#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bu9 s ALA 2 N 0.00 0.86 -0.61 3.04 0.00 -1.26 -4.91 121.76 118.87 1bu9 s ALA 2 Ca 0.00 -0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.58 1bu9 s ALA 2 Cb 0.00 -0.49 0.03 0.00 0.00 0.00 0.00 23.12 22.66 1bu9 s ALA 2 CO 0.00 -0.01 0.62 -1.91 0.00 0.00 0.00 175.76 174.45 1bu9 n GLU 3 N 4.06 -1.70 0.00 0.00 2.13 -1.26 -4.32 120.64 119.55 1bu9 n GLU 3 Ca -0.23 1.06 0.00 0.00 0.66 0.00 0.00 57.16 58.65 1bu9 n GLU 3 Cb 0.51 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.19 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 -1.33 1.82 0.00 5.31 -0.04 -1.26 -4.09 135.00 135.41 1bu9 n PRO 4 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1bu9 n PRO 4 Cb 0.67 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.13 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 0.00 0.00 0.00 0.54 -0.00 -1.26 -4.19 117.44 112.53 1bu9 n TRP 5 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1bu9 n TRP 5 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 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 5.00 0.45 0.00 5.87 0.00 -1.26 -3.73 105.19 111.52 1bu9 n GLY 6 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1bu9 n GLY 6 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bu9 n ASN 7 N 1.15 0.00 0.00 1.61 3.02 -1.26 -1.76 115.26 118.02 1bu9 n ASN 7 Ca 0.00 0.06 -0.18 0.00 -0.03 0.00 0.00 54.58 54.43 1bu9 n ASN 7 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 1bu9 n ASN 7 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1bu9 h GLU 8 N 0.00 0.21 0.00 3.52 4.57 -1.77 -3.32 114.58 117.79 1bu9 h GLU 8 Ca 0.00 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.83 1bu9 h GLU 8 Cb 0.00 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1bu9 h GLU 8 CO 0.00 1.04 0.00 -0.11 -1.18 0.00 0.00 179.01 178.76 1bu9 n LEU 9 N -3.38 0.00 -0.41 1.64 0.00 -1.18 0.11 117.00 113.78 1bu9 n LEU 9 Ca -0.27 1.00 0.37 0.00 0.00 0.00 0.00 56.01 57.10 1bu9 n LEU 9 Cb 1.05 -0.50 0.72 0.00 0.00 0.00 0.00 43.42 44.69 1bu9 n LEU 9 CO 0.44 -0.50 1.33 0.00 0.00 0.00 0.00 177.39 178.67 1bu9 h ALA 10 N -1.88 3.09 -0.79 1.96 0.00 -1.58 1.63 119.26 121.70 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 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1bu9 h ALA 10 CO 0.00 -1.51 0.00 0.45 0.00 0.00 0.00 179.25 178.19 1bu9 n SER 11 N -4.26 0.00 -0.30 0.00 2.88 -0.68 0.18 113.62 111.44 1bu9 n SER 11 Ca 0.30 0.72 0.01 0.00 -1.33 0.00 0.00 58.87 58.58 1bu9 n SER 11 Cb 1.35 -0.37 0.15 0.00 -0.75 0.00 0.00 64.21 64.59 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 1.16 0.15 -1.46 0.00 0.63 0.31 119.26 118.06 1bu9 h ALA 12 Ca 0.00 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bu9 h ALA 12 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1bu9 h ALA 12 CO 0.00 0.20 -0.18 0.00 0.00 0.00 0.00 179.25 179.27 1bu9 h ALA 13 N 1.42 -0.34 -0.14 0.00 0.00 0.23 0.24 119.26 120.67 1bu9 h ALA 13 Ca 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1bu9 h ALA 13 Cb 0.24 