#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 -2.90 -2.70 3.04 0.00 -1.26 -5.03 120.51 111.67 1bu9 n ALA 2 Ca 0.00 0.80 -0.04 0.00 0.00 0.00 0.00 53.44 54.20 1bu9 n ALA 2 Cb 0.00 -2.78 0.04 0.00 0.00 0.00 0.00 19.45 16.71 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 -0.55 0.28 0.00 0.00 2.13 -1.26 -5.16 120.64 116.08 1bu9 n GLU 3 Ca 0.08 -1.13 0.00 0.00 0.66 0.00 0.00 57.16 56.77 1bu9 n GLU 3 Cb 0.39 -0.48 0.00 0.00 0.27 0.00 0.00 31.44 31.62 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 2.27 1.10 0.00 5.31 -0.04 -1.26 -4.27 135.00 138.11 1bu9 n PRO 4 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1bu9 n PRO 4 Cb 0.64 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.10 1bu9 n PRO 4 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1bu9 n TRP 5 N -0.09 0.00 -0.56 0.54 -0.00 -1.26 -3.22 117.44 112.85 1bu9 n TRP 5 Ca 0.00 0.00 0.44 0.00 -0.00 0.00 0.00 57.50 57.94 1bu9 n TRP 5 Cb 0.00 0.02 0.70 0.00 -0.00 0.00 0.00 31.31 32.02 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 -0.85 0.20 5.87 0.00 -1.26 0.37 105.19 109.52 1bu9 n GLY 6 Ca 0.00 0.66 0.06 0.00 0.00 0.00 0.00 46.02 46.74 1bu9 n GLY 6 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1bu9 h ASN 7 N 0.00 0.00 0.00 1.61 -0.73 -1.73 -3.18 115.58 111.56 1bu9 h ASN 7 Ca 0.84 0.00 0.00 0.00 1.87 0.00 0.00 56.30 59.01 1bu9 h ASN 7 Cb 3.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 41.68 1bu9 h ASN 7 CO -0.18 0.34 -0.53 1.21 -0.37 0.00 0.00 177.43 177.90 1bu9 n GLU 8 N -3.65 0.34 0.00 6.67 4.07 1.19 -3.80 120.64 125.47 1bu9 n GLU 8 Ca -0.01 0.30 0.00 0.00 -0.06 0.00 0.00 57.16 57.39 1bu9 n GLU 8 Cb 0.45 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.55 1bu9 n GLU 8 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1bu9 n LEU 9 N -3.89 0.00 -0.25 4.31 4.77 -0.46 0.14 117.00 121.62 1bu9 n LEU 9 Ca -0.07 0.68 0.32 0.00 -0.03 0.00 0.00 56.01 56.91 1bu9 n LEU 9 Cb 0.27 -0.18 0.62 0.00 -2.33 0.00 0.00 43.42 41.80 1bu9 n LEU 9 CO 0.11 -0.18 1.29 0.00 -1.33 0.00 0.00 177.39 177.28 1bu9 h ALA 10 N -1.69 2.98 -3.00 -1.18 0.00 -1.79 0.98 119.26 115.56 1bu9 h ALA 10 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bu9 h ALA 10 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1bu9 h ALA 10 CO 0.00 -1.61 0.00 0.45 0.00 0.00 0.00 179.25 178.09 1bu9 n SER 11 N -3.59 0.00 0.31 0.00 2.88 0.38 -1.52 113.62 112.09 1bu9 n SER 11 Ca 0.24 0.26 -0.17 0.00 -1.33 0.00 0.00 58.87 57.87 1bu9 n SER 11 Cb 1.39 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.76 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 -0.77 -0.72 -1.46 0.00 0.14 0.42 119.26 114.87 1bu9 h ALA 12 Ca 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.87 1bu9 h ALA 12 Cb 0.00 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 17.97 1bu9 h ALA 12 CO 0.00 -0.93 -0.30 0.00 0.00 0.00 0.00 179.25 178.02 1bu9 h ALA 13 N -0.32 0.18 -0.32 0.00 0.00 0.82 0.97 119.26 120.59 1bu9 h ALA 13 Ca -0.07 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1bu9 h ALA 13 Cb 0.59 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1bu9 h ALA 13 CO 0.12 -0.58 0.00 0.00 0.00 0.00 0.00 179.25 178.79 1bu9 n ALA 14 N -3.24 2.81 0.36 0.00 0.00 -0.57 0.26 120.51 120.12 1bu9 n ALA 14 Ca 0.07 -0.77 0.04 0.00 0.00 0.00 0.00 53.44 52.78 1bu9 n ALA 14 Cb 0.38 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 0.42 1.08 0.00 0.00 3.00 0.32 -4.53 116.66 116.95 1bu9 n ARG 15 Ca 0.13 -0.80 0.00 0.00 -0.00 0.00 0.00 57.85 57.18 1bu9 n ARG 15 Cb 0.50 -1.10 0.00 0.00 0.00 0.00 0.00 32.46 31.86 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 0.63 2.63 3.43 5.14 0.00 -0.29 -4.99 105.19 111.73 1bu9 n GLY 16 Ca 0.04 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.52 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 1.81 -0.07 1.61 9.92 -0.40 -4.84 116.55 124.59 1bu9 n ASP 17 Ca 0.00 0.56 -0.06 0.00 -0.53 0.00 0.00 54.79 54.77 1bu9 n ASP 17 Cb 0.00 -1.15 -0.02 0.00 -0.64 0.00 0.00 41.12 39.30 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 10.88 0.00 -0.86 0.64 7.12 -1.94 -3.35 115.31 127.80 1bu9 h LEU 18 Ca -0.25 -0.07 -0.01 0.00 0.13 0.00 0.00 57.88 57.67 1bu9 h LEU 18 Cb 1.35 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 41.43 1bu9 h LEU 18 CO 1.03 0.78 0.49 -0.33 -0.13 0.00 0.00 178.44 180.28 1bu9 h GLU 19 N -1.00 1.19 -0.74 1.25 5.08 -2.00 -2.37 114.58 115.99 1bu9 h GLU 19 Ca -0.03 -0.13 0.16 0.00 -1.00 0.00 0.00 59.36 58.36 1bu9 h GLU 19 Cb 0.49 -0.24 -0.13 0.00 0.50 0.00 0.00 28.75 29.37 1bu9 h GLU 19 CO -0.02 0.86 -0.05 0.37 -1.00 0.00 0.00 179.01 179.17 1bu9 h GLN 20 N 1.20 0.07 -0.54 2.33 4.15 -1.96 0.65 115.11 121.00 1bu9 h GLN 20 Ca 0.31 -0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.81 1bu9 h GLN 20 Cb -0.01 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.60 1bu9 h GLN 20 CO -0.05 0.05 0.17 -0.07 -1.93 0.00 0.00 178.83 176.99 1bu9 h LEU 21 N 0.07 0.13 0.45 -2.39 3.38 -1.55 1.35 115.31 116.75 1bu9 h LEU 21 Ca 0.39 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.42 1bu9 h LEU 21 Cb 0.67 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1bu9 h LEU 21 CO -0.68 0.10 -0.42 0.74 0.09 0.00 0.00 178.44 178.26 1bu9 h THR 22 N 0.33 0.00 -0.06 0.22 2.02 0.30 1.49 112.91 117.21 1bu9 h THR 22 Ca 0.27 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.46 1bu9 h THR 22 Cb 0.33 