#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 0.00 -1.29 3.17 0.00 -1.26 -4.94 120.51 116.19 1bu9 n ALA 2 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1bu9 n ALA 2 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 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 -0.27 0.00 -3.06 0.00 2.13 -1.26 -4.82 120.64 113.37 1bu9 n GLU 3 Ca 0.00 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.41 1bu9 n GLU 3 Cb 0.00 -1.10 -0.05 0.00 0.27 0.00 0.00 31.44 30.56 1bu9 n GLU 3 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1bu9 s PRO 4 N 6.97 4.20 0.00 5.31 0.04 -1.26 -4.82 135.00 145.44 1bu9 s PRO 4 Ca 1.16 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1bu9 s PRO 4 Cb -0.92 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.02 1bu9 s PRO 4 CO 0.45 -0.32 0.00 1.87 0.04 0.00 0.00 177.00 179.04 1bu9 n TRP 5 N 5.31 0.00 -0.52 0.56 -0.00 -1.26 -4.86 117.44 116.68 1bu9 n TRP 5 Ca 0.00 0.00 0.39 0.00 -0.00 0.00 0.00 57.50 57.90 1bu9 n TRP 5 Cb 0.49 0.00 0.60 0.00 -0.00 0.00 0.00 31.31 32.41 1bu9 n TRP 5 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1bu9 n GLY 6 N 0.00 -0.73 0.12 5.87 0.00 -1.26 0.31 105.19 109.50 1bu9 n GLY 6 Ca 0.00 0.52 -0.18 0.00 0.00 0.00 0.00 46.02 46.36 1bu9 n GLY 6 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1bu9 h ASN 7 N 0.00 0.48 0.04 1.61 2.35 -1.93 -3.21 115.58 114.91 1bu9 h ASN 7 Ca 0.70 -0.58 -0.38 0.00 -0.55 0.00 0.00 56.30 55.49 1bu9 h ASN 7 Cb 2.76 -0.16 -0.06 0.00 0.05 0.00 0.00 38.32 40.92 1bu9 h ASN 7 CO -0.04 1.47 -2.36 1.21 -1.65 0.00 0.00 177.43 176.06 1bu9 n GLU 8 N -3.53 0.67 0.00 0.81 2.13 0.93 -3.69 120.64 117.97 1bu9 n GLU 8 Ca -0.14 0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1bu9 n GLU 8 Cb 1.05 -1.56 0.00 0.00 0.27 0.00 0.00 31.44 31.19 1bu9 n GLU 8 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1bu9 n LEU 9 N -3.25 0.39 -0.37 4.31 -0.00 0.79 -2.40 117.00 116.48 1bu9 n LEU 9 Ca -0.41 0.64 0.34 0.00 -0.00 0.00 0.00 56.01 56.58 1bu9 n LEU 9 Cb 1.02 -0.32 0.70 0.00 -0.00 0.00 0.00 43.42 44.82 1bu9 n LEU 9 CO 0.31 -0.32 1.31 0.00 -0.00 0.00 0.00 177.39 178.69 1bu9 h ALA 10 N -2.00 2.97 -3.00 1.96 0.00 -1.67 -2.43 119.26 115.10 1bu9 h ALA 10 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bu9 h ALA 10 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1bu9 h ALA 10 CO 0.00 -1.37 0.00 0.45 0.00 0.00 0.00 179.25 178.33 1bu9 n SER 11 N -4.30 0.00 -0.26 0.00 2.88 -1.15 0.15 113.62 110.93 1bu9 n SER 11 Ca 0.28 0.46 0.05 0.00 -1.33 0.00 0.00 58.87 58.33 1bu9 n SER 11 Cb 1.26 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 64.86 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 -2.04 0.72 -0.73 -1.46 0.00 -1.12 2.26 119.26 116.89 1bu9 h ALA 12 Ca 0.00 0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1bu9 h ALA 12 Cb 0.00 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1bu9 h ALA 12 CO 0.00 -0.43 0.41 0.00 0.00 0.00 0.00 179.25 179.23 1bu9 h ALA 13 N 1.74 1.00 -0.63 0.00 0.00 -1.29 0.24 119.26 120.32 1bu9 h ALA 13 Ca 0.41 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1bu9 h ALA 13 Cb 0.70 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1bu9 h ALA 13 CO -0.72 0.07 0.00 0.00 0.00 0.00 0.00 179.25 178.60 1bu9 n ALA 14 N -2.37 3.02 0.14 0.00 0.00 0.39 0.11 120.51 121.79 1bu9 n ALA 14 Ca 0.10 -1.47 0.02 0.00 0.00 0.00 0.00 53.44 52.09 1bu9 n ALA 14 Cb 0.21 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 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 1.11 4.31 0.00 0.00 3.00 0.72 -4.66 116.66 121.15 1bu9 n ARG 15 Ca 0.24 -0.01 0.00 0.00 -0.00 0.00 0.00 57.85 58.09 1bu9 n ARG 15 Cb 0.83 -0.79 0.00 0.00 0.00 0.00 0.00 32.46 32.50 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 1.39 1.37 3.57 5.14 0.00 0.65 -4.97 105.19 112.34 1bu9 n GLY 16 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1bu9 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bu9 s ASP 17 N -2.13 3.60 0.05 1.61 1.01 -0.60 -4.76 116.67 115.44 1bu9 s ASP 17 Ca 0.00 -0.64 -0.23 0.00 0.71 0.00 0.00 52.55 52.39 1bu9 s ASP 17 Cb 0.00 -2.58 -0.12 0.00 1.01 0.00 0.00 42.92 41.23 1bu9 s ASP 17 CO 0.00 -4.45 1.36 0.25 0.21 0.00 0.00 175.17 172.53 1bu9 h LEU 18 N 22.38 -0.80 -0.16 1.23 5.85 -1.93 -1.20 115.31 140.67 1bu9 h LEU 18 Ca 0.01 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1bu9 h LEU 18 Cb 1.00 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 42.20 1bu9 h LEU 18 CO 1.01 -0.48 -0.52 -0.08 -0.34 0.00 0.00 178.44 178.04 1bu9 h GLU 19 N -0.76 -0.53 -0.78 1.25 4.81 -1.98 -0.19 114.58 116.41 1bu9 h GLU 19 Ca -0.07 0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.33 1bu9 h GLU 19 Cb 0.61 0.12 -0.14 0.00 0.63 0.00 0.00 28.75 29.98 1bu9 h GLU 19 CO 0.06 -0.35 -0.35 0.37 -0.73 0.00 0.00 179.01 178.01 1bu9 h GLN 20 N -0.55 -0.08 -0.89 1.92 4.15 -1.94 2.15 115.11 119.87 1bu9 h GLN 20 Ca 0.05 0.01 0.19 0.00 0.77 0.00 0.00 58.65 59.66 1bu9 h GLN 20 Cb 0.67 0.02 -0.07 0.00 0.21 0.00 0.00 27.48 28.31 1bu9 h GLN 20 CO -0.45 -0.05 0.58 1.25 -1.93 0.00 0.00 178.83 178.24 1bu9 h LEU 21 N -0.08 0.45 0.09 -2.39 5.85 0.10 0.12 115.31 119.45 1bu9 h LEU 21 Ca 0.29 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.05 1bu9 h LEU 21 Cb 0.58 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1bu9 h LEU 21 CO -0.82 0.19 -0.04 0.74 -0.34 0.00 0.00 178.44 178.17 1bu9 h THR 22 N 0.46 0.00 -0.66 1.05 2.02 0.50 -2.61 112.91 113.67 1bu9 h THR 22 Ca 0.46 -0.16 0.13 