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1bu9 h ALA 13 CO -0.20 -0.72 0.00 0.00 0.00 0.00 0.00 179.25 178.33 1bu9 n ALA 14 N -2.43 2.70 0.13 0.00 0.00 0.13 0.29 120.51 121.33 1bu9 n ALA 14 Ca -0.07 -0.38 0.01 0.00 0.00 0.00 0.00 53.44 53.00 1bu9 n ALA 14 Cb 0.22 -1.02 -0.00 0.00 0.00 0.00 0.00 19.45 18.65 1bu9 n ALA 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bu9 n ARG 15 N 0.09 2.79 0.00 0.00 5.12 0.10 -4.64 116.66 120.12 1bu9 n ARG 15 Ca 0.06 -0.34 0.00 0.00 -1.93 0.00 0.00 57.85 55.64 1bu9 n ARG 15 Cb 0.36 -0.84 0.00 0.00 -1.16 0.00 0.00 32.46 30.82 1bu9 n ARG 15 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bu9 n GLY 16 N 0.62 1.70 3.54 -0.13 0.00 -0.34 -4.99 105.19 105.59 1bu9 n GLY 16 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 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 2.18 -0.06 1.61 8.00 0.66 -4.81 116.55 124.12 1bu9 n ASP 17 Ca 0.00 -0.26 -0.05 0.00 0.71 0.00 0.00 54.79 55.19 1bu9 n ASP 17 Cb 0.00 -1.47 -0.04 0.00 -0.02 0.00 0.00 41.12 39.58 1bu9 n ASP 17 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1bu9 h LEU 18 N 17.52 0.00 -0.58 0.64 6.46 -1.94 -3.34 115.31 134.06 1bu9 h LEU 18 Ca -0.24 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.22 1bu9 h LEU 18 Cb 1.27 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.18 1bu9 h LEU 18 CO 1.15 0.68 0.38 -0.33 -0.62 0.00 0.00 178.44 179.70 1bu9 h GLU 19 N -1.00 0.78 -1.54 1.25 5.08 -1.98 -1.56 114.58 115.60 1bu9 h GLU 19 Ca -0.01 -0.05 0.46 0.00 -1.00 0.00 0.00 59.36 58.76 1bu9 h GLU 19 Cb 0.35 -0.17 -0.08 0.00 0.50 0.00 0.00 28.75 29.34 1bu9 h GLU 19 CO -0.00 0.53 1.07 0.37 -1.00 0.00 0.00 179.01 179.98 1bu9 h GLN 20 N 0.79 0.04 -0.04 2.33 4.15 -1.96 0.77 115.11 121.19 1bu9 h GLN 20 Ca 0.21 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.55 1bu9 h GLN 20 Cb -0.07 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.62 1bu9 h GLN 20 CO -0.04 0.03 -0.27 -0.07 -1.93 0.00 0.00 178.83 176.55 1bu9 h LEU 21 N 0.05 0.30 0.10 -2.39 4.07 -1.41 -2.93 115.31 113.10 1bu9 h LEU 21 Ca 0.79 -0.69 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1bu9 h LEU 21 Cb 2.92 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 44.56 1bu9 h LEU 21 CO -0.14 0.94 -0.17 0.74 -1.08 0.00 0.00 178.44 178.74 1bu9 h THR 22 N -0.32 0.00 -0.86 0.22 2.02 0.59 0.70 112.91 115.27 1bu9 h THR 22 Ca -0.02 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.38 1bu9 h THR 22 Cb 0.95 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.22 1bu9 h THR 22 CO 0.05 0.00 0.19 -1.28 0.37 0.00 0.00 175.52 174.86 1bu9 h SER 23 N -0.28 -0.07 -0.10 4.18 0.87 -1.57 0.71 113.55 117.29 1bu9 h SER 23 Ca -0.01 0.20 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1bu9 h SER 23 Cb 0.26 0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 1bu9 h SER 23 CO -0.06 -0.16 -0.02 -0.07 -0.53 0.00 0.00 176.83 175.99 1bu9 h LEU 24 N 0.19 0.28 0.37 2.23 4.07 -1.23 -2.10 115.31 119.12 1bu9 h LEU 24 Ca 0.53 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.43 1bu9 h LEU 24 Cb 1.04 