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.73 1bu9 h THR 22 CO -0.29 0.00 0.06 -1.28 0.37 0.00 0.00 175.52 174.38 1bu9 h SER 23 N -0.87 0.00 1.34 4.18 0.87 -0.63 0.11 113.55 118.55 1bu9 h SER 23 Ca -0.06 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.38 1bu9 h SER 23 Cb 0.74 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.69 1bu9 h SER 23 CO -0.04 0.00 -0.58 -0.07 -0.53 0.00 0.00 176.83 175.61 1bu9 h LEU 24 N 0.00 0.00 0.06 2.23 -0.00 0.35 -3.21 115.31 114.74 1bu9 h LEU 24 Ca 0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.80 1bu9 h LEU 24 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.81 1bu9 h LEU 24 CO -0.00 0.58 -0.52 0.25 -0.00 0.00 0.00 178.44 178.76 1bu9 h LEU 25 N 0.00 0.20 -1.97 1.67 5.85 0.45 -3.09 115.31 118.42 1bu9 h LEU 25 Ca -0.01 -0.93 0.04 0.00 0.84 0.00 0.00 57.88 57.82 1bu9 h LEU 25 Cb 1.41 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 1bu9 h LEU 25 CO 0.08 1.23 0.38 0.06 -0.34 0.00 0.00 178.44 179.85 1bu9 h GLN 26 N -0.72 0.00 0.00 1.25 3.07 -1.30 -2.98 115.11 114.43 1bu9 h GLN 26 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.63 1bu9 h GLN 26 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.88 1bu9 h GLN 26 CO 0.04 0.00 0.00 -1.71 0.09 0.00 0.00 178.83 177.25 1bu9 n ASN 27 N -3.16 0.00 0.00 0.06 2.85 -1.20 -5.07 115.26 108.74 1bu9 n ASN 27 Ca 0.01 0.14 0.00 0.00 -0.11 0.00 0.00 54.58 54.62 1bu9 n ASN 27 Cb 0.47 -0.05 0.00 0.00 1.24 0.00 0.00 39.78 41.43 1bu9 n ASN 27 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1bu9 n ASN 28 N -0.66 0.00 -3.15 1.20 5.15 -1.13 -5.13 115.26 111.54 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 0.00 -0.55 -0.95 3.44 -7.23 -1.26 -4.87 120.40 108.97 1bu9 s VAL 29 Ca 0.00 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.03 1bu9 s VAL 29 Cb 0.00 -0.72 -0.29 0.00 0.56 0.00 0.00 36.38 35.92 1bu9 s VAL 29 CO 0.00 0.00 2.18 -3.20 -0.31 0.00 0.00 175.10 173.77 1bu9 n ASN 30 N 5.32 -0.98 0.19 4.85 5.15 -1.26 -4.61 115.26 123.92 1bu9 n ASN 30 Ca 0.03 -0.35 0.18 0.00 -0.60 0.00 0.00 54.58 53.84 1bu9 n ASN 30 Cb 0.55 -0.60 0.75 0.00 -0.53 0.00 0.00 39.78 39.95 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 6.91 0.20 -0.19 3.44 2.07 -1.95 3.88 116.25 130.61 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 1.12 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1bu9 h VAL 31 CO 1.49 0.00 0.00 0.59 0.02 0.00 0.00 177.57 179.67 1bu9 n ASN 32 N -3.33 1.49 -2.94 0.57 5.03 -1.26 -4.31 115.26 110.52 1bu9 n ASN 32 Ca 0.04 -1.76 0.00 0.00 0.87 0.00 0.00 54.58 53.73 1bu9 n ASN 32 Cb 0.56 -0.12 0.00 0.00 -1.02 0.00 0.00 39.78 39.20 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 0.23 0.00 -2.85 5.41 0.00 1.28 -4.86 120.51 119.72 1bu9 n ALA 33 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.61 1bu9 n ALA 33 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1bu9 n ALA 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1bu9 s GLN 34 N -0.14 0.16 0.00 0.00 0.74 -1.26 -4.06 119.66 115.10 1bu9 s GLN 34 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 55.36 55.39 1bu9 s GLN 34 Cb 0.00 0.03 0.00 0.00 1.10 0.00 0.00 33.01 34.14 1bu9 s GLN 34 CO 0.00 -0.24 0.00 0.27 -0.55 0.00 0.00 175.29 174.77 1bu9 n ASN 35 N 4.01 -1.23 -2.70 6.67 0.23 -1.09 -4.63 115.26 116.52 1bu9 n ASN 35 Ca 0.06 -0.01 -0.17 0.00 -0.53 0.00 0.00 54.58 53.93 1bu9 n ASN 35 Cb 0.62 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.26 1bu9 n ASN 35 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bu9 n GLY 36 N 0.10 2.87 0.35 4.83 0.00 -1.26 -3.05 105.19 109.03 1bu9 n GLY 36 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1bu9 n GLY 36 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1bu9 n PHE 37 N 3.38 0.00 -4.12 1.61 -0.00 -1.26 -5.00 117.46 112.07 1bu9 n PHE 37 Ca 0.41 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.57 1bu9 n PHE 37 Cb 0.38 0.19 -0.05 0.00 -0.00 0.00 0.00 39.48 40.00 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 0.00 -0.21 3.58 7.13 0.00 -1.17 -4.06 105.19 110.46 1bu9 n GLY 38 Ca 0.00 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 -6.89 0.75 0.44 1.61 1.04 -1.26 -1.61 118.95 113.02 1bu9 s ARG 39 Ca 0.08 1.00 0.08 0.00 -1.04 0.00 0.00 55.73 55.85 1bu9 s ARG 39 Cb -0.05 0.30 0.00 0.00 -2.04 0.00 0.00 34.95 33.17 1bu9 s ARG 39 CO 0.93 -0.11 0.48 0.95 -0.04 0.00 0.00 175.30 177.52 1bu9 s THR 40 N 0.72 2.69 -1.01 4.99 -4.23 -1.26 -2.66 115.64 114.88 1bu9 s THR 40 Ca -0.03 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1bu9 s THR 40 Cb -0.05 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.91 1bu9 s THR 40 CO -0.05 0.00 0.79 0.00 -0.54 0.00 0.00 174.62 174.82 1bu9 n ALA 41 N -1.73 0.91 0.04 3.99 0.00 -1.26 -1.10 120.51 121.37 1bu9 n ALA 41 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.30 1bu9 n ALA 41 Cb 0.61 -0.82 -0.12 0.00 0.00 0.00 0.00 19.45 19.12 1bu9 n ALA 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bu9 h LEU 42 N 0.00 0.66 0.00 0.00 -0.00 -1.92 2.77 115.31 116.81 1bu9 h LEU 42 Ca 0.00 -0.81 0.00 0.00 -0.00 0.00 0.00 57.88 57.07 1bu9 h LEU 42 Cb 0.14 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 40.60 1bu9 h LEU 42 CO 0.00 1.40 0.00 0.00 -0.00 0.00 0.00 178.44 179.84 1bu9 n GLN 43 N -4.05 0.96 0.00 1.13 3.00 -0.25 -3.65 117.38 114.52 1bu9 n GLN 43 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 