0.00 0.77 0.00 0.00 66.41 67.61 1bu9 h THR 22 Cb 1.06 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.35 1bu9 h THR 22 CO -0.18 0.00 -0.22 0.28 0.37 0.00 0.00 175.52 175.76 1bu9 h SER 23 N -0.28 -0.80 -0.44 4.18 0.02 -0.26 0.30 113.55 116.27 1bu9 h SER 23 Ca -0.01 0.21 0.08 0.00 -0.84 0.00 0.00 61.79 61.23 1bu9 h SER 23 Cb 0.09 0.47 -0.07 0.00 0.14 0.00 0.00 62.40 63.04 1bu9 h SER 23 CO 0.02 -0.25 0.04 0.25 -1.14 0.00 0.00 176.83 175.75 1bu9 h LEU 24 N -0.05 -0.10 -1.26 5.07 5.85 -0.90 0.28 115.31 124.21 1bu9 h LEU 24 Ca 0.30 0.09 0.21 0.00 0.84 0.00 0.00 57.88 59.32 1bu9 h LEU 24 Cb 0.52 0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.61 1bu9 h LEU 24 CO -0.70 -0.01 0.62 0.25 -0.34 0.00 0.00 178.44 178.25 1bu9 h LEU 25 N 0.16 0.59 -1.71 2.25 5.85 -0.54 1.50 115.31 123.41 1bu9 h LEU 25 Ca 0.22 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1bu9 h LEU 25 Cb 0.30 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1bu9 h LEU 25 CO -0.32 0.21 0.00 1.56 -0.34 0.00 0.00 178.44 179.54 1bu9 h GLN 26 N 0.57 0.00 0.00 1.25 1.08 -0.46 -3.22 115.11 114.33 1bu9 h GLN 26 Ca 0.54 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.74 1bu9 h GLN 26 Cb 1.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 1bu9 h GLN 26 CO -0.29 0.00 0.00 -1.71 -0.95 0.00 0.00 178.83 175.88 1bu9 n ASN 27 N -2.41 0.00 0.00 1.46 5.15 0.51 -5.10 115.26 114.88 1bu9 n ASN 27 Ca -0.02 0.14 0.00 0.00 -0.60 0.00 0.00 54.58 54.10 1bu9 n ASN 27 Cb 0.04 -0.22 0.00 0.00 -0.53 0.00 0.00 39.78 39.08 1bu9 n ASN 27 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bu9 n ASN 28 N -1.42 0.00 -3.15 1.20 5.15 -1.14 -5.15 115.26 110.75 1bu9 n ASN 28 Ca 0.00 0.00 0.05 0.00 -0.60 0.00 0.00 54.58 54.03 1bu9 n ASN 28 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.24 1bu9 n ASN 28 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1bu9 s VAL 29 N -0.42 -0.32 -0.82 3.44 -7.23 -1.26 -4.90 120.40 108.88 1bu9 s VAL 29 Ca 0.00 0.00 -0.10 0.00 -1.81 0.00 0.00 61.98 60.07 1bu9 s VAL 29 Cb 0.00 -0.64 -0.27 0.00 0.56 0.00 0.00 36.38 36.03 1bu9 s VAL 29 CO 0.00 0.00 1.84 -3.20 -0.31 0.00 0.00 175.10 173.43 1bu9 n ASN 30 N 5.30 -0.99 0.24 4.85 5.15 -1.26 -4.59 115.26 123.96 1bu9 n ASN 30 Ca 0.01 -0.36 0.17 0.00 -0.60 0.00 0.00 54.58 53.81 1bu9 n ASN 30 Cb 0.56 -0.49 0.81 0.00 -0.53 0.00 0.00 39.78 40.13 1bu9 n ASN 30 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1bu9 h VAL 31 N 5.90 0.17 -0.16 3.44 2.07 -1.96 3.97 116.25 129.69 1bu9 h VAL 31 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1bu9 h VAL 31 Cb 0.96 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1bu9 h VAL 31 CO 1.31 0.00 0.00 0.59 0.02 0.00 0.00 177.57 179.49 1bu9 n ASN 32 N -3.27 1.32 -3.22 0.57 5.03 -1.26 -4.50 115.26 109.93 1bu9 n ASN 32 Ca 0.01 -1.73 0.00 0.00 0.87 0.00 0.00 54.58 53.74 1bu9 n ASN 32 Cb 0.44 -0.10 0.00 0.00 -1.02 0.00 0.00 39.78 39.10 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 0.12 0.00 -3.20 5.41 0.00 1.31 -4.91 120.51 119.24 1bu9 n ALA 33 Ca 0.14 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.62 1bu9 n ALA 33 Cb 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.21 0.19 0.37 0.00 -0.21 -1.26 -4.33 119.66 114.20 1bu9 s GLN 34 Ca 0.00 0.38 -0.06 0.00 0.02 0.00 0.00 55.36 55.70 1bu9 s GLN 34 Cb 0.00 0.22 0.09 0.00 1.00 0.00 0.00 33.01 34.31 1bu9 s GLN 34 CO 0.00 -0.16 0.50 -1.71 -2.12 0.00 0.00 175.29 171.80 1bu9 n ASN 35 N 5.27 -0.01 0.05 5.90 2.85 -1.18 -4.80 115.26 123.34 1bu9 n ASN 35 Ca -0.07 -1.17 0.06 0.00 -0.11 0.00 0.00 54.58 53.29 1bu9 n ASN 35 Cb 0.54 -0.38 0.28 0.00 1.24 0.00 0.00 39.78 41.45 1bu9 n ASN 35 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1bu9 n GLY 36 N 1.65 -0.83 0.06 8.20 0.00 -1.26 -1.22 105.19 111.80 1bu9 n GLY 36 Ca 0.06 0.04 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 1bu9 n GLY 36 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1bu9 h PHE 37 N 0.00 0.05 -0.48 1.61 3.04 -2.00 -3.48 116.94 115.68 1bu9 h PHE 37 Ca 0.00 -0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.91 1bu9 h PHE 37 Cb 0.12 -0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.63 1bu9 h PHE 37 CO 0.00 1.03 0.00 0.41 -2.02 0.00 0.00 178.31 177.73 1bu9 n GLY 38 N 1.37 0.67 3.48 2.40 0.00 -0.36 -4.24 105.19 108.51 1bu9 n GLY 38 Ca -0.01 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1bu9 n GLY 38 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bu9 s ARG 39 N -0.85 1.05 0.24 1.61 1.04 -1.26 -1.29 118.95 119.49 1bu9 s ARG 39 Ca 0.00 -0.20 0.05 0.00 -1.04 0.00 0.00 55.73 54.54 1bu9 s ARG 39 Cb 0.00 0.49 -0.03 0.00 -2.04 0.00 0.00 34.95 33.37 1bu9 s ARG 39 CO 0.00 -0.42 0.33 0.95 -0.04 0.00 0.00 175.30 176.12 1bu9 s THR 40 N -2.75 5.13 0.61 4.99 -4.23 -1.26 -3.08 115.64 115.05 1bu9 s THR 40 Ca -0.01 -1.06 0.26 0.00 -1.18 0.00 0.00 61.69 59.71 1bu9 s THR 40 Cb -0.01 -3.78 0.34 0.00 1.34 0.00 0.00 72.50 70.39 1bu9 s THR 40 CO -0.05 -0.33 1.72 0.00 -0.54 0.00 0.00 174.62 175.41 1bu9 h ALA 41 N 1.24 2.14 -0.00 3.99 0.00 -1.88 1.91 119.26 126.65 1bu9 h ALA 41 Ca -0.51 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 1bu9 h ALA 41 Cb 1.23 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1bu9 h ALA 41 CO 0.61 -0.86 -0.47 1.25 0.00 0.00 0.00 179.25 179.78 1bu9 h LEU 42 N 0.00 0.00 0.10 0.00 7.12 -1.91 0.34 115.31 120.96 1bu9 h LEU 42 Ca 0.21 -0.00 -0.35 0.00 0.13 0.00 0.00 57.88 57.87 1bu9 h LEU 42 Cb 1.48 -0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.58 