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.71 1bu9 h LEU 24 CO -0.66 0.36 -0.18 0.25 -1.08 0.00 0.00 178.44 177.13 1bu9 h LEU 25 N 0.30 -0.42 -1.72 1.67 5.85 0.28 0.58 115.31 121.85 1bu9 h LEU 25 Ca 0.07 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1bu9 h LEU 25 Cb 0.24 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1bu9 h LEU 25 CO 0.01 -0.19 0.41 0.06 -0.34 0.00 0.00 178.44 178.39 1bu9 h GLN 26 N -0.72 0.00 0.00 1.25 3.07 -1.38 -2.77 115.11 114.55 1bu9 h GLN 26 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.69 1bu9 h GLN 26 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.94 1bu9 h GLN 26 CO 0.08 0.00 -0.22 -0.97 0.09 0.00 0.00 178.83 177.81 1bu9 h ASN 27 N 0.00 0.00 -2.80 0.06 -0.73 -1.09 -3.51 115.58 107.50 1bu9 h ASN 27 Ca 0.00 0.00 0.19 0.00 1.87 0.00 0.00 56.30 58.36 1bu9 h ASN 27 Cb 0.82 0.00 -0.29 0.00 0.27 0.00 0.00 38.32 39.12 1bu9 h ASN 27 CO 0.00 0.34 0.84 0.20 -0.37 0.00 0.00 177.43 178.44 1bu9 s ASN 28 N -4.52 -0.11 -0.28 1.15 0.01 0.20 -4.97 114.94 106.42 1bu9 s ASN 28 Ca -0.06 0.17 -0.25 0.00 -0.71 0.00 0.00 52.86 52.01 1bu9 s ASN 28 Cb 0.01 0.16 0.11 0.00 0.41 0.00 0.00 41.25 41.94 1bu9 s ASN 28 CO 0.10 -0.07 0.94 0.68 -1.51 0.00 0.00 177.10 177.23 1bu9 s VAL 29 N -0.47 0.00 -1.21 1.60 -7.23 -1.26 -4.30 120.40 107.53 1bu9 s VAL 29 Ca 0.07 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.12 1bu9 s VAL 29 Cb -0.03 -1.00 0.19 0.00 0.56 0.00 0.00 36.38 36.10 1bu9 s VAL 29 CO -0.10 0.00 1.48 0.59 -0.31 0.00 0.00 175.10 176.75 1bu9 n ASN 30 N 2.36 5.30 -0.24 4.85 4.13 -1.26 -4.72 115.26 125.67 1bu9 n ASN 30 Ca -0.13 -3.03 0.31 0.00 1.68 0.00 0.00 54.58 53.41 1bu9 n ASN 30 Cb 0.56 -1.51 0.54 0.00 -1.54 0.00 0.00 39.78 37.83 1bu9 n ASN 30 CO 0.00 0.00 0.00 1.62 0.28 0.00 0.00 177.26 179.16 1bu9 h VAL 31 N 4.27 0.07 -0.34 2.41 3.04 -1.97 2.26 116.25 125.99 1bu9 h VAL 31 Ca 0.31 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.00 1bu9 h VAL 31 Cb 0.81 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 1bu9 h VAL 31 CO 1.29 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.44 1bu9 n ASN 32 N -3.43 2.89 -3.10 3.17 5.03 -1.26 -4.83 115.26 113.73 1bu9 n ASN 32 Ca 0.24 -1.95 0.00 0.00 0.87 0.00 0.00 54.58 53.74 1bu9 n ASN 32 Cb 1.46 -0.22 0.00 0.00 -1.02 0.00 0.00 39.78 40.00 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 0.59 0.00 -3.47 5.41 0.00 0.76 -4.96 120.51 118.84 1bu9 n ALA 33 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.57 1bu9 n ALA 33 Cb 0.42 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.82 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 -1.38 0.26 0.82 0.00 -0.21 -1.26 -4.37 119.66 113.52 1bu9 s GLN 34 Ca 0.00 0.57 -0.11 0.00 0.02 0.00 0.00 55.36 55.84 1bu9 s GLN 34 Cb 0.00 0.24 0.11 0.00 1.00 0.00 0.00 33.01 34.36 1bu9 s GLN 34 CO 0.00 -0.07 1.16 1.21 -2.12 0.00 0.00 175.29 175.47 1bu9 s ASN 35 N 1.93 4.22 0.60 5.90 3.84 -1.20 -4.81 114.94 125.41 1bu9 s ASN 35 Ca -0.05 0.50 0.29 0.00 0.21 0.00 0.00 52.86 53.81 1bu9 s ASN 35 Cb -0.04 -0.91 1.61 0.00 -0.55 0.00 0.00 41.25 41.36 