.85 0.45 117.51 116.09 1bu9 h ILE 52 Ca -0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1bu9 h ILE 52 Cb 0.81 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.56 1bu9 h ILE 52 CO 0.03 0.00 0.02 0.00 -0.69 0.00 0.00 178.15 177.51 1bu9 h ALA 53 N -0.07 0.05 -0.85 1.87 0.00 -1.78 -3.03 119.26 115.44 1bu9 h ALA 53 Ca 0.09 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1bu9 h ALA 53 Cb 0.45 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 1bu9 h ALA 53 CO -0.60 -0.38 -0.50 -2.13 0.00 0.00 0.00 179.25 175.64 1bu9 n ARG 54 N -4.99 -0.37 -0.32 0.00 0.63 0.08 0.28 116.66 111.97 1bu9 n ARG 54 Ca -0.07 1.31 0.18 0.00 -0.92 0.00 0.00 57.85 58.35 1bu9 n ARG 54 Cb 0.10 -1.92 0.37 0.00 0.45 0.00 0.00 32.46 31.46 1bu9 n ARG 54 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1bu9 h ARG 55 N 0.00 0.33 0.04 -0.14 9.65 -0.09 1.46 114.38 125.63 1bu9 h ARG 55 Ca 0.14 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1bu9 h ARG 55 Cb 0.35 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 1bu9 h ARG 55 CO -0.80 0.22 -0.02 -0.07 2.80 0.00 0.00 179.97 182.10 1bu9 h LEU 56 N 0.34 -0.05 -1.00 3.80 3.38 0.38 -3.33 115.31 118.84 1bu9 h LEU 56 Ca 0.63 0.00 0.35 0.00 0.09 0.00 0.00 57.88 58.95 1bu9 h LEU 56 Cb 1.32 0.01 -0.16 0.00 0.09 0.00 0.00 40.66 41.92 1bu9 h LEU 56 CO -0.59 0.23 0.53 0.25 0.09 0.00 0.00 178.44 178.96 1bu9 h LEU 57 N -0.58 0.42 -0.43 1.67 7.12 0.45 0.20 115.31 124.15 1bu9 h LEU 57 Ca -0.01 0.21 0.08 0.00 0.13 0.00 0.00 57.88 58.30 1bu9 h LEU 57 Cb 0.04 0.19 -0.08 0.00 -0.53 0.00 0.00 40.66 40.29 1bu9 h LEU 57 CO 0.01 -0.23 -0.05 -0.07 -0.13 0.00 0.00 178.44 177.97 1bu9 h LEU 58 N 0.22 -0.28 -0.80 2.25 -0.00 0.19 -0.42 115.31 116.47 1bu9 h LEU 58 Ca 0.76 0.12 0.01 0.00 -0.00 0.00 0.00 57.88 58.77 1bu9 h LEU 58 Cb 1.81 0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 42.65 1bu9 h LEU 58 CO -0.66 -0.10 0.52 -0.09 -0.00 0.00 0.00 178.44 178.11 1bu9 h ARG 59 N 0.06 1.03 0.00 1.13 9.65 -0.72 -3.44 114.38 122.09 1bu9 h ARG 59 Ca 0.21 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1bu9 h ARG 59 Cb 0.32 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 1bu9 h ARG 59 CO -0.40 0.68 0.00 0.41 2.80 0.00 0.00 179.97 183.46 1bu9 n GLY 60 N -1.32 0.00 3.75 2.80 0.00 -0.20 -5.14 105.19 105.08 1bu9 n GLY 60 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1bu9 n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bu9 s ALA 61 N 0.00 3.33 -0.24 4.61 0.00 -1.00 -4.93 121.76 123.53 1bu9 s ALA 61 Ca 0.00 0.65 -0.18 0.00 0.00 0.00 0.00 51.96 52.43 1bu9 s ALA 61 Cb 0.00 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 1bu9 s ALA 61 CO 0.00 0.13 0.50 -0.80 0.00 0.00 0.00 175.76 175.59 1bu9 s ASN 62 N -0.97 6.45 0.65 0.00 0.01 -1.26 -4.62 114.94 115.20 1bu9 s ASN 62 Ca 0.42 0.54 0.44 0.00 -0.71 0.00 0.00 52.86 53.55 1bu9 s ASN 62 Cb -0.26 -2.27 2.33 0.00 0.41 0.00 0.00 41.25 41.45 1bu9 s ASN 62 CO 0.33 -0.24 2.33 1.55 -1.51 0.00 0.00 177.10 179.56 1bu9 h PRO 63 N 7.84 0.00 -0.05 -0.60 0.13 -1.83 0.13 132.00 137.61 1bu9 h PRO 63 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1bu9 h PRO 63 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1bu9 h PRO 63 CO 0.72 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 175.02 1bu9 n ASP 64 N -3.07 1.45 -4.51 1.44 -0.08 -1.26 -1.90 116.55 108.62 1bu9 n ASP 64 Ca -0.03 -1.53 -0.27 0.00 -1.51 0.00 0.00 54.79 51.46 1bu9 n ASP 64 Cb 0.09 -0.03 -0.17 0.00 2.34 0.00 0.00 41.12 43.36 1bu9 n ASP 64 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1bu9 n LEU 65 N 0.15 -0.26 -4.56 -2.67 4.77 0.03 -4.31 117.00 110.14 1bu9 n LEU 65 Ca 0.18 -0.48 -0.29 0.00 -0.03 0.00 0.00 56.01 55.39 1bu9 n LEU 65 Cb 0.33 -0.87 0.23 0.00 -2.33 0.00 0.00 43.42 40.78 1bu9 n LEU 65 CO 0.16 -1.42 0.58 -0.75 -1.33 0.00 0.00 177.39 174.62 1bu9 s LYS 66 N 7.91 -0.77 0.00 3.23 2.47 -1.26 -2.26 119.74 129.06 1bu9 s LYS 66 Ca 1.25 0.39 0.00 0.00 -1.56 0.00 0.00 55.97 56.05 1bu9 