1bu9 h LEU 42 CO -0.00 0.47 -1.95 0.00 -0.13 0.00 0.00 178.44 176.84 1bu9 n GLN 43 N -3.98 0.73 0.08 1.25 6.02 0.62 -4.17 117.38 117.94 1bu9 n GLN 43 Ca -0.02 0.27 -0.08 0.00 -0.01 0.00 0.00 57.00 57.16 1bu9 n GLN 43 Cb 0.49 -1.72 0.03 0.00 1.02 0.00 0.00 30.24 30.05 1bu9 n GLN 43 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 1bu9 h VAL 44 N 0.06 1.44 0.00 5.09 -1.51 -0.81 -3.46 116.25 117.05 1bu9 h VAL 44 Ca -0.40 -2.36 0.00 0.00 -1.23 0.00 0.00 66.70 62.72 1bu9 h VAL 44 Cb 2.03 2.28 0.00 0.00 -2.13 0.00 0.00 31.29 33.47 1bu9 h VAL 44 CO 0.08 0.69 0.00 1.15 -1.23 0.00 0.00 177.57 178.27 1bu9 n MET 45 N -3.75 0.00 -0.07 5.19 0.00 0.12 -4.38 117.12 114.23 1bu9 n MET 45 Ca -0.04 0.00 0.26 0.00 0.00 0.00 0.00 57.70 57.92 1bu9 n MET 45 Cb 0.74 0.00 0.68 0.00 0.00 0.00 0.00 33.22 34.65 1bu9 n MET 45 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1bu9 h LYS 46 N 0.00 0.00 0.00 3.17 1.79 0.58 -3.45 116.57 118.66 1bu9 h LYS 46 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1bu9 h LYS 46 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1bu9 h LYS 46 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 1bu9 n LEU 47 N -3.73 0.00 -0.11 2.94 4.77 -1.26 -4.73 117.00 114.88 1bu9 n LEU 47 Ca 0.15 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.99 1bu9 n LEU 47 Cb 0.96 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.95 1bu9 n LEU 47 CO 0.30 0.00 0.50 1.23 -1.33 0.00 0.00 177.39 178.09 1bu9 h GLY 48 N 0.00 -1.03 -5.26 -0.72 0.00 -1.96 -3.28 103.07 90.81 1bu9 h GLY 48 Ca 0.00 0.71 -0.59 0.00 0.00 0.00 0.00 47.33 47.45 1bu9 h GLY 48 CO 0.00 -0.14 -0.17 0.54 0.00 0.00 0.00 176.54 176.77 1bu9 s ASN 49 N -5.00 6.75 0.12 0.19 2.20 -1.26 -4.92 114.94 113.01 1bu9 s ASN 49 Ca -0.15 0.89 0.23 0.00 -0.94 0.00 0.00 52.86 52.89 1bu9 s ASN 49 Cb 0.08 -2.27 0.13 0.00 -2.00 0.00 0.00 41.25 37.19 1bu9 s ASN 49 CO 0.61 0.17 1.12 -0.81 -2.94 0.00 0.00 177.10 175.25 1bu9 n PRO 50 N 2.73 0.40 0.24 3.55 -0.04 -1.24 -3.41 135.00 137.23 1bu9 n PRO 50 Ca -0.11 0.06 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 1bu9 n PRO 50 Cb 0.52 -1.69 0.50 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.14 0.54 4.11 -1.91 -2.99 114.58 114.19 1bu9 h GLU 51 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.44 1bu9 h GLU 51 Cb 0.82 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1bu9 h GLU 51 CO 0.00 0.14 -0.13 0.82 0.07 0.00 0.00 179.01 179.91 1bu9 h ILE 52 N 0.00 0.00 -0.62 -1.06 1.08 -1.94 1.44 117.51 116.40 1bu9 h ILE 52 Ca -0.00 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 1bu9 h ILE 52 Cb 0.70 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.42 1bu9 h ILE 52 CO 0.02 0.00 0.41 0.00 -0.69 0.00 0.00 178.15 177.89 1bu9 h ALA 53 N -0.87 1.80 0.79 1.87 0.00 -1.79 -2.66 119.26 118.40 1bu9 h ALA 53 Ca 0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1bu9 h ALA 53 Cb 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1bu9 h ALA 53 CO -0.16 0.09 -0.46 -0.09 0.00 0.00 0.00 179.25 178.63 1bu9 h ARG 54 N 0.61 -1.13 -1.22 0.00 2.43 0.57 1.77 114.38 117.41 1bu9 h ARG 54 Ca 0.27 0.08 0.43 0.00 -0.81 0.00 0.00 59.98 59.95 1bu9 h ARG 54 Cb 0.29 0.26 -0.13 0.00 -0.42 0.00 0.00 29.97 29.97 1bu9 h ARG 54 CO -0.08 -0.75 0.77 0.54 -1.51 0.00 0.00 179.97 178.94 1bu9 n ARG 55 N -5.40 -0.03 -0.02 0.20 3.00 0.43 0.30 116.66 115.13 1bu9 n ARG 55 Ca -0.14 1.15 -0.05 0.00 -0.01 0.00 0.00 57.85 58.79 1bu9 n ARG 55 Cb 0.48 -2.24 -0.13 0.00 0.00 0.00 0.00 32.46 30.57 1bu9 n ARG 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1bu9 n LEU 56 N -4.57 0.65 0.00 0.55 4.77 -0.75 -4.33 117.00 113.32 1bu9 n LEU 56 Ca 0.36 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.64 1bu9 n LEU 56 Cb 1.40 0.20 0.00 0.00 -2.33 0.00 0.00 43.42 42.69 1bu9 n LEU 56 CO 0.15 0.31 0.34 -0.11 -1.33 0.00 0.00 177.39 176.75 1bu9 n LEU 57 N -2.90 0.00 0.32 2.23 7.94 0.86 0.31 117.00 125.76 1bu9 n LEU 57 Ca -0.17 0.68 0.07 0.00 -1.11 0.00 0.00 56.01 55.48 1bu9 n LEU 57 Cb 0.98 -0.18 0.38 0.00 0.53 0.00 0.00 43.42 45.14 1bu9 n LEU 57 CO 0.44 -0.18 1.04 0.17 -1.11 0.00 0.00 177.39 177.75 1bu9 h LEU 58 N 0.00 0.00 0.00 -1.96 -0.00 -1.74 2.25 115.31 113.86 1bu9 h LEU 58 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.88 57.63 1bu9 h LEU 58 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.62 1bu9 h LEU 58 CO 0.00 0.00 -1.67 -1.14 -0.00 0.00 0.00 178.44 175.63 1bu9 n ARG 59 N -2.62 0.63 0.00 0.17 0.00 -0.89 -4.94 116.66 109.02 1bu9 n ARG 59 Ca -0.01 0.24 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 1bu9 n ARG 59 Cb 0.68 -1.77 0.00 0.00 0.00 0.00 0.00 32.46 31.37 1bu9 n ARG 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bu9 n GLY 60 N 1.51 -1.13 2.77 5.14 0.00 0.90 -5.03 105.19 109.36 1bu9 n GLY 60 Ca -0.16 0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1bu9 n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bu9 n ALA 61 N 0.00 4.25 -1.64 4.61 0.00 -0.75 -4.42 120.51 122.57 1bu9 n ALA 61 Ca 0.00 -4.54 -0.64 0.00 0.00 0.00 0.00 53.44 48.25 1bu9 n ALA 61 Cb 0.00 -0.78 -0.10 0.00 0.00 0.00 0.00 19.45 18.57 1bu9 n ALA 61 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1bu9 n ASN 62 N -0.00 1.33 0.31 0.00 3.02 -1.26 -4.73 115.26 113.93 1bu9 n ASN 62 Ca 0.30 1.05 0.20 0.00 -0.03 0.00 0.00 54.58 56.10 1bu9 n ASN 62 Cb 0.43 -0.94 1.03 0.00 -0.61 0.00 0.00 39.78 39.69 1bu9 n ASN 62 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1bu9 h PRO 