1bu9 n GLN 43 Cb 0.81 -1.20 0.00 0.00 0.00 0.00 0.00 30.24 29.86 1bu9 n GLN 43 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 1bu9 n VAL 44 N -0.70 0.00 -0.85 5.09 0.24 -1.14 -4.91 118.33 116.06 1bu9 n VAL 44 Ca 0.09 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.17 1bu9 n VAL 44 Cb 0.04 -0.38 -0.09 0.00 -1.47 0.00 0.00 33.84 31.94 1bu9 n VAL 44 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 1bu9 n MET 45 N -1.41 0.00 -0.51 7.34 0.00 0.93 -3.75 117.12 119.72 1bu9 n MET 45 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 57.70 57.62 1bu9 n MET 45 Cb 0.23 -0.83 -0.07 0.00 0.00 0.00 0.00 33.22 32.54 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 4.70 0.00 0.28 3.17 3.00 0.73 -4.59 118.16 125.45 1bu9 n LYS 46 Ca 0.38 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.80 1bu9 n LYS 46 Cb 0.02 -0.36 0.61 0.00 0.00 0.00 0.00 35.03 35.29 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 3.78 0.00 -0.82 3.14 -0.00 -1.88 -1.71 115.31 117.82 1bu9 h LEU 47 Ca 0.01 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 57.97 1bu9 h LEU 47 Cb 0.39 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 40.94 1bu9 h LEU 47 CO 0.54 0.00 -0.58 1.23 -0.00 0.00 0.00 178.44 179.63 1bu9 h GLY 48 N 0.00 -0.90 -5.26 0.83 0.00 -1.96 -3.28 103.07 92.51 1bu9 h GLY 48 Ca 0.00 0.78 -0.60 0.00 0.00 0.00 0.00 47.33 47.51 1bu9 h GLY 48 CO 0.00 -0.00 -0.21 0.54 0.00 0.00 0.00 176.54 176.87 1bu9 s ASN 49 N -5.36 6.72 0.18 0.19 2.20 -0.64 -4.92 114.94 113.32 1bu9 s ASN 49 Ca -0.13 0.86 0.22 0.00 -0.94 0.00 0.00 52.86 52.88 1bu9 s ASN 49 Cb 0.10 -2.25 -0.03 0.00 -2.00 0.00 0.00 41.25 37.07 1bu9 s ASN 49 CO 0.61 0.22 0.99 -0.81 -2.94 0.00 0.00 177.10 175.18 1bu9 n PRO 50 N 2.51 0.61 0.25 3.55 -0.04 -1.24 -3.49 135.00 137.16 1bu9 n PRO 50 Ca -0.12 0.10 0.13 0.00 -0.04 0.00 0.00 63.50 63.57 1bu9 n PRO 50 Cb 0.52 -1.81 0.59 0.00 -0.04 0.00 0.00 33.50 32.76 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 -0.76 0.54 4.11 -1.92 -3.01 114.58 113.55 1bu9 h GLU 51 Ca -0.01 0.00 0.08 0.00 0.07 0.00 0.00 59.36 59.50 1bu9 h GLU 51 Cb 1.02 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.16 1bu9 h GLU 51 CO 0.00 0.14 -0.56 0.82 0.07 0.00 0.00 179.01 179.49 1bu9 h ILE 52 N 0.00 0.01 0.37 -1.06 1.08 -1.87 0.30 117.51 116.33 1bu9 h ILE 52 Ca -0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.45 1bu9 h ILE 52 Cb 0.59 0.01 -0.00 0.00 -3.07 0.00 0.00 36.82 34.35 1bu9 h ILE 52 CO 0.02 0.00 -0.21 0.00 -0.69 0.00 0.00 178.15 177.27 1bu9 h ALA 53 N 0.35 -0.53 -0.74 1.87 0.00 -1.77 -2.97 119.26 115.47 1bu9 h ALA 53 Ca 0.14 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1bu9 h ALA 53 Cb 0.50 0.25 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1bu9 h ALA 53 CO -0.80 -0.81 -0.44 -2.13 0.00 0.00 0.00 179.25 175.08 1bu9 n ARG 54 N -5.34 -0.33 -0.32 0.00 0.63 0.47 0.27 116.66 112.05 1bu9 n ARG 54 Ca -0.10 1.28 0.31 0.00 -0.92 0.00 0.00 57.85 58.42 1bu9 n ARG 54 Cb 0.24 -1.88 0.58 0.00 0.45 0.00 0.00 32.46 31.85 1bu9 n ARG 54 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1bu9 n ARG 55 N -4.73 -0.06 -0.06 -0.14 0.00 0.76 0.24 116.66 112.67 1bu9 n ARG 55 Ca 0.01 1.34 -0.20 0.00 -0.00 0.00 0.00 57.85 59.00 1bu9 n ARG 55 Cb 0.19 -2.41 -0.13 0.00 0.00 0.00 0.00 32.46 30.12 1bu9 n ARG 55 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1bu9 h LEU 56 N 0.00 0.11 -1.82 6.15 3.38 0.34 -3.34 115.31 120.13 1bu9 h LEU 56 Ca 0.83 -0.73 0.21 0.00 0.09 0.00 0.00 57.88 58.28 1bu9 h LEU 56 Cb 2.21 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.89 1bu9 h LEU 56 CO -0.74 1.42 0.69 -0.07 0.09 0.00 0.00 178.44 179.83 1bu9 h LEU 57 N -0.79 0.00 -0.59 1.67 3.38 0.76 1.06 115.31 120.80 1bu9 h LEU 57 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1bu9 h LEU 57 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1bu9 h LEU 57 CO -0.08 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.38 1bu9 h LEU 58 N 0.00 0.00 0.00 1.67 -0.00 -0.33 -3.13 115.31 113.53 1bu9 h LEU 58 Ca 0.35 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.21 1bu9 h LEU 58 Cb 1.72 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 42.38 1bu9 h LEU 58 CO -0.00 0.00 -1.31 -1.14 -0.00 0.00 0.00 178.44 175.99 1bu9 n ARG 59 N -2.30 0.82 0.00 1.13 0.63 0.34 -5.00 116.66 112.27 1bu9 n ARG 59 Ca 0.03 -0.04 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1bu9 n ARG 59 Cb 0.28 -1.15 0.00 0.00 0.45 0.00 0.00 32.46 32.04 1bu9 n ARG 59 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1bu9 n GLY 60 N 2.26 -0.76 2.54 5.14 0.00 0.20 -5.01 105.19 109.56 1bu9 n GLY 60 Ca -0.03 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 4.31 -1.65 4.61 0.00 -1.20 -4.04 120.51 122.54 1bu9 n ALA 61 Ca 0.00 -4.79 -0.56 0.00 0.00 0.00 0.00 53.44 48.10 1bu9 n ALA 61 Cb 0.00 -1.19 -0.07 0.00 0.00 0.00 0.00 19.45 18.19 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 0.93 2.38 0.21 0.00 3.02 -1.26 -4.65 115.26 115.89 1bu9 n ASN 62 Ca 0.29 0.95 0.15 0.00 -0.03 0.00 0.00 54.58 55.94 1bu9 n ASN 62 Cb 0.39 -1.17 0.70 0.00 -0.61 0.00 0.00 39.78 39.10 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 8.27 0.00 -0.57 3.52 0.13 -1.88 -1.35 132.00 140.13 1bu9 h PRO 63 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1bu9 h PRO 63 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1bu9 h PRO 63 CO 0.98 