s LYS 66 Cb -0.81 -1.61 0.00 0.00 -1.46 0.00 0.00 37.83 33.95 1bu9 s LYS 66 CO 0.46 -3.51 0.00 -0.40 0.16 0.00 0.00 175.35 172.06 1bu9 n ASP 67 N -4.70 0.10 -0.24 1.43 5.68 -0.87 -4.76 116.55 113.21 1bu9 n ASP 67 Ca 0.07 -0.39 0.03 0.00 -0.50 0.00 0.00 54.79 54.00 1bu9 n ASP 67 Cb 0.57 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.68 1bu9 n ASP 67 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1bu9 h ARG 68 N 0.00 0.10 -0.99 0.11 2.43 -1.69 0.39 114.38 114.73 1bu9 h ARG 68 Ca 0.00 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 1bu9 h ARG 68 Cb 0.00 -0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.44 1bu9 h ARG 68 CO 0.00 0.07 0.19 0.25 -1.51 0.00 0.00 179.97 178.96 1bu9 n THR 69 N -5.33 1.62 -1.99 0.20 -2.24 -1.26 -4.76 114.28 100.52 1bu9 n THR 69 Ca 0.11 -0.59 -0.10 0.00 -2.27 0.00 0.00 64.05 61.21 1bu9 n THR 69 Cb 0.42 -0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 67.83 1bu9 n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bu9 n GLY 70 N 0.00 0.06 3.59 3.38 0.00 0.14 -2.08 105.19 110.28 1bu9 n GLY 70 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1bu9 n GLY 70 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bu9 s PHE 71 N -2.21 3.10 0.63 1.61 0.40 -1.25 -2.28 117.98 117.98 1bu9 s PHE 71 Ca 0.00 0.60 -0.17 0.00 -0.60 0.00 0.00 56.93 56.76 1bu9 s PHE 71 Cb 0.00 -3.46 -0.02 0.00 0.51 0.00 0.00 43.02 40.05 1bu9 s PHE 71 CO 0.00 -0.76 1.15 0.00 0.70 0.00 0.00 175.22 176.31 1bu9 s ALA 72 N 3.19 2.49 0.37 5.36 0.00 -1.23 -2.04 121.76 129.89 1bu9 s ALA 72 Ca 0.33 0.75 0.18 0.00 0.00 0.00 0.00 51.96 53.21 1bu9 s ALA 72 Cb -0.13 -3.38 1.13 0.00 0.00 0.00 0.00 23.12 20.75 1bu9 s ALA 72 CO 0.17 -1.22 1.68 0.28 0.00 0.00 0.00 175.76 176.68 1bu9 h VAL 73 N 0.43 0.33 -1.01 0.00 2.07 -0.93 3.04 116.25 120.19 1bu9 h VAL 73 Ca -0.48 -0.11 0.22 0.00 0.82 0.00 0.00 66.70 67.15 1bu9 h VAL 73 Cb 1.27 -0.02 -0.11 0.00 -1.52 0.00 0.00 31.29 30.91 1bu9 h VAL 73 CO 0.54 0.06 0.61 0.40 0.02 0.00 0.00 177.57 179.20 1bu9 h ILE 74 N 0.32 0.61 0.06 4.57 2.04 -1.75 0.48 117.51 123.84 1bu9 h ILE 74 Ca 0.71 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 66.36 1bu9 h ILE 74 Cb 1.76 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1bu9 h ILE 74 CO -0.50 0.12 -0.09 0.45 0.00 0.00 0.00 178.15 178.12 1bu9 h HIS 75 N 0.63 -0.27 -0.86 1.37 3.86 0.52 0.19 115.15 120.59 1bu9 h HIS 75 Ca 0.61 0.00 0.26 0.00 -1.16 0.00 0.00 60.37 60.08 1bu9 h HIS 75 Cb 1.12 0.11 -0.16 0.00 1.06 0.00 0.00 27.41 29.54 1bu9 h HIS 75 CO -0.00 -0.12 0.10 -0.25 0.86 0.00 0.00 177.93 178.52 1bu9 n ASP 76 N -2.92 -0.03 0.34 2.45 8.00 -0.16 0.31 116.55 124.54 1bu9 n ASP 76 Ca -0.02 1.46 -0.13 0.00 0.71 0.00 0.00 54.79 56.81 1bu9 n ASP 76 Cb 0.08 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 40.55 1bu9 n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bu9 h ALA 77 N 1.73 -1.10 0.02 2.24 0.00 0.35 -3.33 119.26 119.17 1bu9 h ALA 77 Ca 0.56 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 1bu9 h ALA 77 Cb 1.23 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1bu9 h ALA 77 CO -0.79 -1.03 -0.29 0.00 0.00 0.00 0.00 179.25 177.14 1bu9 h ALA 78 N -1.49 0.02 -0.43 0.00 0.00 0.19 1.75 119.26 119.31 1bu9 h ALA 78 Ca -0.09 -0.62 0.08 0.00 0.00 0.00 0.00 54.91 54.28 1bu9 h ALA 78 Cb 0.67 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 1bu9 h ALA 78 CO 0.15 0.15 -0.13 -2.13 0.00 0.00 0.00 179.25 177.29 1bu9 n ARG 79 N -4.50 -0.06 -0.03 0.00 0.00 0.92 -0.05 116.66 112.94 1bu9 n ARG 79 Ca -0.13 0.66 -0.21 0.00 -0.00 0.00 0.00 57.85 58.17 1bu9 n ARG 79 Cb 0.56 -0.99 -0.13 0.00 0.00 0.00 0.00 32.46 31.91 1bu9 n ARG 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1bu9 h ALA 80 N 0.75 0.26 0.00 5.13 0.00 -1.70 -3.41 119.26 120.29 1bu9 h ALA 80 Ca 0.18 -1.17 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1bu9 h ALA 80 Cb 0.29 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1bu9 h ALA 80 CO -0.43 0.86 