63 N 6.34 0.00 -0.21 3.52 0.13 -1.88 -0.02 132.00 139.88 1bu9 h PRO 63 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1bu9 h PRO 63 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1bu9 h PRO 63 CO 1.00 0.02 0.00 -3.47 -0.23 0.00 0.00 178.00 175.32 1bu9 n ASP 64 N -3.26 1.29 -4.29 1.44 -0.08 -1.26 -2.60 116.55 107.78 1bu9 n ASP 64 Ca -0.02 -1.89 -0.22 0.00 -1.51 0.00 0.00 54.79 51.15 1bu9 n ASP 64 Cb 0.13 -0.14 -0.12 0.00 2.34 0.00 0.00 41.12 43.34 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 0.16 1.21 -4.42 -2.67 4.77 -0.02 -4.75 117.00 111.28 1bu9 n LEU 65 Ca 0.10 -2.22 -0.30 0.00 -0.03 0.00 0.00 56.01 53.56 1bu9 n LEU 65 Cb 0.22 -1.41 0.21 0.00 -2.33 0.00 0.00 43.42 40.11 1bu9 n LEU 65 CO 0.08 -3.25 0.11 1.17 -1.33 0.00 0.00 177.39 174.17 1bu9 n LYS 66 N 8.07 -1.72 -1.72 3.23 3.00 -1.26 -3.69 118.16 124.06 1bu9 n LYS 66 Ca 0.42 -0.47 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 1bu9 n LYS 66 Cb 0.46 -2.00 0.00 0.00 0.00 0.00 0.00 35.03 33.48 1bu9 n LYS 66 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1bu9 n ASP 67 N -3.40 1.62 -0.23 3.14 5.75 -1.00 -4.81 116.55 117.62 1bu9 n ASP 67 Ca 0.04 -0.86 0.15 0.00 -0.01 0.00 0.00 54.79 54.11 1bu9 n ASP 67 Cb 0.56 0.00 0.46 0.00 -1.03 0.00 0.00 41.12 41.11 1bu9 n ASP 67 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1bu9 h ARG 68 N 0.00 0.50 -0.90 0.11 -0.00 -1.37 0.54 114.38 113.27 1bu9 h ARG 68 Ca 0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.98 59.94 1bu9 h ARG 68 Cb 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 29.97 29.85 1bu9 h ARG 68 CO 0.00 0.33 0.01 0.25 -0.00 0.00 0.00 179.97 180.56 1bu9 n THR 69 N -4.52 0.76 -4.02 0.08 -2.24 -1.26 -4.81 114.28 98.27 1bu9 n THR 69 Ca 0.17 -0.36 -0.32 0.00 -2.27 0.00 0.00 64.05 61.27 1bu9 n THR 69 Cb 0.56 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 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 0.15 -0.44 3.26 3.38 0.00 0.19 -4.46 105.19 107.27 1bu9 n GLY 70 Ca 0.08 0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.37 3.30 0.49 1.61 0.40 -1.25 -2.25 117.98 116.91 1bu9 s PHE 71 Ca 0.60 -1.54 -0.24 0.00 -0.60 0.00 0.00 56.93 55.15 1bu9 s PHE 71 Cb -0.31 -2.48 -0.07 0.00 0.51 0.00 0.00 43.02 40.66 1bu9 s PHE 71 CO 0.87 -0.78 1.41 0.00 0.70 0.00 0.00 175.22 177.43 1bu9 s ALA 72 N 1.38 3.07 0.59 5.36 0.00 -1.24 -2.37 121.76 128.55 1bu9 s ALA 72 Ca -0.00 1.44 0.30 0.00 0.00 0.00 0.00 51.96 53.70 1bu9 s ALA 72 Cb -0.20 -3.59 1.32 0.00 0.00 0.00 0.00 23.12 20.64 1bu9 s ALA 72 CO 0.02 -1.31 1.69 -0.24 0.00 0.00 0.00 175.76 175.92 1bu9 h VAL 73 N 1.94 0.23 -0.93 0.00 3.04 -1.58 3.54 116.25 122.49 1bu9 h VAL 73 Ca -0.51 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.26 1bu9 h VAL 73 Cb 1.28 0.38 -0.06 0.00 -2.01 0.00 0.00 31.29 30.88 1bu9 h VAL 73 CO 0.59 0.00 0.60 0.40 -1.01 0.00 0.00 177.57 178.15 1bu9 h ILE 74 N 0.00 1.03 0.00 3.17 2.04 -1.85 0.11 117.51 122.02 1bu9 h ILE 74 Ca 0.36 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1bu9 h ILE 74 Cb 1.92 -0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1bu9 h ILE 74 CO -0.00 0.19 -0.06 0.45 0.00 0.00 0.00 178.15 178.72 1bu9 h HIS 75 N 1.02 -0.18 -0.98 1.37 3.86 0.64 0.41 115.15 121.28 1bu9 h HIS 75 Ca 0.41 0.01 0.34 0.00 -1.16 0.00 0.00 60.37 59.97 1bu9 h HIS 75 Cb 0.27 0.08 -0.17 0.00 1.06 0.00 0.00 27.41 28.65 1bu9 h HIS 75 CO -0.00 -0.07 0.42 -0.44 0.86 0.00 0.00 177.93 178.70 1bu9 h ASP 76 N -0.08 0.20 0.51 2.45 3.32 -1.27 2.52 116.42 124.07 1bu9 h ASP 76 Ca 0.00 0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1bu9 h ASP 76 Cb 0.08 0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1bu9 h ASP 76 CO -0.04 -0.30 -0.24 0.00 -1.72 0.00 0.00 179.24 176.93 1bu9 h ALA 77 N 1.93 -0.92 -0.01 3.45 0.00 0.62 -3.29 119.26 121.04 1bu9 h ALA 77 Ca 0.74 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.48 1bu9 h ALA 77 Cb 1.77 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1bu9 h ALA 77 CO -0.74 -0.87 -0.06 0.00 0.00 0.00 0.00 179.25 177.59 1bu9 h ALA 78 N -1.50 0.02 -0.18 0.00 0.00 0.05 1.03 119.26 118.68 1bu9 h ALA 78 Ca -0.07 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1bu9 h ALA 78 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1bu9 h ALA 78 CO 0.11 -0.10 0.00 -2.13 0.00 0.00 0.00 179.25 177.13 1bu9 n ARG 79 N -4.70 0.00 0.25 0.00 0.63 0.84 -2.25 116.66 111.42 1bu9 n ARG 79 Ca -0.09 0.50 -0.11 0.00 -0.92 0.00 0.00 57.85 57.23 1bu9 n ARG 79 Cb 0.37 -0.77 -0.05 0.00 0.45 0.00 0.00 32.46 32.46 1bu9 n ARG 79 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bu9 h ALA 80 N -0.59 -0.69 0.00 5.13 0.00 -1.72 -3.39 119.26 118.00 1bu9 h ALA 80 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bu9 h ALA 80 Cb 0.00 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1bu9 h ALA 80 CO 0.00 -0.65 0.00 0.41 0.00 0.00 0.00 179.25 179.01 1bu9 n GLY 81 N -0.01 0.00 3.13 0.00 0.00 -0.95 -4.98 105.19 102.37 1bu9 n GLY 81 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1bu9 n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bu9 s PHE 82 N 0.00 3.94 0.02 1.61 0.08 0.35 -4.91 117.98 119.07 1bu9 s PHE 82 Ca 0.00 -2.99 -0.27 0.00 0.12 0.00 0.00 56.93 53.80 1bu9 s PHE 82 Cb 0.00 -3.31 -0.16 0.00 -0.57 0.00 0.00 43.02 38.98 1bu9 s PHE 82 CO 0.00 -0.76 1.24 1.25 -0.10 0.00 0.00 175.22 176.85 1bu9 h LEU 83 N 6.11 -0.57 -1.60 -0.37 5.85 -1.93 0.16 115.31 122.96 1bu9 h LEU 83 Ca 0.16 -0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.92 