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 175.28 1bu9 n ASP 64 N -2.55 3.18 -4.22 1.44 -0.08 -1.26 -2.29 116.55 110.76 1bu9 n ASP 64 Ca -0.00 -2.15 -0.27 0.00 -1.51 0.00 0.00 54.79 50.86 1bu9 n ASP 64 Cb 0.15 -0.42 -0.11 0.00 2.34 0.00 0.00 41.12 43.08 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 0.91 1.74 -4.23 -2.67 4.77 -0.51 -4.63 117.00 112.38 1bu9 n LEU 65 Ca 0.18 -2.37 -0.28 0.00 -0.03 0.00 0.00 56.01 53.51 1bu9 n LEU 65 Cb 0.56 -1.37 0.20 0.00 -2.33 0.00 0.00 43.42 40.48 1bu9 n LEU 65 CO 0.15 -2.69 -0.14 1.17 -1.33 0.00 0.00 177.39 174.54 1bu9 n LYS 66 N 8.04 -2.40 -0.59 3.23 3.00 -1.26 -2.94 118.16 125.24 1bu9 n LYS 66 Ca 0.44 -0.69 0.00 0.00 -0.00 0.00 0.00 58.31 58.06 1bu9 n LYS 66 Cb 0.45 -1.74 0.00 0.00 0.00 0.00 0.00 35.03 33.74 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 -2.64 0.97 0.26 3.14 5.68 -0.82 -4.76 116.55 118.38 1bu9 n ASP 67 Ca 0.04 -0.30 0.10 0.00 -0.50 0.00 0.00 54.79 54.14 1bu9 n ASP 67 Cb 0.54 0.00 0.69 0.00 -1.14 0.00 0.00 41.12 41.21 1bu9 n ASP 67 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1bu9 h ARG 68 N 0.00 0.00 -0.86 0.11 0.11 -1.44 -0.22 114.38 112.08 1bu9 h ARG 68 Ca 0.00 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.03 1bu9 h ARG 68 Cb 0.00 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.05 1bu9 h ARG 68 CO 0.00 0.11 0.06 0.25 0.10 0.00 0.00 179.97 180.49 1bu9 n THR 69 N -3.96 1.35 -4.04 0.08 -2.24 -1.26 -4.82 114.28 99.39 1bu9 n THR 69 Ca -0.02 -0.65 -0.33 0.00 -2.27 0.00 0.00 64.05 60.78 1bu9 n THR 69 Cb 0.20 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 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 0.17 -0.48 3.25 3.38 0.00 -0.09 -4.40 105.19 107.02 1bu9 n GLY 70 Ca 0.15 0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.28 3.24 0.45 1.61 0.40 -1.25 -2.15 117.98 117.00 1bu9 s PHE 71 Ca 0.70 -1.49 -0.25 0.00 -0.60 0.00 0.00 56.93 55.30 1bu9 s PHE 71 Cb -0.37 -2.22 -0.08 0.00 0.51 0.00 0.00 43.02 40.85 1bu9 s PHE 71 CO 0.87 -0.73 1.33 0.00 0.70 0.00 0.00 175.22 177.39 1bu9 n ALA 72 N 4.77 1.57 -0.21 5.36 0.00 -1.24 -1.94 120.51 128.81 1bu9 n ALA 72 Ca -0.13 0.23 0.31 0.00 0.00 0.00 0.00 53.44 53.85 1bu9 n ALA 72 Cb 0.45 -2.32 0.70 0.00 0.00 0.00 0.00 19.45 18.28 1bu9 n ALA 72 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1bu9 h VAL 73 N 2.02 0.31 -0.99 0.00 3.04 -1.38 3.56 116.25 122.80 1bu9 h VAL 73 Ca -0.49 0.00 0.10 0.00 -1.01 0.00 0.00 66.70 65.30 1bu9 h VAL 73 Cb 1.29 0.38 -0.08 0.00 -2.01 0.00 0.00 31.29 30.88 1bu9 h VAL 73 CO 0.60 0.00 0.63 0.40 -1.01 0.00 0.00 177.57 178.19 1bu9 h ILE 74 N 0.00 0.98 -0.01 3.17 2.04 -1.76 -0.58 117.51 121.36 1bu9 h ILE 74 Ca 0.47 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1bu9 h ILE 74 Cb 2.13 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1bu9 h ILE 74 CO -0.00 0.19 -0.03 0.45 0.00 0.00 0.00 178.15 178.76 1bu9 h HIS 75 N 1.04 -0.08 -0.88 1.37 3.86 0.64 0.30 115.15 121.42 1bu9 h HIS 75 Ca 0.46 0.00 0.36 0.00 -1.16 0.00 0.00 60.37 60.04 1bu9 h HIS 75 Cb 0.37 0.03 -0.16 0.00 1.06 0.00 0.00 27.41 28.72 1bu9 h HIS 75 CO -0.00 -0.02 0.46 -0.25 0.86 0.00 0.00 177.93 178.97 1bu9 n ASP 76 N -2.73 0.29 0.09 2.45 8.00 -0.60 0.28 116.55 124.33 1bu9 n ASP 76 Ca -0.00 1.45 -0.04 0.00 0.71 0.00 0.00 54.79 56.91 1bu9 n ASP 76 Cb 0.02 -0.70 -0.02 0.00 -0.02 0.00 0.00 41.12 40.40 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 1.75 -0.65 -0.02 2.24 0.00 0.97 -3.33 119.26 120.23 1bu9 h ALA 77 Ca 0.74 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.56 1bu9 h ALA 77 Cb 1.94 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1bu9 h ALA 77 CO -0.68 -0.63 -0.11 0.00 0.00 0.00 0.00 179.25 177.83 1bu9 h ALA 78 N -1.77 0.03 -0.19 0.00 0.00 0.86 1.36 119.26 119.55 1bu9 h ALA 78 Ca -0.02 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1bu9 h ALA 78 Cb 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1bu9 h ALA 78 CO 0.04 -0.04 -0.11 -2.13 0.00 0.00 0.00 179.25 177.01 1bu9 n ARG 79 N -4.64 -0.09 0.01 0.00 0.00 0.81 -0.45 116.66 112.31 1bu9 n ARG 79 Ca -0.09 0.54 -0.13 0.00 -0.00 0.00 0.00 57.85 58.18 1bu9 n ARG 79 Cb 0.41 -0.81 -0.10 0.00 0.00 0.00 0.00 32.46 31.97 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 -0.15 -0.07 0.00 5.13 0.00 -1.70 -3.41 119.26 119.06 1bu9 h ALA 80 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1bu9 h ALA 80 Cb 0.08 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1bu9 h ALA 80 CO -0.18 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.19 1bu9 n GLY 81 N 0.28 -0.15 2.85 0.00 0.00 0.41 -4.99 105.19 103.59 1bu9 n GLY 81 Ca -0.09 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 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 3.42 0.30 1.61 3.72 0.47 -4.94 117.46 122.04 1bu9 n PHE 82 Ca 0.00 -4.26 -0.16 0.00 -0.05 0.00 0.00 57.45 52.98 1bu9 n PHE 82 Cb 0.00 -0.68 -0.08 0.00 -0.94 0.00 0.00 39.48 37.78 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 5.25 -0.62 -1.75 4.37 5.85 -1.93 0.29 115.31 126.77 1bu9 h LEU 83 Ca 0.16 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1bu9 h LEU 83 Cb 0.74 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1bu9 h LEU 83 CO 0.76 -0.37 0.50 0.44 -0.34 0.00 0.00 178.44 179.43 1bu9 h ASP 84 N -0.84 0.00 0.79 1.25 3.32 -1.95 2.67 116.42 121.66 1bu9 h ASP 84 Ca -0.08 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.73 1bu9 