1bu9 s ASN 35 CO -0.16 -2.04 2.02 1.23 -2.79 0.00 0.00 177.10 175.37 1bu9 h GLY 36 N -1.06 0.00 2.00 1.21 0.00 -1.98 0.91 103.07 104.15 1bu9 h GLY 36 Ca -0.45 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 1bu9 h GLY 36 CO 0.56 0.00 -0.40 -2.75 0.00 0.00 0.00 176.54 173.95 1bu9 h PHE 37 N 0.00 0.00 -0.43 5.60 3.57 -2.04 -3.47 116.94 120.17 1bu9 h PHE 37 Ca 0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1bu9 h PHE 37 Cb 0.72 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.46 1bu9 h PHE 37 CO 0.00 0.40 0.00 0.41 -2.23 0.00 0.00 178.31 176.89 1bu9 n GLY 38 N -0.13 0.59 3.62 2.40 0.00 0.32 -3.39 105.19 108.61 1bu9 n GLY 38 Ca -0.01 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.43 0.70 0.60 1.61 3.03 -1.26 -3.95 118.95 119.25 1bu9 s ARG 39 Ca 0.00 0.73 -0.16 0.00 2.03 0.00 0.00 55.73 58.33 1bu9 s ARG 39 Cb 0.00 0.34 -0.03 0.00 -1.03 0.00 0.00 34.95 34.22 1bu9 s ARG 39 CO 0.00 -0.10 1.06 0.95 -1.13 0.00 0.00 175.30 176.08 1bu9 s THR 40 N 0.13 3.75 0.62 4.99 -4.23 -1.26 -3.23 115.64 116.41 1bu9 s THR 40 Ca 0.01 0.83 0.26 0.00 -1.18 0.00 0.00 61.69 61.61 1bu9 s THR 40 Cb -0.04 -3.35 0.33 0.00 1.34 0.00 0.00 72.50 70.77 1bu9 s THR 40 CO -0.01 -0.49 1.76 0.00 -0.54 0.00 0.00 174.62 175.33 1bu9 h ALA 41 N 0.41 2.00 0.00 3.99 0.00 -1.90 1.96 119.26 125.72 1bu9 h ALA 41 Ca -0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1bu9 h ALA 41 Cb 1.22 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1bu9 h ALA 41 CO 0.57 -0.75 -0.05 1.25 0.00 0.00 0.00 179.25 180.27 1bu9 h LEU 42 N 0.00 0.00 0.03 0.00 5.85 -1.92 2.10 115.31 121.37 1bu9 h LEU 42 Ca 0.17 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.62 1bu9 h LEU 42 Cb 1.31 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 1bu9 h LEU 42 CO -0.00 0.05 -1.45 1.67 -0.34 0.00 0.00 178.44 178.37 1bu9 n GLN 43 N -3.30 0.61 0.06 1.25 7.27 0.66 -4.17 117.38 119.76 1bu9 n GLN 43 Ca -0.01 0.51 -0.05 0.00 0.07 0.00 0.00 57.00 57.51 1bu9 n GLN 43 Cb 0.21 -1.73 0.15 0.00 2.41 0.00 0.00 30.24 31.27 1bu9 n GLN 43 CO 0.00 0.00 0.00 -0.39 0.07 0.00 0.00 177.06 176.74 1bu9 h VAL 44 N -0.78 1.33 0.00 1.69 -1.51 -1.22 -3.46 116.25 112.30 1bu9 h VAL 44 Ca -0.37 -1.71 0.00 0.00 -1.23 0.00 0.00 66.70 63.38 1bu9 h VAL 44 Cb 1.47 1.77 0.00 0.00 -2.13 0.00 0.00 31.29 32.40 1bu9 h VAL 44 CO -0.15 0.52 0.00 1.15 -1.23 0.00 0.00 177.57 177.85 1bu9 n MET 45 N -3.97 0.00 -1.52 5.19 0.00 0.71 -4.27 117.12 113.26 1bu9 n MET 45 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.54 1bu9 n MET 45 Cb 0.55 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.67 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 0.00 0.33 0.14 3.17 3.00 0.83 -4.66 118.16 120.98 1bu9 n LYS 46 Ca 0.00 -0.87 0.15 0.00 -0.00 0.00 0.00 58.31 57.59 1bu9 n LYS 46 Cb 0.00 -3.18 0.44 0.00 0.00 0.00 0.00 35.03 32.29 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 20.06 0.00 -0.69 3.14 3.38 -1.87 0.10 115.31 139.43 1bu9 h LEU 47 Ca 0.01 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1bu9 h LEU 47 Cb 1.02 