1bu9 h LEU 83 Cb 0.82 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1bu9 h LEU 83 CO 0.87 -0.22 0.63 0.44 -0.34 0.00 0.00 178.44 179.82 1bu9 h ASP 84 N -0.95 0.00 0.64 1.25 3.32 -1.94 3.17 116.42 121.91 1bu9 h ASP 84 Ca -0.07 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.71 1bu9 h ASP 84 Cb 0.60 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1bu9 h ASP 84 CO 0.11 0.00 -1.29 0.74 -1.72 0.00 0.00 179.24 177.08 1bu9 h THR 85 N 0.00 1.43 0.00 0.35 2.02 -1.63 -2.57 112.91 112.51 1bu9 h THR 85 Ca 0.19 -3.04 -0.03 0.00 0.77 0.00 0.00 66.41 64.30 1bu9 h THR 85 Cb 1.45 2.87 -0.00 0.00 -1.74 0.00 0.00 68.15 70.73 1bu9 h THR 85 CO -0.00 0.88 -0.15 0.25 0.37 0.00 0.00 175.52 176.86 1bu9 h LEU 86 N 0.06 0.00 -0.13 2.58 6.46 0.85 -1.80 115.31 123.32 1bu9 h LEU 86 Ca -0.15 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.55 1bu9 h LEU 86 Cb 1.96 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.88 1bu9 h LEU 86 CO 0.18 0.15 -0.16 1.56 -0.62 0.00 0.00 178.44 179.55 1bu9 h GLN 87 N 0.00 0.34 -0.98 1.25 4.20 -0.10 -1.34 115.11 118.47 1bu9 h GLN 87 Ca -0.00 -0.19 0.28 0.00 0.06 0.00 0.00 58.65 58.80 1bu9 h GLN 87 Cb 0.30 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 1bu9 h GLN 87 CO 0.02 0.76 0.70 1.15 -0.67 0.00 0.00 178.83 180.78 1bu9 h THR 88 N -0.06 0.52 0.09 -0.54 2.02 -0.93 0.44 112.91 114.46 1bu9 h THR 88 Ca 0.02 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1bu9 h THR 88 Cb 0.71 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1bu9 h THR 88 CO 0.04 0.01 -0.04 -0.07 0.37 0.00 0.00 175.52 175.83 1bu9 h LEU 89 N 0.07 -0.10 -0.24 2.58 4.07 -1.19 -2.85 115.31 117.64 1bu9 h LEU 89 Ca 0.48 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.50 1bu9 h LEU 89 Cb 1.80 0.03 -0.07 0.00 1.08 0.00 0.00 40.66 43.49 1bu9 h LEU 89 CO -0.04 0.15 -0.34 0.25 -1.08 0.00 0.00 178.44 177.38 1bu9 h LEU 90 N -0.56 -1.09 -0.94 1.67 7.12 -0.56 0.54 115.31 121.49 1bu9 h LEU 90 Ca -0.01 0.17 0.26 0.00 0.13 0.00 0.00 57.88 58.42 1bu9 h LEU 90 Cb 0.09 0.48 -0.17 0.00 -0.53 0.00 0.00 40.66 40.53 1bu9 h LEU 90 CO 0.02 -0.35 0.07 -0.08 -0.13 0.00 0.00 178.44 177.97 1bu9 h GLU 91 N -0.35 0.05 -1.03 1.25 4.57 -0.28 1.63 114.58 120.42 1bu9 h GLU 91 Ca 0.12 -0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.99 1bu9 h GLU 91 Cb 0.55 -0.01 -0.18 0.00 -0.16 0.00 0.00 28.75 28.95 1bu9 h GLU 91 CO -0.44 0.03 0.40 1.19 -1.18 0.00 0.00 179.01 179.01 1bu9 n PHE 92 N -5.42 1.82 -3.38 0.92 3.72 0.42 -4.87 117.46 110.67 1bu9 n PHE 92 Ca 0.22 -1.35 -0.16 0.00 -0.05 0.00 0.00 57.45 56.10 1bu9 n PHE 92 Cb 0.73 -0.69 0.08 0.00 -0.94 0.00 0.00 39.48 38.66 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 -0.44 -5.19 -2.98 -1.08 6.02 0.55 -4.78 117.38 109.49 1bu9 n GLN 93 Ca 0.36 0.85 -0.43 0.00 -0.01 0.00 0.00 57.00 57.77 1bu9 n GLN 93 Cb 1.16 -5.84 -0.06 0.00 1.02 0.00 0.00 30.24 26.52 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 -3.37 3.29 -0.87 -1.58 0.00 0.16 -4.84 121.76 114.55 1bu9 s ALA 94 Ca 0.15 -1.09 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1bu9 s ALA 94 Cb -0.02 -3.46 -0.22 0.00 0.00 0.00 0.00 23.12 19.42 1bu9 s ALA 94 CO 0.73 -1.95 2.19 -0.25 0.00 0.00 0.00 175.76 176.49 1bu9 n ASP 95 N 6.68 -0.23 0.24 0.00 9.92 -1.26 -4.43 116.55 127.48 1bu9 n ASP 95 Ca 0.01 -0.04 0.18 0.00 -0.53 0.00 0.00 54.79 54.41 1bu9 n ASP 95 Cb 0.48 -0.69 0.83 0.00 -0.64 0.00 0.00 41.12 41.09 1bu9 n ASP 95 CO 0.00 0.00 0.00 1.62 0.13 0.00 0.00 177.20 178.95 1bu9 h VAL 96 N 6.66 0.20 -0.38 2.53 3.04 -1.93 2.33 116.25 128.69 1bu9 h VAL 96 Ca -0.02 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 1bu9 h VAL 96 Cb 1.09 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1bu9 h VAL 96 CO 1.27 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.42 1bu9 n ASN 97 N -3.33 2.17 -4.58 3.17 5.03 -1.26 -4.68 115.26 111.79 1bu9 n ASN 97 Ca 0.02 -1.97 -0.41 0.00 0.87 0.00 0.00 54.58 53.09 1bu9 n ASN 97 Cb 0.42 -0.26 -0.03 0.00 -1.02 0.00 0.00 39.78 38.90 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 -1.49 3.46 0.00 2.41 -1.16 0.78 -4.93 121.20 120.27 1bu9 s ILE 98 Ca 0.28 0.39 0.00 0.00 -0.51 0.00 0.00 60.65 60.81 1bu9 s ILE 98 Cb 0.15 -3.83 0.00 0.00 0.61 0.00 0.00 42.46 39.39 1bu9 s ILE 98 CO 0.20 -0.68 0.00 -0.62 -2.81 0.00 0.00 174.94 171.03 1bu9 n GLU 99 N 8.76 1.03 0.00 3.50 1.02 -1.26 -3.80 120.64 129.89 1bu9 n GLU 99 Ca 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1bu9 n GLU 99 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.91 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 0.71 -1.28 1.62 5.75 0.49 -3.58 116.55 120.26 1bu9 n ASP 100 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.75 1bu9 n ASP 100 Cb 0.00 0.00 0.13 0.00 -1.03 0.00 0.00 41.12 40.22 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 3.14 0.00 -1.12 2.85 -0.96 -4.20 115.26 114.97 1bu9 n ASN 101 Ca 0.00 -2.52 0.00 0.00 -0.11 0.00 0.00 54.58 51.95 1bu9 n ASN 101 Cb 0.00 -0.61 0.00 0.00 1.24 0.00 0.00 39.78 40.41 1bu9 n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1bu9 n GLU 102 N 0.06 0.00 0.00 1.20 1.02 -1.26 -5.04 120.64 116.62 1bu9 n GLU 102 Ca 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1bu9 n GLU 102 Cb 0.80 -0.19 0.00 0.00 -0.02 0.00 0.00 31.44 32.04 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 0.24 0.98 3.47 0.62 0.00 -1.26 -4.04 105.19 105.20 1bu9 n GLY 103 Ca 0.00 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 