h ASP 84 Cb 0.61 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1bu9 h ASP 84 CO 0.12 0.00 -1.25 0.74 -1.72 0.00 0.00 179.24 177.13 1bu9 h THR 85 N 0.00 1.42 0.00 0.35 2.02 -1.47 -2.70 112.91 112.53 1bu9 h THR 85 Ca 0.12 -3.16 -0.03 0.00 0.77 0.00 0.00 66.41 64.11 1bu9 h THR 85 Cb 1.12 2.73 -0.00 0.00 -1.74 0.00 0.00 68.15 70.25 1bu9 h THR 85 CO -0.00 0.82 -0.13 0.25 0.37 0.00 0.00 175.52 176.84 1bu9 h LEU 86 N 0.01 0.00 -0.02 2.58 6.46 0.81 -2.72 115.31 122.43 1bu9 h LEU 86 Ca -0.11 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.59 1bu9 h LEU 86 Cb 1.87 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.80 1bu9 h LEU 86 CO 0.12 0.13 -0.21 1.56 -0.62 0.00 0.00 178.44 179.42 1bu9 h GLN 87 N 0.00 0.18 -0.55 1.25 4.20 -0.20 -1.86 115.11 118.12 1bu9 h GLN 87 Ca -0.00 -0.16 0.11 0.00 0.06 0.00 0.00 58.65 58.65 1bu9 h GLN 87 Cb 0.53 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 28.25 1bu9 h GLN 87 CO 0.02 0.86 -0.19 1.15 -0.67 0.00 0.00 178.83 180.00 1bu9 h THR 88 N -0.45 0.37 0.56 -0.54 2.02 -1.17 1.35 112.91 115.05 1bu9 h THR 88 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 1bu9 h THR 88 Cb 0.92 0.37 0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1bu9 h THR 88 CO 0.04 0.00 -0.27 -0.07 0.37 0.00 0.00 175.52 175.59 1bu9 h LEU 89 N -0.06 -0.63 0.07 2.58 3.38 -1.57 0.19 115.31 119.27 1bu9 h LEU 89 Ca 0.26 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.25 1bu9 h LEU 89 Cb 0.46 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 1bu9 h LEU 89 CO -0.59 -0.41 -0.36 0.25 0.09 0.00 0.00 178.44 177.42 1bu9 h LEU 90 N -0.81 -1.06 -0.95 1.67 6.46 -0.41 0.45 115.31 120.66 1bu9 h LEU 90 Ca -0.08 0.13 0.29 0.00 -0.12 0.00 0.00 57.88 58.10 1bu9 h LEU 90 Cb 0.60 0.41 -0.15 0.00 -0.73 0.00 0.00 40.66 40.79 1bu9 h LEU 90 CO 0.13 -0.43 0.35 -0.08 -0.62 0.00 0.00 178.44 177.79 1bu9 h GLU 91 N -0.56 0.19 -0.87 1.25 4.57 0.19 2.09 114.58 121.43 1bu9 h GLU 91 Ca 0.04 -0.01 -0.15 0.00 -1.18 0.00 0.00 59.36 58.06 1bu9 h GLU 91 Cb 0.61 -0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.07 1bu9 h GLU 91 CO -0.24 0.12 0.19 1.19 -1.18 0.00 0.00 179.01 179.09 1bu9 n PHE 92 N -5.21 1.52 -2.36 0.92 3.01 0.37 -4.88 117.46 110.83 1bu9 n PHE 92 Ca 0.27 -0.85 -0.06 0.00 1.01 0.00 0.00 57.45 57.81 1bu9 n PHE 92 Cb 0.86 -0.50 0.03 0.00 -0.01 0.00 0.00 39.48 39.86 1bu9 n PHE 92 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1bu9 n GLN 93 N -0.04 -1.63 -3.39 -1.08 6.02 0.71 -4.84 117.38 113.13 1bu9 n GLN 93 Ca 0.26 0.35 -0.39 0.00 -0.01 0.00 0.00 57.00 57.21 1bu9 n GLN 93 Cb 1.00 -3.51 -0.09 0.00 1.02 0.00 0.00 30.24 28.67 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 -3.15 3.57 -0.76 -1.58 0.00 0.13 -4.79 121.76 115.18 1bu9 s ALA 94 Ca 0.11 -0.73 -0.28 0.00 0.00 0.00 0.00 51.96 51.07 1bu9 s ALA 94 Cb -0.01 -2.68 -0.15 0.00 0.00 0.00 0.00 23.12 20.27 1bu9 s ALA 94 CO 0.30 -0.54 2.55 -0.25 0.00 0.00 0.00 175.76 177.82 1bu9 n ASP 95 N 5.06 1.23 0.09 0.00 9.92 -1.26 -4.49 116.55 127.10 1bu9 n ASP 95 Ca -0.08 -0.21 0.20 0.00 -0.53 0.00 0.00 54.79 54.17 1bu9 n ASP 95 Cb 0.51 -1.24 0.66 0.00 -0.64 0.00 0.00 41.12 40.41 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 7.83 0.21 -0.71 2.53 3.04 -1.94 1.80 116.25 129.02 1bu9 h VAL 96 Ca -0.14 0.00 -0.16 0.00 -1.01 0.00 0.00 66.70 65.40 1bu9 h VAL 96 Cb 1.28 0.49 -0.09 0.00 -2.01 0.00 0.00 31.29 30.96 1bu9 h VAL 96 CO 1.28 0.00 0.20 0.59 -1.01 0.00 0.00 177.57 178.63 1bu9 n ASN 97 N -3.40 5.16 -4.57 3.17 5.03 -1.26 -4.60 115.26 114.78 1bu9 n ASN 97 Ca 0.08 -3.15 -0.40 0.00 0.87 0.00 0.00 54.58 51.98 1bu9 n ASN 97 Cb 0.77 -0.73 -0.03 0.00 -1.02 0.00 0.00 39.78 38.77 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 -2.94 3.43 0.00 2.41 -1.16 0.61 -4.89 121.20 118.66 1bu9 s ILE 98 Ca 0.56 0.35 0.00 0.00 -0.51 0.00 0.00 60.65 61.05 1bu9 s ILE 98 Cb 0.44 -3.82 0.00 0.00 0.61 0.00 0.00 42.46 39.69 1bu9 s ILE 98 CO 0.14 -0.69 0.00 -0.62 -2.81 0.00 0.00 174.94 170.97 1bu9 n GLU 99 N 8.82 3.26 0.00 3.50 1.02 -1.26 -3.19 120.64 132.79 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 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 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 -1.77 1.62 5.75 0.15 -3.71 116.55 118.59 1bu9 n ASP 100 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.63 1bu9 n ASP 100 Cb 0.00 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.16 1bu9 n ASP 100 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1bu9 n ASN 101 N 0.00 4.86 0.00 -1.12 3.02 -0.91 -4.29 115.26 116.82 1bu9 n ASN 101 Ca 0.00 -2.97 0.00 0.00 -0.03 0.00 0.00 54.58 51.58 1bu9 n ASN 101 Cb 0.00 -0.85 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 1bu9 n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1bu9 n GLU 102 N -0.08 0.00 0.00 3.52 1.02 -1.26 -5.05 120.64 118.80 1bu9 n GLU 102 Ca 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1bu9 n GLU 102 Cb 0.87 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.29 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 -1.46 0.42 3.77 0.62 0.00 -1.26 -3.69 105.19 103.59 1bu9 n GLY 103 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 6.50 0.53 1.61 -0.87 -1.26 -4.47 114.94 116.98 1bu9 s ASN 104 Ca 0.00 2.68 0.05 0.00 -1.57 0.00 0.00 52.86 54.02 1bu9 s ASN 104 Cb 0.00 -2.64 0.02 0.00 -0.02 0.00 0.00 41.25 38.61 1bu9 s ASN 104 CO 0.00 -0.72 0.34 -0.76 -2.57 0.00 0.00 177.10 173.39 1bu9 s LEU 105 N -2.17 2.71 0.36 0.60 1.43 -1.26 0.32 118.68 120.67 1bu9 s LEU 105 Ca 0.54 -1.26 0.25 0.00 -1.03 0.00 0.00 54.13 52.62 1bu9 s LEU 105 Cb -0.39 -1.19 1.32 0.00 0.03 0.00 0.00 46.19 45.97 1bu9 s LEU 105 CO 0.51 -1.02 1.75 1.55 0.23 0.00 0.00 176.35 179.37 1bu9 h PRO 106 N 0.87 0.00 0.09 1.29 0.13 -1.82 -0.62 132.00 131.95 1bu9 h PRO 106 Ca -0.38 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1bu9 h PRO 106 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1bu9 h PRO 106 CO 0.60 0.00 -0.05 1.25 -0.23 0.00 0.00 178.00 179.57 1bu9 h LEU 107 N 0.00 -0.11 -1.49 1.56 5.85 -1.87 0.70 115.31 119.95 1bu9 h LEU 107 Ca 0.00 -0.17 0.25 0.00 0.84 0.00 0.00 57.88 58.80 1bu9 h LEU 107 Cb 0.02 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 1bu9 h LEU 107 CO 0.00 0.45 0.66 0.45 -0.34 0.00 0.00 178.44 179.66 1bu9 h HIS 108 N -1.01 0.54 0.21 1.25 3.86 -1.62 0.49 115.15 118.87 1bu9 h HIS 108 Ca -0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1bu9 h HIS 108 Cb 0.27 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1bu9 h HIS 108 CO 0.05 0.09 -0.10 -0.07 0.86 0.00 0.00 177.93 178.76 1bu9 h LEU 109 N 0.36 -0.24 -1.68 2.43 4.07 -1.08 1.82 115.31 121.00 1bu9 h LEU 109 Ca 0.54 0.01 0.31 0.00 0.08 0.00 0.00 57.88 58.82 1bu9 h LEU 109 Cb 1.44 0.06 -0.04 0.00 1.08 0.00 0.00 40.66 43.19 1bu9 h LEU 109 CO -0.22 -0.10 0.97 0.00 -1.08 0.00 0.00 178.44 178.01 1bu9 h ALA 110 N -1.74 2.95 0.10 1.53 0.00 0.12 2.28 119.26 124.50 1bu9 h ALA 110 Ca -0.03 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 1bu9 h ALA 110 Cb 0.21 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1bu9 h ALA 110 CO 0.05 -1.52 -1.54 0.00 0.00 0.00 0.00 179.25 176.23 1bu9 h ALA 111 N 1.07 0.33 0.02 0.00 0.00 0.29 1.25 119.26 122.22 1bu9 h ALA 111 Ca 0.51 -1.15 0.03 0.00 0.00 0.00 0.00 54.91 54.30 1bu9 h ALA 111 Cb 2.44 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 20.48 1bu9 h ALA 111 CO -0.01 1.19 -0.35 -0.22 0.00 0.00 0.00 179.25 179.86 1bu9 h LYS 112 N 0.06 -0.50 -0.34 0.00 3.64 1.72 0.98 116.57 122.13 1bu9 h LYS 112 Ca -0.24 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 1bu9 h LYS 112 Cb 2.00 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.92 1bu9 h LYS 112 CO 0.15 -0.34 -0.01 0.93 -2.27 0.00 0.00 179.45 177.92 1bu9 h GLU 113 N -0.52 0.52 0.00 1.90 4.39 -1.52 -3.46 114.58 115.90 1bu9 h GLU 113 Ca 0.05 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1bu9 h GLU 113 Cb 0.60 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1bu9 h GLU 113 CO -0.27 0.56 0.00 0.41 -1.16 0.00 0.00 179.01 178.54 1bu9 n GLY 114 N -0.87 1.36 3.51 -3.84 0.00 0.34 -4.93 105.19 100.76 1bu9 n GLY 114 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.30 0.77 0.00 1.61 8.25 0.42 -4.69 115.22 120.28 1bu9 n HIS 115 Ca 0.00 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 1bu9 n HIS 115 Cb 0.00 -1.80 0.00 0.00 1.12 0.00 0.00 29.99 29.31 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 14.25 0.00 -0.62 2.41 7.94 -1.26 0.15 117.00 139.87 1bu9 n LEU 116 Ca 0.44 0.29 0.48 0.00 -1.11 0.00 0.00 56.01 56.11 1bu9 n LEU 116 Cb 0.44 0.00 0.75 0.00 0.53 0.00 0.00 43.42 45.14 1bu9 n LEU 116 CO 0.88 0.00 1.35 -1.14 -1.11 0.00 0.00 177.39 177.36 1bu9 n ARG 117 N -0.46 -0.01 0.02 1.96 0.00 -1.26 0.15 116.66 117.05 1bu9 n ARG 117 Ca 0.00 1.07 -0.01 0.00 -0.00 0.00 0.00 57.85 58.91 1bu9 n ARG 117 Cb 0.00 -2.36 -0.00 0.00 0.00 0.00 0.00 32.46 30.09 1bu9 n ARG 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1bu9 h VAL 118 N 0.00 0.00 -0.94 5.15 2.07 -1.61 -2.67 116.25 118.26 1bu9 h VAL 118 Ca 0.88 -0.04 0.21 0.00 0.82 0.00 0.00 66.70 68.57 1bu9 h VAL 118 Cb 3.37 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 33.06 1bu9 h VAL 118 CO -0.12 0.00 0.61 0.58 0.02 0.00 0.00 177.57 178.66 1bu9 h VAL 119 N -0.08 0.67 -1.05 2.57 2.07 0.42 1.36 116.25 122.21 1bu9 h VAL 119 Ca -0.00 -0.17 0.28 0.00 0.82 0.00 0.00 66.70 67.63 1bu9 h VAL 119 Cb 0.03 0.14 -0.07 0.00 -1.52 0.00 0.00 31.29 29.88 1bu9 h VAL 119 CO 0.01 0.09 0.71 -0.08 0.02 0.00 0.00 177.57 178.32 1bu9 h GLU 120 N 0.49 0.23 -0.12 1.57 4.22 0.14 0.89 114.58 122.00 1bu9 h GLU 120 Ca 0.50 -0.01 -0.19 0.00 0.08 0.00 0.00 59.36 59.74 1bu9 h GLU 120 Cb 1.14 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1bu9 h GLU 120 CO -0.23 0.15 -0.70 0.35 -2.18 0.00 0.00 179.01 176.41 1bu9 h PHE 121 N 0.24 0.67 -0.08 0.92 3.04 0.22 -2.79 116.94 119.16 1bu9 h PHE 121 Ca 0.56 -0.28 0.02 0.00 3.98 0.00 0.00 57.97 62.25 1bu9 h PHE 121 Cb 1.72 -0.11 -0.00 0.00 2.56 0.00 0.00 35.95 40.12 1bu9 h PHE 121 CO -0.00 1.05 0.11 -0.07 -2.02 0.00 0.00 178.31 177.38 1bu9 h LEU 122 N 0.36 0.00 0.00 0.59 -0.00 1.00 0.36 115.31 117.61 1bu9 h LEU 122 Ca -0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.72 1bu9 h LEU 122 Cb 1.27 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.91 1bu9 h LEU 122 CO 0.13 0.00 -1.29 1.62 -0.00 0.00 0.00 178.44 178.90 1bu9 h VAL 123 N 0.00 0.40 -1.88 1.22 3.04 -1.20 -3.34 116.25 114.49 1bu9 h VAL 123 Ca 0.04 -1.78 -0.48 0.00 -1.01 0.00 0.00 66.70 63.47 1bu9 h VAL 123 Cb 0.26 1.93 -0.03 0.00 -2.01 0.00 0.00 31.29 31.44 1bu9 h VAL 123 CO -0.00 0.23 -0.43 -0.54 -1.01 0.00 0.00 177.57 175.82 1bu9 s LYS 124 N -3.02 2.89 0.00 4.17 3.01 0.11 -4.32 119.74 122.58 1bu9 s LYS 124 Ca -0.02 -1.17 0.00 0.00 -1.01 