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.67 1bu9 h LEU 47 CO 1.10 0.00 -0.54 1.23 0.09 0.00 0.00 178.44 180.32 1bu9 h GLY 48 N 0.00 -0.79 -5.50 0.83 0.00 -1.96 -3.29 103.07 92.36 1bu9 h GLY 48 Ca 0.17 0.71 -0.61 0.00 0.00 0.00 0.00 47.33 47.60 1bu9 h GLY 48 CO -0.00 -0.07 -0.31 0.54 0.00 0.00 0.00 176.54 176.71 1bu9 s ASN 49 N -5.26 6.57 0.10 0.19 2.20 0.35 -4.94 114.94 114.17 1bu9 s ASN 49 Ca -0.13 0.68 0.18 0.00 -0.94 0.00 0.00 52.86 52.65 1bu9 s ASN 49 Cb 0.11 -2.19 -0.10 0.00 -2.00 0.00 0.00 41.25 37.08 1bu9 s ASN 49 CO 0.63 0.24 0.89 1.55 -2.94 0.00 0.00 177.10 177.48 1bu9 h PRO 50 N 5.59 0.00 0.00 3.55 0.13 -1.77 -3.21 132.00 136.29 1bu9 h PRO 50 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1bu9 h PRO 50 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1bu9 h PRO 50 CO 0.67 0.21 -0.04 1.05 -0.23 0.00 0.00 178.00 179.66 1bu9 h GLU 51 N 0.00 0.00 0.00 0.86 4.11 -1.92 -2.49 114.58 115.14 1bu9 h GLU 51 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 1bu9 h GLU 51 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1bu9 h GLU 51 CO 0.03 0.04 0.00 -0.89 0.07 0.00 0.00 179.01 178.27 1bu9 n ILE 52 N -3.45 0.00 -0.19 -1.06 2.08 -1.21 0.78 119.36 116.32 1bu9 n ILE 52 Ca -0.02 1.34 -0.04 0.00 0.56 0.00 0.00 62.75 64.60 1bu9 n ILE 52 Cb 0.16 -1.94 0.06 0.00 -0.75 0.00 0.00 39.64 37.18 1bu9 n ILE 52 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1bu9 h ALA 53 N -1.44 0.72 -0.90 -1.39 0.00 -1.76 -2.46 119.26 112.03 1bu9 h ALA 53 Ca 0.00 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1bu9 h ALA 53 Cb 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 17.58 1bu9 h ALA 53 CO 0.00 -0.04 -0.54 -0.09 0.00 0.00 0.00 179.25 178.57 1bu9 h ARG 54 N 0.56 -0.06 -0.91 0.00 2.43 -0.68 2.55 114.38 118.27 1bu9 h ARG 54 Ca 0.24 0.00 0.26 0.00 -0.81 0.00 0.00 59.98 59.68 1bu9 h ARG 54 Cb 0.14 0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 29.55 1bu9 h ARG 54 CO -0.16 -0.04 0.25 0.00 -1.51 0.00 0.00 179.97 178.51 1bu9 h ARG 55 N -0.06 0.17 0.06 0.20 2.47 0.86 1.45 114.38 119.53 1bu9 h ARG 55 Ca 0.18 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.89 1bu9 h ARG 55 Cb 0.47 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.76 1bu9 h ARG 55 CO -0.89 0.11 -0.03 -0.07 0.56 0.00 0.00 179.97 179.65 1bu9 h LEU 56 N 0.17 -0.07 -1.02 3.04 3.38 0.22 -3.31 115.31 117.71 1bu9 h LEU 56 Ca 0.59 0.00 0.42 0.00 0.09 0.00 0.00 57.88 58.99 1bu9 h LEU 56 Cb 1.26 0.02 -0.18 0.00 0.09 0.00 0.00 40.66 41.85 1bu9 h LEU 56 CO -0.70 0.10 0.56 -0.11 0.09 0.00 0.00 178.44 178.38 1bu9 n LEU 57 N -3.07 0.34 0.06 1.67 -0.00 0.74 -0.89 117.00 115.85 1bu9 n LEU 57 Ca -0.01 1.64 -0.10 0.00 -0.00 0.00 0.00 56.01 57.54 1bu9 n LEU 57 Cb 0.03 -0.80 -0.06 0.00 -0.00 0.00 0.00 43.42 42.59 1bu9 n LEU 57 CO 0.03 -1.84 0.51 -0.07 -0.00 0.00 0.00 177.39 176.01 1bu9 h LEU 58 N 0.00 -1.02 -0.98 -1.96 -0.00 0.19 0.24 115.31 111.78 1bu9 h LEU 58 Ca 0.85 0.11 0.30 0.00 -0.00 0.00 0.00 57.88 59.14 1bu9 h LEU 58 Cb 2.29 0.38 -0.14 0.00 -0.00 0.00 0.00 40.66 43.18 1bu9 h LEU 58 CO -0.75 -0.34 0.52 -0.09 -0.00 0.00 0.00 178.44 177.77 1bu9 h ARG 59 N -0.46 0.34 0.00 1.13 2.43 -1.11 -3.42 114.38 113.29 1bu9 h ARG 59 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1bu9 h ARG 59 Cb 0.47 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1bu9 h ARG 59 CO -0.20 0.22 0.00 0.41 -1.51 0.00 0.00 179.97 178.90 1bu9 n GLY 60 N -1.31 0.00 3.79 2.80 0.00 0.00 -5.15 105.19 105.33 1bu9 n GLY 60 Ca 0.29 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.93 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 3.45 -0.21 4.61 0.00 -0.78 -4.93 121.76 123.90 1bu9 s ALA 61 Ca 0.00 0.28 -0.18 0.00 0.00 0.00 0.00 51.96 52.06 1bu9 s ALA 61 Cb 0.00 -2.89 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1bu9 s ALA 61 CO 0.00 0.31 0.49 -0.80 0.00 0.00 0.00 175.76 175.77 1bu9 s ASN 62 N -1.28 6.52 0.36 0.00 0.01 -1.26 -4.62 114.94 114.67 1bu9 s ASN 62 Ca 0.37 0.62 0.08 0.00 -0.71 0.00 0.00 52.86 53.22 1bu9 s ASN 62 Cb -0.21 -2.28 0.68 0.00 0.41 0.00 0.00 41.25 39.86 1bu9 s ASN 62 CO 0.24 -0.18 1.86 1.55 -1.51 0.00 0.00 177.10 179.07 1bu9 h PRO 63 N 7.53 0.28 0.00 -0.60 0.13 -1.88 -1.91 132.00 135.55 1bu9 h PRO 63 Ca -0.33 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1bu9 h PRO 63 Cb 1.15 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1bu9 h PRO 63 CO 0.73 0.46 0.00 -3.47 -0.23 0.00 0.00 178.00 175.49 1bu9 n ASP 64 N -4.22 0.00 -4.51 1.44 -0.08 -1.26 -0.54 116.55 107.38 1bu9 n ASP 64 Ca -0.01 0.50 -0.31 0.00 -1.51 0.00 0.00 54.79 53.46 1bu9 n ASP 64 Cb 0.31 -0.50 -0.17 0.00 2.34 0.00 0.00 41.12 43.10 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 -1.50 -0.20 -4.70 -2.67 4.77 -0.72 -4.39 117.00 107.59 1bu9 n LEU 65 Ca 0.04 -0.27 -0.29 0.00 -0.03 0.00 0.00 56.01 55.46 1bu9 n LEU 65 Cb 0.17 -0.85 0.16 0.00 -2.33 0.00 0.00 43.42 40.57 1bu9 n LEU 65 CO 0.14 -1.19 0.66 -0.75 -1.33 0.00 0.00 177.39 174.92 1bu9 s LYS 66 N 8.14 0.76 0.00 3.23 2.47 -1.26 -2.54 119.74 130.53 1bu9 s LYS 66 Ca 1.29 0.59 0.00 0.00 -1.56 0.00 0.00 55.97 56.29 1bu9 s LYS 66 Cb -0.95 -1.77 0.00 0.00 -1.46 0.00 0.00 37.83 33.65 1bu9 s LYS 66 CO 0.48 -2.53 0.00 -3.47 0.16 0.00 0.00 175.35 170.00 1bu9 n ASP 67 N -4.04 1.65 -0.21 1.43 -0.08 -0.84 -4.59 116.55 109.86 1bu9 n ASP 67 Ca 0.06 -0.19 -0.07 0.00 -1.51 0.00 0.00 54.79 53.08 1bu9 n ASP 67 Cb 0.57 0.00 0.03 0.00 2.34 0.00 0.00 41.12 44.06 1bu9 n ASP 67 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1bu9 h ARG 68 N 0.00 0.84 -0.96 -0.67 2.43 -1.68 -1.42 114.38 112.92 1bu9 h ARG 68 Ca 0.00 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.00 1bu9 h ARG 68 Cb 0.00 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 1bu9 h ARG 68 CO 0.00 0.66 0.07 0.25 -1.51 0.00 0.00 179.97 179.44 1bu9 n THR 69 N -4.55 1.05 -3.70 0.20 -2.24 -1.26 -4.80 114.28 98.97 1bu9 n THR 69 Ca 0.04 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.27 1bu9 n THR 69 Cb 0.10 -0.71 0.03 0.00 -2.10 0.00 0.00 70.33 67.66 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 -0.30 3.20 3.38 0.00 -0.54 -4.18 105.19 106.90 1bu9 n GLY 