1bu9 n GLY 103 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bu9 n ASN 104 N 0.00 -1.30 -4.17 1.61 4.13 -1.26 -4.31 115.26 109.96 1bu9 n ASN 104 Ca 0.00 0.51 -0.10 0.00 1.68 0.00 0.00 54.58 56.66 1bu9 n ASN 104 Cb 0.00 -1.24 -0.10 0.00 -1.54 0.00 0.00 39.78 36.90 1bu9 n ASN 104 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1bu9 s LEU 105 N -0.90 2.33 0.64 3.41 2.96 -1.26 -0.38 118.68 125.48 1bu9 s LEU 105 Ca 0.63 -1.07 0.29 0.00 -0.22 0.00 0.00 54.13 53.77 1bu9 s LEU 105 Cb -0.30 0.03 1.55 0.00 0.50 0.00 0.00 46.19 47.97 1bu9 s LEU 105 CO 0.60 -0.55 1.90 1.55 -1.32 0.00 0.00 176.35 178.54 1bu9 h PRO 106 N 2.93 0.00 0.00 0.98 0.13 -1.84 1.27 132.00 135.47 1bu9 h PRO 106 Ca -0.35 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.71 1bu9 h PRO 106 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1bu9 h PRO 106 CO 0.64 0.00 -0.33 1.25 -0.23 0.00 0.00 178.00 179.33 1bu9 h LEU 107 N 0.00 0.00 -0.08 1.56 6.46 -1.90 -1.36 115.31 120.00 1bu9 h LEU 107 Ca 0.07 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.59 1bu9 h LEU 107 Cb 0.85 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.79 1bu9 h LEU 107 CO -0.00 0.33 -1.04 0.45 -0.62 0.00 0.00 178.44 177.56 1bu9 h HIS 108 N 0.00 0.61 0.39 1.25 3.86 0.13 -2.48 115.15 118.92 1bu9 h HIS 108 Ca -0.00 -0.36 -0.02 0.00 -1.16 0.00 0.00 60.37 58.82 1bu9 h HIS 108 Cb 1.04 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.46 1bu9 h HIS 108 CO 0.00 1.21 -0.19 -0.07 0.86 0.00 0.00 177.93 179.74 1bu9 h LEU 109 N 0.19 -0.45 -1.86 2.43 4.07 -1.26 0.51 115.31 118.94 1bu9 h LEU 109 Ca -0.10 0.02 0.34 0.00 0.08 0.00 0.00 57.88 58.22 1bu9 h LEU 109 Cb 1.70 0.12 -0.05 0.00 1.08 0.00 0.00 40.66 43.51 1bu9 h LEU 109 CO 0.18 -0.02 0.95 0.00 -1.08 0.00 0.00 178.44 178.47 1bu9 h ALA 110 N -1.15 3.09 0.20 1.53 0.00 -1.37 2.09 119.26 123.65 1bu9 h ALA 110 Ca -0.05 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.50 1bu9 h ALA 110 Cb 0.41 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.31 1bu9 h ALA 110 CO 0.09 -1.56 -1.40 0.00 0.00 0.00 0.00 179.25 176.38 1bu9 h ALA 111 N 1.22 -0.04 -0.31 0.00 0.00 -1.16 1.26 119.26 120.22 1bu9 h ALA 111 Ca 0.56 -0.88 0.07 0.00 0.00 0.00 0.00 54.91 54.66 1bu9 h ALA 111 Cb 2.46 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 20.29 1bu9 h ALA 111 CO -0.01 0.82 -0.29 0.87 0.00 0.00 0.00 179.25 180.64 1bu9 h LYS 112 N 0.12 -0.26 -0.20 0.00 1.79 0.85 -0.80 116.57 118.06 1bu9 h LYS 112 Ca -0.21 0.02 -0.20 0.00 -2.18 0.00 0.00 60.65 58.08 1bu9 h LYS 112 Cb 2.09 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 32.80 1bu9 h LYS 112 CO 0.24 -0.17 -0.66 0.93 -1.08 0.00 0.00 179.45 178.71 1bu9 h GLU 113 N -0.27 0.77 0.00 3.15 4.39 -1.50 -3.46 114.58 117.66 1bu9 h GLU 113 Ca 0.15 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1bu9 h GLU 113 Cb 0.51 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1bu9 h GLU 113 CO -0.46 1.17 0.00 0.41 -1.16 0.00 0.00 179.01 178.97 1bu9 n GLY 114 N 0.50 1.76 3.46 -3.84 0.00 0.08 -4.94 105.19 102.21 1bu9 n GLY 114 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.83 0.50 0.00 1.61 8.25 0.41 -4.74 115.22 120.41 1bu9 n HIS 115 Ca 0.00 -0.65 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 1bu9 n HIS 115 Cb 0.00 -1.26 0.00 0.00 1.12 0.00 0.00 29.99 29.85 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 10.86 0.00 -0.70 2.41 0.00 -1.26 0.65 117.00 128.96 1bu9 n LEU 116 Ca 0.46 0.61 0.53 0.00 0.00 0.00 0.00 56.01 57.61 1bu9 n LEU 116 Cb 0.43 -0.11 0.81 0.00 0.00 0.00 0.00 43.42 44.56 1bu9 n LEU 116 CO 1.06 -0.11 1.47 -2.11 0.00 0.00 0.00 177.39 177.70 1bu9 n ARG 117 N -1.18 -0.00 0.00 1.96 -4.01 -1.26 0.22 116.66 112.38 1bu9 n ARG 117 Ca 0.00 1.09 0.00 0.00 -1.04 0.00 0.00 57.85 57.90 1bu9 n ARG 117 Cb 0.00 -2.49 0.00 0.00 -3.04 0.00 0.00 32.46 26.93 1bu9 n ARG 117 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1bu9 n VAL 118 N -3.95 0.00 -0.10 8.89 0.31 0.04 -1.98 118.33 121.54 1bu9 n VAL 118 Ca 0.44 0.80 0.15 0.00 -0.01 0.00 0.00 64.34 65.71 1bu9 n VAL 118 Cb 1.99 -1.77 0.53 0.00 -0.91 0.00 0.00 33.84 33.69 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 0.83 -0.11 2.52 2.07 0.18 0.87 116.25 122.61 1bu9 h VAL 119 Ca 0.00 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.43 1bu9 h VAL 119 Cb 0.00 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1bu9 h VAL 119 CO 0.00 0.06 0.11 -0.08 0.02 0.00 0.00 177.57 177.69 1bu9 h GLU 120 N 0.35 0.00 0.15 1.57 4.22 0.25 -2.62 114.58 118.51 1bu9 h GLU 120 Ca 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.74 1bu9 h GLU 120 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1bu9 h GLU 120 CO -0.08 0.00 -0.07 0.35 -2.18 0.00 0.00 179.01 177.02 1bu9 h PHE 121 N 0.00 -0.19 -0.71 0.92 3.04 0.14 -2.41 116.94 117.73 1bu9 h PHE 121 Ca 0.05 -0.00 0.20 0.00 3.98 0.00 0.00 57.97 62.20 1bu9 h PHE 121 Cb 0.28 0.06 -0.03 0.00 2.56 0.00 0.00 35.95 38.82 1bu9 h PHE 121 CO 0.00 0.16 0.90 -0.07 -2.02 0.00 0.00 178.31 177.27 1bu9 h LEU 122 N -0.97 0.00 0.00 0.59 4.07 -1.36 1.76 115.31 119.40 1bu9 h LEU 122 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1bu9 h LEU 122 Cb 0.43 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.17 1bu9 h LEU 122 CO 0.03 0.00 -1.27 0.55 -1.08 0.00 0.00 178.44 176.68 1bu9 n VAL 123 N -3.33 0.51 -0.43 1.22 3.14 -1.11 -2.75 118.33 115.57 1bu9 n VAL 123 Ca 0.15 -0.55 0.10 0.00 -2.96 0.00 0.00 64.34 61.08 1bu9 n VAL 123 Cb 1.13 -0.28 0.30 0.00 -1.06 