0.00 0.00 55.97 53.77 1bu9 s LYS 124 Cb 0.09 -2.60 0.00 0.00 -1.01 0.00 0.00 37.83 34.31 1bu9 s LYS 124 CO 0.80 0.13 0.00 0.72 0.51 0.00 0.00 175.35 177.52 1bu9 n HIS 125 N -1.43 0.00 -1.27 3.18 8.25 -1.26 -4.84 115.22 117.85 1bu9 n HIS 125 Ca -0.02 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.42 1bu9 n HIS 125 Cb 0.59 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.71 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 0.00 0.00 0.41 1.59 -2.24 -1.26 -4.93 114.28 107.85 1bu9 n THR 126 Ca 0.00 -0.07 0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1bu9 n THR 126 Cb 0.00 -1.86 0.16 0.00 -2.10 0.00 0.00 70.33 66.53 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 -3.04 2.93 -1.11 6.98 0.00 -1.26 -4.97 120.51 120.04 1bu9 n ALA 127 Ca -0.01 -0.73 0.11 0.00 0.00 0.00 0.00 53.44 52.82 1bu9 n ALA 127 Cb 0.03 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 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 -5.18 -1.23 0.00 7.64 -1.25 -4.71 113.62 109.18 1bu9 n SER 128 Ca 0.11 0.84 -0.05 0.00 1.01 0.00 0.00 58.87 60.78 1bu9 n SER 128 Cb 0.55 -3.68 0.13 0.00 -1.01 0.00 0.00 64.21 60.20 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 -4.00 2.82 -0.13 6.43 6.94 -1.26 -4.91 115.26 121.15 1bu9 n ASN 129 Ca -0.05 -3.69 0.04 0.00 -0.02 0.00 0.00 54.58 50.87 1bu9 n ASN 129 Cb 0.50 -0.45 0.09 0.00 -2.36 0.00 0.00 39.78 37.56 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 -0.87 -0.15 -1.67 3.53 0.24 -1.25 0.18 118.33 118.34 1bu9 n VAL 130 Ca 0.27 0.81 -0.07 0.00 -2.04 0.00 0.00 64.34 63.31 1bu9 n VAL 130 Cb 0.82 -1.16 0.15 0.00 -1.47 0.00 0.00 33.84 32.18 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 -1.20 5.46 2.99 7.63 0.00 -1.26 -3.05 105.19 115.77 1bu9 n GLY 131 Ca 0.08 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.00 1.00 -1.99 1.61 -0.00 0.48 -4.87 115.22 110.45 1bu9 n HIS 132 Ca 0.32 -1.36 -0.42 0.00 -0.00 0.00 0.00 57.72 56.25 1bu9 n HIS 132 Cb 0.86 -1.30 -0.03 0.00 -0.00 0.00 0.00 29.99 29.52 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 4.84 4.07 0.00 1.57 0.52 -1.26 -3.27 118.95 125.42 1bu9 s ARG 133 Ca 0.42 2.12 0.00 0.00 -0.52 0.00 0.00 55.73 57.75 1bu9 s ARG 133 Cb 0.10 -4.02 0.00 0.00 0.52 0.00 0.00 34.95 31.55 1bu9 s ARG 133 CO 0.09 -0.98 0.00 0.09 0.02 0.00 0.00 175.30 174.52 1bu9 n ASN 134 N 7.56 -0.17 -0.02 0.23 3.02 -1.20 -4.44 115.26 120.24 1bu9 n ASN 134 Ca 0.18 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.64 1bu9 n ASN 134 Cb 0.43 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.58 1bu9 n ASN 134 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1bu9 h HIS 135 N -0.86 -0.36 -0.04 3.10 3.86 -1.85 -2.28 115.15 116.72 1bu9 h HIS 135 Ca 0.00 0.02 -0.19 0.00 -1.16 0.00 0.00 60.37 59.05 1bu9 h HIS 135 Cb 0.00 0.19 0.01 0.00 1.06 0.00 0.00 27.41 28.67 1bu9 h HIS 135 CO 0.00 -0.21 -0.71 -0.22 0.86 0.00 0.00 177.93 177.65 1bu9 h LYS 136 N -0.16 0.55 0.00 2.45 3.64 -1.91 -3.47 116.57 117.66 1bu9 h LYS 136 Ca 0.10 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1bu9 h LYS 136 Cb 0.32 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1bu9 h LYS 136 CO -0.26 1.16 0.00 0.41 -2.27 0.00 0.00 179.45 178.49 1bu9 n GLY 137 N 0.95 -0.33 3.56 5.01 0.00 -0.86 -5.03 105.19 108.49 1bu9 n GLY 137 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.05 4.55 1.02 1.61 1.11 -1.26 -3.72 116.67 119.94 1bu9 s ASP 138 Ca 0.00 -0.43 -0.06 0.00 0.18 0.00 0.00 52.55 52.24 1bu9 s ASP 138 Cb 0.00 -2.56 0.10 0.00 1.07 0.00 0.00 42.92 41.53 1bu9 s ASP 138 CO 0.00 -3.30 0.23 0.35 1.18 0.00 0.00 175.17 173.62 1bu9 n THR 139 N 8.30 0.00 0.65 -1.27 -2.24 -1.25 -3.21 114.28 115.25 1bu9 n THR 139 Ca 0.43 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.27 1bu9 n THR 139 Cb 0.45 -0.26 0.31 0.00 -2.10 0.00 0.00 70.33 68.74 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 -3.47 1.85 -0.11 6.98 0.00 -1.20 -2.27 120.51 122.28 1bu9 n ALA 140 Ca -0.05 -0.06 -0.21 0.00 0.00 0.00 0.00 53.44 53.11 1bu9 n ALA 140 Cb 0.16 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.31 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 -3.60 0.50 -0.04 0.00 9.92 -0.98 -1.17 116.55 121.19 1bu9 n ASP 142 Ca -0.44 0.67 -0.02 0.00 -0.53 0.00 0.00 54.79 54.46 1bu9 n ASP 142 Cb 0.96 -0.76 -0.01 0.00 -0.64 0.00 0.00 41.12 40.67 1bu9 n ASP 142 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1bu9 h LEU 143 N 0.00 0.00 -2.01 0.64 3.38 -1.58 -3.13 115.31 112.61 1bu9 h LEU 143 Ca 0.00 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.12 1bu9 h LEU 143 Cb 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1bu9 h LEU 143 CO 0.00 0.38 0.39 0.00 0.09 0.00 0.00 178.44 179.30 1bu9 h ALA 144 N -1.48 2.45 0.36 1.53 0.00 -1.50 -1.49 119.26 119.13 1bu9 h ALA 144 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1bu9 h ALA 144 Cb 0.24 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bu9 h ALA 144 CO 0.00 -0.66 -0.17 -0.09 0.00 0.00 0.00 179.25 178.33 1bu9 h ARG 145 N 0.00 -0.47 -0.95 0.00 1.12 -1.27 0.01 114.38 112.82 1bu9 h ARG 145 Ca 0.25 0.03 0.08 0.00 -1.11 0.00 0.00 59.98 59.23 1bu9 h ARG 145 Cb 1.03 0.11 -0.07 0.00 -0.01 0.00 0.00 29.97 31.03 1bu9 h ARG 145 CO -0.00 -0.17 0.61 -0.07 -3.11 0.00 0.00 179.97 177.24 1bu9 h LEU 146 N -0.77 0.93 0.00 3.80 3.38 -1.24 0.11 115.31 121.52 1bu9 h LEU 146 Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1bu9 