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1bu9 n GLY 81 N 1.69 0.11 2.84 0.00 0.00 0.92 -5.00 105.19 105.75 1bu9 n GLY 81 Ca -0.28 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.30 1bu9 n GLY 81 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1bu9 n PHE 82 N 0.00 3.05 0.32 1.61 3.72 0.60 -4.96 117.46 121.80 1bu9 n PHE 82 Ca 0.00 -4.25 -0.15 0.00 -0.05 0.00 0.00 57.45 53.00 1bu9 n PHE 82 Cb 0.00 -0.57 -0.08 0.00 -0.94 0.00 0.00 39.48 37.89 1bu9 n PHE 82 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1bu9 h LEU 83 N 5.30 -0.71 -1.76 4.37 5.85 -1.93 0.52 115.31 126.95 1bu9 h LEU 83 Ca 0.16 -0.02 0.30 0.00 0.84 0.00 0.00 57.88 59.16 1bu9 h LEU 83 Cb 0.75 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 1bu9 h LEU 83 CO 0.71 -0.36 0.90 0.44 -0.34 0.00 0.00 178.44 179.79 1bu9 h ASP 84 N -1.07 0.00 0.37 1.25 5.19 -1.95 3.72 116.42 123.93 1bu9 h ASP 84 Ca -0.09 0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.01 1bu9 h ASP 84 Cb 0.69 0.00 0.03 0.00 0.18 0.00 0.00 39.33 40.22 1bu9 h ASP 84 CO 0.14 0.00 -1.37 0.74 -3.12 0.00 0.00 179.24 175.63 1bu9 h THR 85 N 0.00 1.36 0.00 0.35 2.02 -1.66 -1.94 112.91 113.04 1bu9 h THR 85 Ca 0.49 -2.78 -0.03 0.00 0.77 0.00 0.00 66.41 64.86 1bu9 h THR 85 Cb 2.30 2.96 -0.00 0.00 -1.74 0.00 0.00 68.15 71.66 1bu9 h THR 85 CO -0.01 0.83 -0.17 0.25 0.37 0.00 0.00 175.52 176.80 1bu9 h LEU 86 N 0.14 0.00 -0.13 2.58 6.46 1.14 -2.03 115.31 123.48 1bu9 h LEU 86 Ca -0.21 0.00 -0.12 0.00 -0.12 0.00 0.00 57.88 57.44 1bu9 h LEU 86 Cb 2.06 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.00 1bu9 h LEU 86 CO 0.25 0.17 -0.37 1.56 -0.62 0.00 0.00 178.44 179.42 1bu9 h GLN 87 N 0.00 0.48 -0.16 1.25 4.20 0.23 -1.28 115.11 119.82 1bu9 h GLN 87 Ca -0.00 -0.34 0.02 0.00 0.06 0.00 0.00 58.65 58.39 1bu9 h GLN 87 Cb 0.38 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 1bu9 h GLN 87 CO 0.02 0.96 -0.30 1.15 -0.67 0.00 0.00 178.83 179.99 1bu9 h THR 88 N 0.08 0.00 -0.02 -0.54 2.02 -0.61 1.37 112.91 115.21 1bu9 h THR 88 Ca -0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.18 1bu9 h THR 88 Cb 0.99 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1bu9 h THR 88 CO 0.08 0.00 -0.28 -0.07 0.37 0.00 0.00 175.52 175.62 1bu9 h LEU 89 N -0.26 -0.86 -0.60 2.58 4.07 -1.55 2.06 115.31 120.75 1bu9 h LEU 89 Ca 0.03 0.10 0.09 0.00 0.08 0.00 0.00 57.88 58.18 1bu9 h LEU 89 Cb 0.34 0.33 -0.11 0.00 1.08 0.00 0.00 40.66 42.30 1bu9 h LEU 89 CO -0.29 -0.26 -0.43 0.25 -1.08 0.00 0.00 178.44 176.63 1bu9 h LEU 90 N -0.33 -1.49 -1.40 1.67 7.12 -0.78 1.99 115.31 122.09 1bu9 h LEU 90 Ca 0.01 0.25 0.15 0.00 0.13 0.00 0.00 57.88 58.42 1bu9 h LEU 90 Cb 0.36 0.68 -0.06 0.00 -0.53 0.00 0.00 40.66 41.11 1bu9 h LEU 90 CO -0.19 -0.33 0.55 -0.08 -0.13 0.00 0.00 178.44 178.26 1bu9 h GLU 91 N -0.21 0.56 -1.15 1.25 4.57 0.26 0.20 114.58 120.06 1bu9 h GLU 91 Ca 0.19 -0.03 -0.33 0.00 -1.18 0.00 0.00 59.36 58.00 1bu9 h GLU 91 Cb 0.56 -0.13 -0.18 0.00 -0.16 0.00 0.00 28.75 28.85 1bu9 h GLU 91 CO -0.70 0.37 0.43 1.19 -1.18 0.00 0.00 179.01 179.12 1bu9 n PHE 92 N -4.53 1.82 -3.25 0.92 3.72 0.69 -4.87 117.46 111.96 1bu9 n PHE 92 Ca 0.17 -1.60 -0.12 0.00 -0.05 0.00 0.00 57.45 55.84 1bu9 n PHE 92 Cb 0.51 -0.80 0.05 0.00 -0.94 0.00 0.00 39.48 38.29 1bu9 n PHE 92 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1bu9 n GLN 93 N -0.26 -1.87 -4.27 -1.08 6.02 0.69 -4.68 117.38 111.93 1bu9 n GLN 93 Ca 0.35 1.01 -0.34 0.00 -0.01 0.00 0.00 57.00 58.01 1bu9 n GLN 93 Cb 0.97 -5.58 -0.10 0.00 1.02 0.00 0.00 30.24 26.55 1bu9 n GLN 93 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bu9 s ALA 94 N -3.28 3.25 -0.54 -1.58 0.00 -0.41 -4.65 121.76 114.55 1bu9 s ALA 94 Ca 0.32 -0.79 -0.27 0.00 0.00 0.00 0.00 51.96 51.22 1bu9 s ALA 94 Cb -0.05 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 1bu9 s ALA 94 CO 0.76 0.36 1.98 -0.51 0.00 0.00 0.00 175.76 178.35 1bu9 s ASP 95 N -0.17 5.16 0.64 0.00 1.01 -1.26 -4.59 116.67 117.47 