0.00 0.00 33.84 33.93 1bu9 n VAL 123 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1bu9 n LYS 124 N -2.59 3.06 0.17 1.45 4.81 0.59 -4.70 118.16 120.95 1bu9 n LYS 124 Ca -0.02 -2.63 0.00 0.00 -0.87 0.00 0.00 58.31 54.79 1bu9 n LYS 124 Cb 0.57 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 34.00 1bu9 n LYS 124 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1bu9 n HIS 125 N 1.22 -3.42 0.00 5.64 8.25 -0.66 -5.03 115.22 121.22 1bu9 n HIS 125 Ca 0.23 0.94 0.00 0.00 -0.26 0.00 0.00 57.72 58.63 1bu9 n HIS 125 Cb 0.68 2.22 0.00 0.00 1.12 0.00 0.00 29.99 34.01 1bu9 n HIS 125 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1bu9 n THR 126 N -3.31 0.00 0.04 1.59 -2.24 -1.23 -4.81 114.28 104.32 1bu9 n THR 126 Ca 0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1bu9 n THR 126 Cb 0.00 -0.31 0.20 0.00 -2.10 0.00 0.00 70.33 68.13 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 -3.00 3.23 -1.23 6.98 0.00 -1.26 -4.89 120.51 120.34 1bu9 n ALA 127 Ca 0.00 -0.98 0.12 0.00 0.00 0.00 0.00 53.44 52.58 1bu9 n ALA 127 Cb 0.00 -1.07 -0.07 0.00 0.00 0.00 0.00 19.45 18.31 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 0.29 -5.85 -2.57 0.00 7.64 -1.11 -4.63 113.62 107.39 1bu9 n SER 128 Ca 0.15 1.12 -0.31 0.00 1.01 0.00 0.00 58.87 60.83 1bu9 n SER 128 Cb 0.74 -4.12 0.02 0.00 -1.01 0.00 0.00 64.21 59.84 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 -3.89 5.77 -3.35 6.43 6.94 -1.26 -4.81 115.26 121.10 1bu9 n ASN 129 Ca -0.07 -3.76 -0.30 0.00 -0.02 0.00 0.00 54.58 50.43 1bu9 n ASN 129 Cb 0.50 -0.67 -0.06 0.00 -2.36 0.00 0.00 39.78 37.19 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 -0.54 0.90 0.00 3.53 0.24 -1.25 -1.76 118.33 119.44 1bu9 n VAL 130 Ca 0.45 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 1bu9 n VAL 130 Cb 0.55 -1.99 0.00 0.00 -1.47 0.00 0.00 33.84 30.93 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 4.42 -0.64 3.47 7.63 0.00 -1.17 -4.92 105.19 113.97 1bu9 n GLY 131 Ca 0.36 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.02 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 0.69 -2.37 1.61 -0.00 -0.72 -4.86 115.22 109.56 1bu9 n HIS 132 Ca 0.00 -0.67 -0.43 0.00 -0.00 0.00 0.00 57.72 56.62 1bu9 n HIS 132 Cb 0.00 -1.49 -0.02 0.00 -0.00 0.00 0.00 29.99 28.48 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 7.06 4.27 0.00 1.57 0.52 -1.26 -2.84 118.95 128.28 1bu9 s ARG 133 Ca 0.71 1.75 0.00 0.00 -0.52 0.00 0.00 55.73 57.66 1bu9 s ARG 133 Cb 0.09 -3.69 0.00 0.00 0.52 0.00 0.00 34.95 31.87 1bu9 s ARG 133 CO 0.26 -0.62 0.00 0.27 0.02 0.00 0.00 175.30 175.23 1bu9 n ASN 134 N 6.03 -0.14 -0.02 0.23 0.23 -1.20 -4.46 115.26 115.93 1bu9 n ASN 134 Ca 0.13 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 54.09 1bu9 n ASN 134 Cb 0.45 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.12 1bu9 n ASN 134 CO 0.00 0.00 0.00 -0.74 -0.93 0.00 0.00 177.26 175.59 1bu9 h HIS 135 N -0.95 -0.26 -0.10 -2.53 2.76 -1.76 -2.11 115.15 110.20 1bu9 h HIS 135 Ca 0.00 0.02 -0.23 0.00 -2.20 0.00 0.00 60.37 57.96 1bu9 h HIS 135 Cb 0.00 0.14 0.01 0.00 1.55 0.00 0.00 27.41 29.12 1bu9 h HIS 135 CO 0.00 -0.16 -0.86 -0.22 -1.30 0.00 0.00 177.93 175.39 1bu9 h LYS 136 N -0.10 0.74 0.00 5.26 3.64 -1.91 -3.48 116.57 120.72 1bu9 h LYS 136 Ca 0.10 -0.65 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 1bu9 h LYS 136 Cb 0.25 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1bu9 h LYS 136 CO -0.24 1.25 0.00 0.41 -2.27 0.00 0.00 179.45 178.61 1bu9 n GLY 137 N 0.81 0.53 3.56 5.01 0.00 -0.79 -5.02 105.19 109.28 1bu9 n GLY 137 Ca -0.08 0.00 -0.17 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 -0.53 4.22 1.18 1.61 1.01 -1.26 -3.70 116.67 119.19 1bu9 s ASP 138 Ca 0.00 -0.21 -0.15 0.00 0.71 0.00 0.00 52.55 52.91 1bu9 s ASP 138 Cb 0.00 -2.55 0.23 0.00 1.01 0.00 0.00 42.92 41.60 1bu9 s ASP 138 CO 0.00 -3.60 0.51 0.35 0.21 0.00 0.00 175.17 172.64 1bu9 n THR 139 N 8.55 0.00 0.09 -1.27 -2.24 -1.25 -3.22 114.28 114.93 1bu9 n THR 139 Ca 0.45 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 62.24 1bu9 n THR 139 Cb 0.44 -0.58 0.05 0.00 -2.10 0.00 0.00 70.33 68.13 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 -4.54 1.35 -0.11 6.98 0.00 -1.13 -1.91 120.51 121.15 1bu9 n ALA 140 Ca -0.12 -0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.11 1bu9 n ALA 140 Cb 0.36 -1.03 -0.12 0.00 0.00 0.00 0.00 19.45 18.66 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 -3.48 0.00 -0.06 0.00 9.92 -0.80 -1.25 116.55 120.88 1bu9 n ASP 142 Ca -0.44 0.46 -0.04 0.00 -0.53 0.00 0.00 54.79 54.24 1bu9 n ASP 142 Cb 0.98 -0.48 -0.01 0.00 -0.64 0.00 0.00 41.12 40.96 1bu9 n ASP 142 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1bu9 n LEU 143 N -1.48 1.39 0.30 0.64 4.77 -0.88 -3.13 117.00 118.61 1bu9 n LEU 143 Ca 0.04 0.45 0.19 0.00 -0.03 0.00 0.00 56.01 56.66 1bu9 n LEU 143 Cb 0.15 -0.75 0.99 0.00 -2.33 0.00 0.00 43.42 41.48 1bu9 n LEU 143 CO 0.12 -0.44 1.16 0.00 -1.33 0.00 0.00 177.39 176.90 1bu9 h ALA 144 N -1.25 1.35 0.42 -1.18 0.00 -1.54 -0.91 119.26 116.14 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 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1bu9 h ALA 144 CO 0.00 -0.17 -0.20 -0.09 0.00 0.00 0.00 179.25 178.79 1bu9 h ARG 145 N 0.00 -0.54 -0.83 0.00 1.12 -1.33 0.54 114.38 113.35 1bu9 h ARG 145 Ca 0.02 0.04 0.05 0.00 -1.11 0.00 0.00 59.98 58.98 1bu9 h ARG 145 Cb 0.31 0.12 -0.05 0.00 -0.01 0.00 0.00 29.97 30.34 1bu9 h ARG 