h LEU 146 Cb 0.52 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1bu9 h LEU 146 CO 0.08 0.56 0.00 -1.22 0.09 0.00 0.00 178.44 177.95 1bu9 n TYR 147 N -4.53 0.00 0.00 1.13 4.01 -0.76 -4.82 117.16 112.20 1bu9 n TYR 147 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 1bu9 n TYR 147 Cb 0.25 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 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 0.18 2.86 3.55 2.72 0.00 0.37 -4.97 105.19 109.91 1bu9 n GLY 148 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.45 2.09 -0.18 1.61 3.00 -0.03 -4.77 118.95 120.21 1bu9 s ARG 149 Ca 0.00 1.03 -0.21 0.00 0.00 0.00 0.00 55.73 56.55 1bu9 s ARG 149 Cb 0.00 -4.62 -0.21 0.00 0.00 0.00 0.00 34.95 30.12 1bu9 s ARG 149 CO 0.00 -3.44 0.34 -2.95 0.00 0.00 0.00 175.30 169.25 1bu9 h ASN 150 N 17.23 0.06 -0.90 0.23 -1.07 -1.90 -2.36 115.58 126.86 1bu9 h ASN 150 Ca -0.18 -0.64 0.26 0.00 0.07 0.00 0.00 56.30 55.81 1bu9 h ASN 150 Cb 1.19 -0.02 -0.04 0.00 -2.07 0.00 0.00 38.32 37.39 1bu9 h ASN 150 CO 1.14 1.45 0.82 -0.33 0.07 0.00 0.00 177.43 180.58 1bu9 h GLU 151 N -0.88 0.00 0.19 4.14 3.07 -1.94 2.58 114.58 121.74 1bu9 h GLU 151 Ca -0.30 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.24 1bu9 h GLU 151 Cb 1.34 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 29.26 1bu9 h GLU 151 CO -0.14 0.00 -1.51 0.28 -1.40 0.00 0.00 179.01 176.24 1bu9 h VAL 152 N 0.00 1.21 0.39 3.13 2.07 -1.84 -2.26 116.25 118.95 1bu9 h VAL 152 Ca 0.43 -2.75 -0.02 0.00 0.82 0.00 0.00 66.70 65.18 1bu9 h VAL 152 Cb 2.06 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 34.73 1bu9 h VAL 152 CO -0.00 0.84 -0.19 0.58 0.02 0.00 0.00 177.57 178.82 1bu9 h VAL 153 N 0.11 0.00 -1.04 2.57 2.07 0.45 -2.94 116.25 117.47 1bu9 h VAL 153 Ca -0.25 -0.24 0.27 0.00 0.82 0.00 0.00 66.70 67.30 1bu9 h VAL 153 Cb 2.09 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.77 1bu9 h VAL 153 CO 0.22 0.00 0.68 0.28 0.02 0.00 0.00 177.57 178.77 1bu9 h SER 154 N -0.76 0.38 -0.52 0.57 0.02 0.10 1.60 113.55 114.95 1bu9 h SER 154 Ca -0.05 0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.07 1bu9 h SER 154 Cb 0.40 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 62.84 1bu9 h SER 154 CO 0.09 0.08 -0.26 0.25 -1.14 0.00 0.00 176.83 175.85 1bu9 h LEU 155 N 0.34 -0.90 0.11 5.07 7.12 -1.23 1.33 115.31 127.15 1bu9 h LEU 155 Ca 0.57 0.20 -0.36 0.00 0.13 0.00 0.00 57.88 58.42 1bu9 h LEU 155 Cb 1.56 0.47 -0.02 0.00 -0.53 0.00 0.00 40.66 42.14 1bu9 h LEU 155 CO -0.25 -0.27 -2.02 0.23 -0.13 0.00 0.00 178.44 176.01 1bu9 n MET 156 N -5.42 0.74 -0.37 1.25 2.81 0.64 -2.41 117.12 114.36 1bu9 n MET 156 Ca 0.04 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.20 1bu9 n MET 156 Cb 0.33 -1.69 0.14 0.00 -0.71 0.00 0.00 33.22 31.30 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 0.00 1.20 0.08 0.03 4.20 0.24 1.70 115.11 122.56 1bu9 h GLN 157 Ca -0.44 -0.07 -0.27 0.00 0.06 0.00 0.00 58.65 57.93 1bu9 h GLN 157 Cb 1.98 -0.27 0.01 0.00 0.30 0.00 0.00 27.48 29.51 1bu9 h GLN 157 CO 0.05 0.80 -1.13 0.00 -0.67 0.00 0.00 178.83 177.87 1bu9 h ALA 158 N 1.41 0.15 -0.24 3.87 0.00 0.16 -3.23 119.26 121.38 1bu9 h ALA 158 Ca 0.40 -0.77 -0.15 0.00 0.00 0.00 0.00 54.91 54.39 1bu9 h ALA 158 Cb 0.03 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 1bu9 h ALA 158 CO -0.13 0.79 0.19 0.09 0.00 0.00 0.00 179.25 180.19 1bu9 n ASN 159 N -3.72 4.88 -4.29 0.00 3.02 -0.79 -4.80 115.26 109.55 1bu9 n ASN 159 Ca -0.10 -2.60 -0.33 0.00 -0.03 0.00 0.00 54.58 51.52 1bu9 n ASN 159 Cb 0.94 -0.90 -0.08 0.00 -0.61 0.00 0.00 39.78 39.13 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 0.62 -0.22 0.00 7.41 0.00 -0.92 -4.77 105.19 107.31 1bu9 n GLY 160 Ca 0.15 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.43 0.80 -1.00 4.61 0.00 0.56 -4.78 120.51 116.27 1bu9 n ALA 161 Ca -0.20 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1bu9 n ALA 161 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 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 0.15 -0.90 0.00 0.00 0.00 -0.26 -3.95 105.19 100.23 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 0.00 -0.29 0.00 -0.02 0.00 -1.17 -4.16 105.19 99.56 1bu9 n GLY 163 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 0.00 0.04 4.61 0.00 -1.26 -4.79 120.51 119.11 1bu9 n ALA 164 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bu9 n ALA 164 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bu9 n ALA 164 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bu9 n THR 165 N 0.00 0.14 -3.22 0.00 -2.24 -1.26 -5.02 114.28 102.68 1bu9 n THR 165 Ca 0.00 0.05 -0.23 0.00 -2.27 0.00 0.00 64.05 61.60 1bu9 n THR 165 Cb 0.00 -0.85 0.02 0.00 -2.10 0.00 0.00 70.33 67.40 1bu9 n THR 165 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bu9 n ASN 166 N -2.95 -5.09 -4.06 3.42 2.85 -1.26 -4.96 115.26 103.21 1bu9 n ASN 166 Ca 0.00 -0.36 -0.17 0.00 -0.11 0.00 0.00 54.58 53.94 1bu9 n ASN 166 Cb 0.11 -4.13 -0.13 0.00 1.24 0.00 0.00 39.78 36.86 1bu9 n ASN 166 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1bu9 s LEU 167 N -6.66 2.12 0.00 1.20 1.43 -1.26 -5.35 118.68 110.16 1bu9 s LEU 167 Ca 0.37 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1bu9 s LEU 167 Cb -0.18 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 45.65 1bu9 s LEU 167 CO 0.46 0.00 0.42 1.67 0.23 0.00 0.00 176.35 179.13