1bu9 s ASP 95 Ca 0.05 0.65 0.32 0.00 0.71 0.00 0.00 52.55 54.28 1bu9 s ASP 95 Cb -0.12 -2.52 1.76 0.00 1.01 0.00 0.00 42.92 43.04 1bu9 s ASP 95 CO 0.02 -2.41 2.03 1.62 0.21 0.00 0.00 175.17 176.64 1bu9 h VAL 96 N 7.06 0.13 -0.27 -1.27 3.04 -1.96 2.25 116.25 125.23 1bu9 h VAL 96 Ca -0.27 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1bu9 h VAL 96 Cb 1.19 0.75 0.00 0.00 -2.01 0.00 0.00 31.29 31.22 1bu9 h VAL 96 CO 1.18 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.33 1bu9 n ASN 97 N -3.18 1.60 -4.61 3.17 5.03 -1.26 -4.68 115.26 111.33 1bu9 n ASN 97 Ca -0.00 -2.03 -0.43 0.00 0.87 0.00 0.00 54.58 52.99 1bu9 n ASN 97 Cb 0.35 -0.22 -0.03 0.00 -1.02 0.00 0.00 39.78 38.87 1bu9 n ASN 97 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1bu9 s ILE 98 N -1.63 3.49 0.00 2.41 -1.16 0.76 -4.89 121.20 120.17 1bu9 s ILE 98 Ca 0.19 0.52 0.00 0.00 -0.51 0.00 0.00 60.65 60.85 1bu9 s ILE 98 Cb 0.10 -3.58 0.00 0.00 0.61 0.00 0.00 42.46 39.59 1bu9 s ILE 98 CO 0.12 -0.32 0.00 -0.62 -2.81 0.00 0.00 174.94 171.31 1bu9 n GLU 99 N 8.16 1.69 0.00 3.50 1.02 -1.26 -3.11 120.64 130.64 1bu9 n GLU 99 Ca 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1bu9 n GLU 99 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.88 1bu9 n GLU 99 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1bu9 n ASP 100 N 0.00 0.00 -1.19 1.62 5.75 0.56 -3.54 116.55 119.75 1bu9 n ASP 100 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.77 1bu9 n ASP 100 Cb 0.00 0.00 0.14 0.00 -1.03 0.00 0.00 41.12 40.23 1bu9 n ASP 100 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1bu9 n ASN 101 N 0.00 3.04 0.00 -1.12 4.05 -0.88 -4.28 115.26 116.06 1bu9 n ASN 101 Ca 0.00 -2.46 0.00 0.00 0.45 0.00 0.00 54.58 52.57 1bu9 n ASN 101 Cb 0.00 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 40.42 1bu9 n ASN 101 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1bu9 n GLU 102 N 0.13 0.00 0.00 1.20 1.02 -1.26 -4.92 120.64 116.81 1bu9 n GLU 102 Ca 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 1bu9 n GLU 102 Cb 0.74 -0.01 0.00 0.00 -0.02 0.00 0.00 31.44 32.15 1bu9 n GLU 102 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bu9 n GLY 103 N -0.96 0.00 3.71 0.62 0.00 -1.26 -3.90 105.19 103.40 1bu9 n GLY 103 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1bu9 n GLY 103 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bu9 s ASN 104 N 0.00 7.29 0.71 1.61 -0.87 -1.26 -3.91 114.94 118.51 1bu9 s ASN 104 Ca 0.00 1.56 -0.10 0.00 -1.57 0.00 0.00 52.86 52.75 1bu9 s ASN 104 Cb 0.00 -2.53 0.03 0.00 -0.02 0.00 0.00 41.25 38.73 1bu9 s ASN 104 CO 0.00 -0.20 1.07 -0.76 -2.57 0.00 0.00 177.10 174.64 1bu9 s LEU 105 N 0.83 2.86 0.61 0.60 1.43 -1.26 0.21 118.68 123.95 1bu9 s LEU 105 Ca 0.48 0.89 0.32 0.00 -1.03 0.00 0.00 54.13 54.79 1bu9 s LEU 105 Cb -0.20 -3.60 1.86 0.00 0.03 0.00 0.00 46.19 44.28 1bu9 s LEU 105 CO 0.26 -1.45 2.19 1.55 0.23 0.00 0.00 176.35 179.12 1bu9 h PRO 106 N -0.65 0.00 0.01 1.29 0.13 -1.80 0.31 132.00 131.29 1bu9 h PRO 106 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1bu9 h PRO 106 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1bu9 h PRO 106 CO 0.63 0.00 -0.01 1.25 -0.23 0.00 0.00 178.00 179.65 1bu9 h LEU 107 N 0.00 -0.02 -1.64 1.56 6.46 -1.87 1.29 115.31 121.09 1bu9 h LEU 107 Ca 0.04 -0.64 0.28 0.00 -0.12 0.00 0.00 57.88 57.44 1bu9 h LEU 107 Cb 0.26 0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.12 1bu9 h LEU 107 CO -0.00 0.64 0.70 0.45 -0.62 0.00 0.00 178.44 179.61 1bu9 h HIS 108 N -0.68 0.37 0.20 1.25 3.86 -0.78 0.94 115.15 120.31 1bu9 h HIS 108 Ca -0.00 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1bu9 h HIS 108 Cb 0.65 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1bu9 h HIS 108 CO 0.15 0.05 -0.10 -0.07 0.86 0.00 0.00 177.93 178.82 1bu9 h LEU 109 N 0.23 -0.23 -1.75 2.43 4.07 -0.41 -0.33 115.31 119.33 1bu9 h LEU 109 Ca 0.54 0.01 0.34 0.00 0.08 0.00 0.00 57.88 58.85 1bu9 h LEU 109 Cb 1.69 0.06 -0.05 0.00 1.08 0.00 0.00 40.66 43.44 1bu9 h LEU 109 CO -0.16 0.20 0.99 0.00 -1.08 0.00 0.00 178.44 178.38 1bu9 h ALA 110 N -1.16 3.05 0.18 1.53 0.00 0.31 2.54 119.26 125.72 1bu9 h ALA 110 Ca -0.03 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.54 1bu9 h ALA 110 Cb 0.21 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.11 1bu9 h ALA 110 CO 0.05 -1.59 -1.34 0.00 0.00 0.00 0.00 179.25 176.37 1bu9 h ALA 111 N 1.11 -0.02 -0.36 0.00 0.00 0.93 1.23 119.26 122.15 1bu9 h ALA 111 Ca 0.55 -0.84 0.04 0.00 0.00 0.00 0.00 54.91 54.66 1bu9 h ALA 111 Cb 2.53 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 20.35 1bu9 h ALA 111 CO -0.01 0.79 -0.51 0.87 0.00 0.00 0.00 179.25 180.40 1bu9 h LYS 112 N 0.15 -0.36 0.00 0.00 1.79 0.62 0.51 116.57 119.29 1bu9 h LYS 112 Ca -0.20 0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.24 1bu9 h LYS 112 Cb 2.03 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 32.75 1bu9 h LYS 112 CO 0.24 -0.24 -0.27 0.93 -1.08 0.00 0.00 179.45 179.04 1bu9 h GLU 113 N -0.37 0.00 0.00 3.15 4.39 -1.61 -3.45 114.58 116.69 1bu9 h GLU 113 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1bu9 h GLU 113 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1bu9 h GLU 113 CO -0.53 0.27 0.00 0.41 -1.16 0.00 0.00 179.01 177.99 1bu9 n GLY 114 N -0.51 1.51 3.49 -3.84 0.00 0.18 -4.95 105.19 101.08 1bu9 n GLY 114 Ca -0.02 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1bu9 n GLY 114 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1bu9 n HIS 115 N -1.69 0.49 0.00 1.61 8.25 0.42 -4.76 115.22 119.53 1bu9 n HIS 115 Ca 0.00 -0.54 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 1bu9 n HIS 115 Cb 0.07 -1.41 0.00 0.00 1.12 0.00 0.00 29.99 29.77 1bu9 n HIS 115 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1bu9 n LEU 116 N 12.19 0.00 -0.67 2.41 0.00 -1.26 0.20 117.00 129.87 1bu9 n LEU 116 Ca 0.45 0.48 0.50 0.00 0.00 0.00 0.00 56.01 57.45 1bu9 n LEU 116 Cb 0.43 0.00 0.78 0.00 0.00 0.00 0.00 43.42 44.63 1bu9 n LEU 116 CO 1.00 0.00 1.41 -1.14 0.00 0.00 0.00 177.39 178.66 1bu9 n ARG 117 N -0.83 -0.00 0.00 1.96 0.63 -1.26 0.19 116.66 117.35 1bu9 n ARG 117 Ca 0.00 1.06 0.00 0.00 -0.92 0.00 0.00 57.85 57.99 1bu9 n ARG 117 Cb 0.00 -2.40 0.00 0.00 0.45 0.00 0.00 32.46 30.51 1bu9 n ARG 117 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1bu9 n VAL 118 N -3.91 0.00 0.06 5.15 0.31 0.16 -2.05 118.33 118.04 1bu9 n VAL 118 Ca 0.43 0.67 0.21 0.00 -0.01 0.00 0.00 64.34 65.64 1bu9 n VAL 118 Cb 1.91 -1.65 0.74 0.00 -0.91 0.00 0.00 33.84 33.92 1bu9 n VAL 118 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1bu9 h VAL 119 N 0.00 0.42 0.00 2.52 2.07 0.42 1.32 116.25 123.00 1bu9 h VAL 119 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1bu9 h VAL 119 Cb 0.00 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1bu9 h VAL 119 CO 0.00 0.00 -0.30 -0.08 0.02 0.00 0.00 177.57 177.21 1bu9 h GLU 120 N 0.00 0.00 -0.03 1.57 4.81 0.20 -3.05 114.58 118.09 1bu9 h GLU 120 Ca 0.22 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1bu9 h GLU 120 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1bu9 h GLU 120 CO -0.00 0.30 -0.05 0.35 -0.73 0.00 0.00 179.01 178.88 1bu9 h PHE 121 N 0.00 0.10 -0.59 0.92 3.04 0.23 -1.66 116.94 118.99 1bu9 h PHE 121 Ca -0.00 -0.04 0.09 0.00 3.98 0.00 0.00 57.97 62.00 1bu9 h PHE 121 Cb 0.73 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 39.15 1bu9 h PHE 121 CO 0.00 0.62 0.20 -0.07 -2.02 0.00 0.00 178.31 177.04 1bu9 h LEU 122 N -0.45 0.18 -1.11 0.59 4.07 -1.47 0.32 115.31 117.44 1bu9 h LEU 122 Ca 0.00 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1bu9 h LEU 122 Cb 0.62 0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.43 1bu9 h LEU 122 CO 0.01 0.11 0.00 1.62 -1.08 0.00 0.00 178.44 179.10 1bu9 h VAL 123 N 0.37 0.00 0.19 1.22 3.04 -1.55 -3.14 116.25 116.38 1bu9 h VAL 123 Ca 0.30 -0.50 -0.32 0.00 -1.01 0.00 0.00 66.70 65.17 1bu9 h VAL 123 Cb 0.38 1.44 0.02 0.00 -2.01 0.00 0.00 31.29 31.11 1bu9 h VAL 123 CO -0.32 0.00 -1.57 0.50 -1.01 0.00 0.00 177.57 175.18 1bu9 h LYS 124 N 0.00 0.40 0.00 4.17 1.63 0.51 -3.46 116.57 119.82 1bu9 h LYS 124 Ca 0.00 -0.68 0.00 0.00 -0.85 0.00 0.00 60.65 59.12 1bu9 h LYS 124 Cb 0.54 0.25 0.00 0.00 -0.60 0.00 0.00 32.23 32.42 1bu9 h LYS 124 CO 0.00 1.33 0.00 0.72 -3.45 0.00 0.00 179.45 178.05 1bu9 n HIS 125 N -3.72 0.00 0.00 1.91 -0.00 0.33 -5.03 115.22 108.71 1bu9 n HIS 125 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.50 1bu9 n HIS 125 Cb 1.04 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 31.03 1bu9 n HIS 125 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1bu9 n THR 126 N 0.00 0.00 -0.06 1.59 -2.24 -1.26 -2.92 114.28 109.39 1bu9 n THR 126 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1bu9 n THR 126 Cb 0.00 0.00 0.26 0.00 -2.10 0.00 0.00 70.33 68.49 1bu9 n THR 126 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bu9 n ALA 127 N 0.79 3.14 -2.00 6.98 0.00 -1.26 -5.01 120.51 123.15 1bu9 n ALA 127 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 52.28 1bu9 n ALA 127 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1bu9 n ALA 127 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bu9 n SER 128 N 0.57 -3.68 -2.06 0.00 7.64 -1.15 -4.67 113.62 110.27 1bu9 n SER 128 Ca 0.18 1.28 -0.15 0.00 1.01 0.00 0.00 58.87 61.19 1bu9 n SER 128 Cb 0.75 -2.95 -0.10 0.00 -1.01 0.00 0.00 64.21 60.89 1bu9 n SER 128 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1bu9 n ASN 129 N 1.86 5.68 -3.36 6.43 6.94 -1.26 -4.79 115.26 126.75 1bu9 n ASN 129 Ca 0.00 -2.71 -0.30 0.00 -0.02 0.00 0.00 54.58 51.55 1bu9 n ASN 129 Cb 0.00 -1.30 -0.04 0.00 -2.36 0.00 0.00 39.78 36.07 1bu9 n ASN 129 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1bu9 n VAL 130 N 1.76 1.52 0.00 3.53 0.24 -1.26 -2.30 118.33 121.82 1bu9 n VAL 130 Ca 0.38 -1.10 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 1bu9 n VAL 130 Cb 0.74 -2.09 0.00 0.00 -1.47 0.00 0.00 33.84 31.02 1bu9 n VAL 130 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bu9 n GLY 131 N 4.24 1.04 3.24 7.63 0.00 -1.09 -4.73 105.19 115.52 1bu9 n GLY 131 Ca 0.40 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.19 1bu9 n GLY 131 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1bu9 n HIS 132 N 0.00 0.08 -2.88 1.61 -0.00 -0.97 -4.71 115.22 108.34 1bu9 n HIS 132 Ca 0.00 0.05 -0.41 0.00 -0.00 0.00 0.00 57.72 57.36 1bu9 n HIS 132 Cb 0.00 -0.72 -0.04 0.00 -0.00 0.00 0.00 29.99 29.23 1bu9 n HIS 132 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1bu9 s ARG 133 N 6.76 4.50 0.00 1.57 0.52 -1.26 -2.97 118.95 128.07 1bu9 s ARG 133 Ca 1.23 1.15 0.00 0.00 -0.52 0.00 0.00 55.73 57.59 1bu9 s ARG 133 Cb -0.84 -3.45 0.00 0.00 0.52 0.00 0.00 34.95 31.17 1bu9 s ARG 133 CO 0.52 0.01 0.00 0.27 0.02 0.00 0.00 175.30 176.12 1bu9 n ASN 134 N 3.83 0.00 0.06 0.23 6.94 -1.18 -4.50 115.26 120.63 1bu9 n ASN 134 Ca 0.02 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.46 1bu9 n ASN 134 Cb 0.51 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.86 1bu9 n ASN 134 CO 0.00 0.00 0.00 0.45 -1.03 0.00 0.00 177.26 176.68 1bu9 h HIS 135 N -0.66 -0.08 -0.01 -2.53 3.86 -1.75 -2.39 115.15 111.59 1bu9 h HIS 135 Ca 0.00 -0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.05 1bu9 h HIS 135 Cb 0.00 0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 1bu9 h HIS 135 CO 0.00 0.03 -0.73 -0.22 0.86 0.00 0.00 177.93 177.88 1bu9 h LYS 136 N -0.18 0.06 0.00 2.45 3.64 -1.91 -3.47 116.57 117.16 1bu9 h LYS 136 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1bu9 h LYS 136 Cb 0.15 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1bu9 h LYS 136 CO 0.01 0.76 0.00 0.41 -2.27 0.00 0.00 179.45 178.36 1bu9 n GLY 137 N 0.55 1.21 3.57 5.01 0.00 -0.90 -5.01 105.19 109.63 1bu9 n GLY 137 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1bu9 n GLY 137 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bu9 s ASP 138 N -0.85 4.64 1.11 1.61 1.01 -1.26 -3.72 116.67 119.20 1bu9 s ASP 138 Ca 0.00 -1.05 -0.15 0.00 0.71 0.00 0.00 52.55 52.06 1bu9 s ASP 138 Cb 0.00 -2.58 0.24 0.00 1.01 0.00 0.00 42.92 41.59 1bu9 s ASP 138 CO 0.00 -3.38 0.53 0.35 0.21 0.00 0.00 175.17 172.88 1bu9 n THR 139 N 8.17 0.00 0.00 -1.27 -2.24 -1.25 -3.13 114.28 114.55 1bu9 n THR 139 Ca 0.43 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.21 1bu9 n THR 139 Cb 0.46 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1bu9 n THR 139 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bu9 n ALA 140 N -4.73 1.12 -0.09 6.98 0.00 -1.16 -1.69 120.51 120.94 1bu9 n ALA 140 Ca -0.12 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.13 1bu9 n ALA 140 Cb 0.37 -0.92 -0.13 0.00 0.00 0.00 0.00 19.45 18.78 1bu9 n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bu9 n ASP 142 N -3.33 0.00 -0.06 0.00 8.00 -0.68 -1.50 116.55 118.97 1bu9 n ASP 142 Ca -0.42 0.23 -0.05 0.00 0.71 0.00 0.00 54.79 55.27 1bu9 n ASP 142 Cb 1.01 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 41.71 1bu9 n ASP 142 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1bu9 n LEU 143 N -1.38 1.54 0.28 0.64 4.77 -0.94 -3.14 117.00 118.78 1bu9 n LEU 143 Ca 0.07 0.50 0.18 0.00 -0.03 0.00 0.00 56.01 56.73 1bu9 n LEU 143 Cb 0.16 -0.79 0.96 0.00 -2.33 0.00 0.00 43.42 41.43 1bu9 n LEU 143 CO 0.14 -0.44 1.15 0.00 -1.33 0.00 0.00 177.39 176.92 1bu9 h ALA 144 N -1.16 1.42 0.37 -1.18 0.00 -1.55 -0.56 119.26 116.61 1bu9 h ALA 144 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1bu9 h ALA 144 Cb 0.53 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1bu9 h ALA 144 CO 0.00 -0.19 -0.18 -0.09 0.00 0.00 0.00 179.25 178.79 1bu9 h ARG 145 N 0.00 -0.48 -0.69 0.00 9.65 -1.41 0.24 114.38 121.69 1bu9 h ARG 145 Ca 0.03 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.99 1bu9 h ARG 145 Cb 0.34 0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.99 1bu9 h ARG 145 CO -0.00 -0.25 0.45 -0.07 2.80 0.00 0.00 179.97 182.90 1bu9 h LEU 146 N -1.09 0.68 -0.52 3.80 3.38 -1.36 0.17 115.31 120.37 1bu9 h LEU 146 Ca -0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1bu9 h LEU 146 Cb 0.45 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1bu9 h LEU 146 CO 0.08 0.46 0.00 -1.22 0.09 0.00 0.00 178.44 177.85 1bu9 n TYR 147 N -4.47 0.54 0.00 1.13 4.01 -0.27 -4.85 117.16 113.25 1bu9 n TYR 147 Ca 0.09 0.22 0.00 0.00 -0.16 0.00 0.00 57.90 58.05 1bu9 n TYR 147 Cb 0.16 -0.85 0.00 0.00 -0.31 0.00 0.00 39.34 38.34 1bu9 n TYR 147 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bu9 n GLY 148 N -0.14 3.25 3.56 2.72 0.00 0.58 -5.00 105.19 110.16 1bu9 n GLY 148 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 1bu9 n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bu9 s ARG 149 N -0.61 1.76 -0.12 1.61 3.00 0.80 -4.75 118.95 120.64 1bu9 s ARG 149 Ca 0.00 0.60 -0.26 0.00 0.00 0.00 0.00 55.73 56.08 1bu9 s ARG 149 Cb 0.00 -4.76 -0.27 0.00 0.00 0.00 0.00 34.95 29.92 1bu9 s ARG 149 CO 0.00 -4.16 0.74 -2.95 0.00 0.00 0.00 175.30 168.93 1bu9 h ASN 150 N 13.88 0.15 -1.21 0.23 7.08 -1.90 -1.81 115.58 132.00 1bu9 h ASN 150 Ca -0.04 -0.94 0.36 0.00 -3.08 0.00 0.00 56.30 52.60 1bu9 h ASN 150 Cb 1.05 -0.05 -0.10 0.00 -2.08 0.00 0.00 38.32 37.15 1bu9 h ASN 150 CO 1.05 1.19 0.80 -0.33 -2.08 0.00 0.00 177.43 178.06 1bu9 h GLU 151 N -0.79 0.19 0.06 4.14 3.07 -1.95 2.38 114.58 121.67 1bu9 h GLU 151 Ca -0.09 -0.01 -0.26 0.00 -0.50 0.00 0.00 59.36 58.51 1bu9 h GLU 151 Cb 1.24 -0.04 0.01 0.00 -0.84 0.00 0.00 28.75 29.12 1bu9 h GLU 151 CO 0.02 0.13 -1.08 0.28 -1.40 0.00 0.00 179.01 176.96 1bu9 h VAL 152 N 0.20 1.39 0.38 3.13 2.07 -1.86 -1.56 116.25 119.99 1bu9 h VAL 152 Ca 0.69 -2.57 -0.02 0.00 0.82 0.00 0.00 66.70 65.62 1bu9 h VAL 152 Cb 2.13 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 34.50 1bu9 h VAL 152 CO -0.28 0.77 -0.18 0.58 0.02 0.00 0.00 177.57 178.48 1bu9 h VAL 153 N 0.22 0.00 -0.99 2.57 2.07 0.44 -2.99 116.25 117.57 