145 CO -0.00 -0.36 0.54 -0.07 -3.11 0.00 0.00 179.97 176.97 1bu9 h LEU 146 N -1.15 0.83 -0.00 3.80 3.38 -1.37 0.14 115.31 120.95 1bu9 h LEU 146 Ca -0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1bu9 h LEU 146 Cb 0.43 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1bu9 h LEU 146 CO 0.09 0.55 0.00 -1.22 0.09 0.00 0.00 178.44 177.95 1bu9 n TYR 147 N -4.47 0.00 0.00 1.13 4.01 -0.40 -4.83 117.16 112.60 1bu9 n TYR 147 Ca 0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.86 1bu9 n TYR 147 Cb 0.17 -0.50 0.00 0.00 -0.31 0.00 0.00 39.34 38.70 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 -0.16 3.36 3.54 2.72 0.00 0.49 -4.97 105.19 110.16 1bu9 n GLY 148 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1bu9 n GLY 148 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bu9 n ARG 149 N -1.51 0.12 -0.03 1.61 3.00 0.19 -4.64 116.66 115.40 1bu9 n ARG 149 Ca 0.00 -1.43 -0.14 0.00 -0.01 0.00 0.00 57.85 56.27 1bu9 n ARG 149 Cb 0.00 -3.31 -0.10 0.00 0.00 0.00 0.00 32.46 29.06 1bu9 n ARG 149 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.63 174.68 1bu9 h ASN 150 N 10.83 0.24 -1.25 0.55 7.08 -1.87 -1.03 115.58 130.14 1bu9 h ASN 150 Ca 0.13 -0.61 0.37 0.00 -3.08 0.00 0.00 56.30 53.10 1bu9 h ASN 150 Cb 0.86 -0.07 -0.10 0.00 -2.08 0.00 0.00 38.32 36.93 1bu9 h ASN 150 CO 1.48 0.82 0.83 -0.33 -2.08 0.00 0.00 177.43 178.14 1bu9 h GLU 151 N -0.31 0.17 0.05 4.14 4.39 -1.93 2.50 114.58 123.58 1bu9 h GLU 151 Ca -0.01 -0.01 -0.26 0.00 0.34 0.00 0.00 59.36 59.42 1bu9 h GLU 151 Cb 0.79 -0.04 0.02 0.00 -0.10 0.00 0.00 28.75 29.42 1bu9 h GLU 151 CO 0.04 0.11 -1.09 0.28 -1.16 0.00 0.00 179.01 177.19 1bu9 h VAL 152 N 0.17 1.34 0.33 3.13 2.07 -1.80 -1.66 116.25 119.83 1bu9 h VAL 152 Ca 0.70 -2.44 -0.02 0.00 0.82 0.00 0.00 66.70 65.77 1bu9 h VAL 152 Cb 2.24 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 34.55 1bu9 h VAL 152 CO -0.27 0.74 -0.16 0.58 0.02 0.00 0.00 177.57 178.48 1bu9 h VAL 153 N 0.28 0.00 -1.02 2.57 2.07 0.52 -2.93 116.25 117.74 1bu9 h VAL 153 Ca -0.13 -0.12 0.27 0.00 0.82 0.00 0.00 66.70 67.53 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 0.20 0.00 0.62 -1.28 0.02 0.00 0.00 177.57 177.13 1bu9 h SER 154 N -0.57 0.59 -0.82 0.57 0.87 0.70 0.77 113.55 115.67 1bu9 h SER 154 Ca -0.05 0.13 0.20 0.00 -1.23 0.00 0.00 61.79 60.84 1bu9 h SER 154 Cb 0.34 0.04 -0.14 0.00 -0.44 0.00 0.00 62.40 62.21 1bu9 h SER 154 CO 0.08 0.06 0.05 0.25 -0.53 0.00 0.00 176.83 176.74 1bu9 h LEU 155 N 0.49 -0.30 0.00 2.23 7.12 -1.12 1.46 115.31 125.20 1bu9 h LEU 155 Ca 0.65 0.21 -0.08 0.00 0.13 0.00 0.00 57.88 58.79 1bu9 h LEU 155 Cb 1.39 0.35 -0.01 0.00 -0.53 0.00 0.00 40.66 41.85 1bu9 h LEU 155 CO -0.45 -0.20 -0.76 0.23 -0.13 0.00 0.00 178.44 177.13 1bu9 n MET 156 N -5.34 0.49 -0.30 1.25 2.81 0.17 -2.43 117.12 113.76 1bu9 n MET 156 Ca 0.16 0.55 0.14 0.00 -1.81 0.00 0.00 57.70 56.74 1bu9 n MET 156 Cb 0.55 -1.71 0.31 0.00 -0.71 0.00 0.00 33.22 31.66 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 0.27 -0.30 0.03 4.20 0.44 0.70 115.11 119.45 1bu9 h GLN 157 Ca -0.12 -0.02 -0.13 0.00 0.06 0.00 0.00 58.65 58.44 1bu9 h GLN 157 Cb 0.77 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.49 1bu9 h GLN 157 CO -0.07 0.18 -0.33 0.00 -0.67 0.00 0.00 178.83 177.94 1bu9 h ALA 158 N 1.76 0.45 -0.08 3.87 0.00 0.19 -3.07 119.26 122.38 1bu9 h ALA 158 Ca 0.57 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1bu9 h ALA 158 Cb 1.15 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1bu9 h ALA 158 CO -0.61 0.49 -0.00 0.09 0.00 0.00 0.00 179.25 179.22 1bu9 n ASN 159 N -4.21 5.51 -4.44 0.00 3.02 0.17 -4.74 115.26 110.56 1bu9 n ASN 159 Ca -0.04 -2.53 -0.41 0.00 -0.03 0.00 0.00 54.58 51.57 1bu9 n ASN 159 Cb 0.50 -1.18 -0.06 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 1.51 -0.42 0.00 7.41 0.00 -0.91 -4.73 105.19 108.06 1bu9 n GLY 160 Ca 0.13 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -4.14 1.89 -1.00 4.61 0.00 0.19 -4.65 120.51 117.42 1bu9 n ALA 161 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1bu9 n ALA 161 Cb 0.46 0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 2.70 -1.38 0.00 0.00 0.00 -0.79 -3.06 105.19 102.66 1bu9 n GLY 162 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.77 2.50 1.83 -0.02 0.00 -1.26 -4.39 105.19 104.62 1bu9 n GLY 163 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.00 3.32 -1.26 4.61 0.00 -1.26 -4.98 120.51 117.94 1bu9 n ALA 164 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1bu9 n ALA 164 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1bu9 n ALA 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1bu9 n THR 165 N -0.74 -4.40 -3.82 0.00 -1.04 -1.26 -5.09 114.28 97.94 1bu9 n THR 165 Ca -0.22 1.89 -0.06 0.00 -2.04 0.00 0.00 64.05 63.62 1bu9 n THR 165 Cb 0.80 -2.62 0.00 0.00 -1.82 0.00 0.00 70.33 66.69 1bu9 n THR 165 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1bu9 s ASN 166 N -2.91 -0.11 -1.14 8.00 4.22 -1.26 -5.00 114.94 116.74 1bu9 s ASN 166 Ca 0.00 -0.72 -0.03 0.00 -2.14 0.00 0.00 52.86 49.97 1bu9 s ASN 166 Cb 0.00 0.66 -0.03 0.00 1.28 0.00 0.00 41.25 43.16 1bu9 s ASN 166 CO 0.00 -1.26 0.94 -0.11 -2.04 0.00 0.00 177.10 174.63 1bu9 n LEU 167 N -0.53 -4.63 -0.04 3.54 0.00 -1.26 -5.31 117.00 108.77 1bu9 n LEU 167 Ca -0.06 -0.68 0.00 0.00 0.00 0.00 0.00 56.01 55.27 1bu9 n LEU 167 Cb 0.60 -3.11 0.00 0.00 0.00 0.00 0.00 43.42 40.91 1bu9 n LEU 167 CO 0.19 0.27 0.26 1.67 0.00 0.00 0.00 177.39 179.78