1bu9 h VAL 153 Ca -0.12 -0.16 0.23 0.00 0.82 0.00 0.00 66.70 67.47 1bu9 h VAL 153 Cb 1.75 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.40 1bu9 h VAL 153 CO 0.19 0.00 0.57 -1.28 0.02 0.00 0.00 177.57 177.07 1bu9 h SER 154 N -0.67 0.65 -0.83 0.57 0.87 0.71 0.75 113.55 115.60 1bu9 h SER 154 Ca -0.05 0.13 0.17 0.00 -1.23 0.00 0.00 61.79 60.81 1bu9 h SER 154 Cb 0.39 0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 62.23 1bu9 h SER 154 CO 0.09 0.12 -0.17 0.25 -0.53 0.00 0.00 176.83 176.59 1bu9 h LEU 155 N 0.59 -0.70 0.00 2.23 7.12 -1.14 1.15 115.31 124.56 1bu9 h LEU 155 Ca 0.62 0.25 -0.12 0.00 0.13 0.00 0.00 57.88 58.76 1bu9 h LEU 155 Cb 1.14 0.49 -0.02 0.00 -0.53 0.00 0.00 40.66 41.75 1bu9 h LEU 155 CO -0.47 -0.27 -1.01 0.23 -0.13 0.00 0.00 178.44 176.80 1bu9 n MET 156 N -5.51 0.51 -0.30 1.25 2.81 0.59 -2.54 117.12 113.92 1bu9 n MET 156 Ca 0.13 0.47 0.14 0.00 -1.81 0.00 0.00 57.70 56.64 1bu9 n MET 156 Cb 0.45 -1.65 0.31 0.00 -0.71 0.00 0.00 33.22 31.62 1bu9 n MET 156 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1bu9 h GLN 157 N -1.00 0.20 -0.16 0.03 4.20 0.47 0.59 115.11 119.44 1bu9 h GLN 157 Ca -0.18 -0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.38 1bu9 h GLN 157 Cb 0.93 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1bu9 h GLN 157 CO -0.11 0.13 -0.45 0.00 -0.67 0.00 0.00 178.83 177.74 1bu9 h ALA 158 N 1.80 0.27 -0.01 3.87 0.00 0.12 -3.20 119.26 122.11 1bu9 h ALA 158 Ca 0.57 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1bu9 h ALA 158 Cb 1.18 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1bu9 h ALA 158 CO -0.67 0.40 -0.15 0.09 0.00 0.00 0.00 179.25 178.93 1bu9 n ASN 159 N -4.24 5.33 -4.23 0.00 3.02 0.10 -4.73 115.26 110.52 1bu9 n ASN 159 Ca -0.07 -2.46 -0.33 0.00 -0.03 0.00 0.00 54.58 51.69 1bu9 n ASN 159 Cb 0.56 -1.25 -0.05 0.00 -0.61 0.00 0.00 39.78 38.43 1bu9 n ASN 159 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bu9 n GLY 160 N 1.89 -0.31 0.00 7.41 0.00 -1.00 -4.78 105.19 108.41 1bu9 n GLY 160 Ca 0.19 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1bu9 n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bu9 n ALA 161 N -4.38 0.97 -2.28 4.61 0.00 0.17 -4.74 120.51 114.85 1bu9 n ALA 161 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 1bu9 n ALA 161 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1bu9 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bu9 n GLY 162 N 0.98 4.74 3.65 0.00 0.00 -0.93 -2.68 105.19 110.95 1bu9 n GLY 162 Ca 0.00 -2.06 -0.47 0.00 0.00 0.00 0.00 46.02 43.50 1bu9 n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bu9 n GLY 163 N 2.90 0.70 0.35 -0.02 0.00 -1.26 -4.71 105.19 103.16 1bu9 n GLY 163 Ca 0.41 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1bu9 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bu9 n ALA 164 N 2.28 1.81 -1.65 4.61 0.00 -1.26 -4.87 120.51 121.42 1bu9 n ALA 164 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 53.44 53.53 1bu9 n ALA 164 Cb 0.28 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.74 1bu9 n ALA 164 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1bu9 n THR 165 N -1.80 0.00 0.00 0.00 5.66 -1.26 -5.07 114.28 111.81 1bu9 n THR 165 Ca 0.00 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 1bu9 n THR 165 Cb 0.00 -1.66 0.00 0.00 -1.55 0.00 0.00 70.33 67.12 1bu9 n THR 165 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1bu9 n ASN 166 N -3.03 0.00 -3.94 1.09 3.02 -1.26 -4.60 115.26 106.54 1bu9 n ASN 166 Ca 0.01 0.14 -0.34 0.00 -0.03 0.00 0.00 54.58 54.35 1bu9 n ASN 166 Cb 0.04 -0.38 -0.10 0.00 -0.61 0.00 0.00 39.78 38.73 1bu9 n ASN 166 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1bu9 n LEU 167 N -2.05 1.91 -0.47 3.41 4.77 -1.26 -5.21 117.00 118.10 1bu9 n LEU 167 Ca 0.00 -2.22 0.14 0.00 -0.03 0.00 0.00 56.01 53.90 1bu9 n LEU 167 Cb 0.00 -1.09 0.53 0.00 -2.33 0.00 0.00 43.42 40.53 1bu9 n LEU 167 CO 0.00 -2.13 0.88 1.67 -1.33 0.00 0.00 177.39 176.48