70 Ca 0.09 0.13 -0.37 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 -3.67 3.36 0.55 1.61 0.40 -1.26 -2.58 117.98 116.40 1bu9 s PHE 71 Ca 0.01 -1.85 -0.21 0.00 -0.60 0.00 0.00 56.93 54.28 1bu9 s PHE 71 Cb -0.00 -2.58 -0.05 0.00 0.51 0.00 0.00 43.02 40.90 1bu9 s PHE 71 CO 0.81 -0.84 1.32 0.00 0.70 0.00 0.00 175.22 177.21 1bu9 n ALA 72 N 4.71 1.42 -0.42 5.36 0.00 -1.24 -1.99 120.51 128.33 1bu9 n ALA 72 Ca -0.10 0.11 0.36 0.00 0.00 0.00 0.00 53.44 53.82 1bu9 n ALA 72 Cb 0.43 -2.33 0.68 0.00 0.00 0.00 0.00 19.45 18.24 1bu9 n ALA 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bu9 h VAL 73 N 1.30 0.28 -0.85 0.00 2.07 -0.52 2.96 116.25 121.49 1bu9 h VAL 73 Ca -0.50 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 1bu9 h VAL 73 Cb 1.31 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 1bu9 h VAL 73 CO 0.56 0.02 0.53 0.40 0.02 0.00 0.00 177.57 179.10 1bu9 h ILE 74 N 0.11 1.23 -0.20 4.57 2.04 -1.85 -0.97 117.51 122.44 1bu9 h ILE 74 Ca 0.71 -0.48 0.02 0.00 1.00 0.00 0.00 64.86 66.11 1bu9 h ILE 74 Cb 2.45 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 38.51 1bu9 h ILE 74 CO -0.18 0.24 -0.26 0.45 0.00 0.00 0.00 178.15 178.40 1bu9 h HIS 75 N 1.17 -0.79 -0.94 1.37 3.86 0.51 0.79 115.15 121.11 1bu9 h HIS 75 Ca 0.31 0.04 0.16 0.00 -1.16 0.00 0.00 60.37 59.72 1bu9 h HIS 75 Cb -0.07 0.37 -0.16 0.00 1.06 0.00 0.00 27.41 28.61 1bu9 h HIS 75 CO -0.00 -0.22 -0.34 -0.44 0.86 0.00 0.00 177.93 177.78 1bu9 h ASP 76 N -0.17 -1.25 -0.55 2.45 5.19 -1.26 2.87 116.42 123.70 1bu9 h ASP 76 Ca 0.04 0.30 0.08 0.00 -0.62 0.00 0.00 57.03 56.82 1bu9 h ASP 76 Cb 0.27 0.69 -0.07 0.00 0.18 0.00 0.00 39.33 40.40 1bu9 h ASP 76 CO -0.28 -0.30 0.18 0.00 -3.12 0.00 0.00 179.24 175.72 1bu9 h ALA 77 N 1.50 0.68 0.00 3.45 0.00 0.44 -3.17 119.26 122.16 1bu9 h ALA 77 Ca 0.37 0.08 -0.21 0.00 0.00 0.00 0.00 54.91 55.15 1bu9 h ALA 77 Cb 0.62 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1bu9 h ALA 77 CO -0.95 -0.23 -1.45 0.00 0.00 0.00 0.00 179.25 176.62 1bu9 n ALA 78 N -2.47 0.86 -0.19 0.00 0.00 0.82 0.27 120.51 119.80 1bu9 n ALA 78 Ca 0.07 -0.72 0.02 0.00 0.00 0.00 0.00 53.44 52.80 1bu9 n ALA 78 Cb 0.24 -0.12 0.05 0.00 0.00 0.00 0.00 19.45 19.62 1bu9 n ALA 78 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bu9 n ARG 79 N -4.42 -0.08 -0.08 0.00 0.00 0.93 -0.80 116.66 112.21 1bu9 n ARG 79 Ca -0.31 0.80 -0.14 0.00 -0.00 0.00 0.00 57.85 58.20 1bu9 n ARG 79 Cb 0.63 -1.19 -0.10 0.00 0.00 0.00 0.00 32.46 31.80 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 0.91 0.09 0.00 5.13 0.00 -1.70 -3.42 119.26 120.27 1bu9 h ALA 80 Ca 0.22 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1bu9 h ALA 80 Cb 0.35 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1bu9 h ALA 80 CO -0.52 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.44 1bu9 n GLY 81 N 1.57 -0.10 2.76 0.00 0.00 0.01 -5.05 105.19 104.38 1bu9 n GLY 81 Ca -0.16 -0.15 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 2.18 0.12 1.61 3.72 0.75 -4.97 117.46 120.87 1bu9 n PHE 82 Ca 0.00 -4.05 -0.13 0.00 -0.05 0.00 0.00 57.45 53.22 1bu9 n PHE 82 Cb 0.00 -0.40 -0.08 0.00 -0.94 0.00 0.00 39.48 38.06 1bu9 n PHE 82 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1bu9 h LEU 83 N 5.41 -0.28 -1.67 4.37 3.38 -1.93 0.31 115.31 124.89 1bu9 h LEU 83 Ca 0.18 -0.23 0.23 0.00 0.09 0.00 0.00 57.88 58.14 1bu9 h LEU 83 Cb 0.79 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1bu9 h LEU 83 CO 0.63 0.13 0.80 0.44 0.09 0.00 0.00 178.44 180.53 1bu9 h ASP 84 N -0.76 0.00 0.34 -0.43 5.19 -1.93 3.50 116.42 122.33 1bu9 h ASP 84 Ca -0.03 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.05 1bu9 h ASP 84 Cb 0.50 0.00 0.03 0.00 0.18 0.00 0.00 39.33 40.04 1bu9 h ASP 84 CO 0.06 0.00 -1.48 0.74 -3.12 0.00 0.00 179.24 175.44 1bu9 h THR 85 N 0.00 1.27 0.00 0.35 2.02 -1.71 -2.38 112.91 112.47 1bu9 h THR 85 Ca 0.37 -2.76 -0.04 0.00 0.77 0.00 0.00 66.41 64.76 1bu9 h THR 85 Cb 1.96 2.98 -0.01 0.00 -1.74 0.00 0.00 68.15 71.35 1bu9 h THR 85 CO -0.00 0.83 -0.17 0.25 0.37 0.00 0.00 175.52 176.80 1bu9 h LEU 86 N 0.13 0.00 -0.46 2.58 6.46 0.95 -0.79 115.31 124.18 1bu9 h LEU 86 Ca -0.24 0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.36 1bu9 h LEU 86 Cb 2.12 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 42.04 1bu9 h LEU 86 CO 0.25 0.17 -0.43 1.56 -0.62 0.00 0.00 178.44 179.37 1bu9 h GLN 87 N 0.00 0.81 0.37 1.25 4.20 0.27 -1.28 115.11 120.72 1bu9 h GLN 87 Ca -0.00 -0.44 -0.00 0.00 0.06 0.00 0.00 58.65 58.26 1bu9 h GLN 87 Cb 0.35 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 1bu9 h GLN 87 CO 0.02 1.08 -0.46 1.15 -0.67 0.00 0.00 178.83 179.95 1bu9 h THR 88 N 0.65 0.09 -0.08 -0.54 2.02 -0.62 0.30 112.91 114.74 1bu9 h THR 88 Ca 0.05 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.25 1bu9 h THR 88 Cb 1.00 0.09 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 1bu9 h THR 88 CO 0.10 0.00 -0.40 -0.07 0.37 0.00 0.00 175.52 175.51 1bu9 h LEU 89 N -0.86 -1.27 -0.33 2.58 4.07 -1.37 1.19 115.31 119.32 1bu9 h LEU 89 Ca -0.03 0.15 0.04 0.00 0.08 0.00 0.00 57.88 58.11 1bu9 h LEU 89 Cb 0.79 0.49 -0.06 0.00 1.08 0.00 0.00 40.66 42.96 1bu9 h LEU 89 CO -0.12 -0.37 -0.39 0.25 -1.08 0.00 0.00 178.44 176.74 1bu9 h LEU 90 N -0.45 -1.31 -1.68 1.67 6.46 -0.97 1.81 115.31 120.85 1bu9 h LEU 90 Ca 0.02 0.18 0.34 0.00 -0.12 0.00 0.00 57.88 58.30 1bu9 h LEU 90 Cb 0.51 0.54 -0.08 0.00 -0.73 0.00 0.00 40.66 40.90 1bu9 h LEU 90 CO -0.31 -0.26 0.82 -0.08 -0.62 0.00 0.00 178.44 177.99 1bu9 h GLU 91 N -0.24 0.15 -1.12 1.25 4.57 0.20 0.65 114.58 120.04 1bu9 h GLU 91 Ca 0.06 -0.01 -0.57 0.00 -1.18 0.00 0.00 59.36 57.66 1bu9 h GLU 91 Cb 0.39 -0.03 -0.25 0.00 -0.16 0.00 0.00 28.75 28.70 1bu9 h GLU 91 CO -0.44 0.10 0.74 1.19 -1.18 0.00 0.00 179.01 179.42 1bu9 n PHE 92 N -4.41 2.78 -4.17 0.92 3.72 0.59 -4.89 117.46 112.01 1bu9 n PHE 92 Ca 0.28 -2.62 -0.30 0.00 -0.05 0.00 0.00 57.45 54.76 1bu9 n PHE 92 Cb 1.18 -1.27 -0.06 0.00 -0.94 0.00 0.00 39.48 38.40 1bu9 n PHE 92 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bu9 n GLN 93 N -0.63 -2.11 -3.20 -1.08 10.64 0.23 -4.67 117.38 116.55 1bu9 n GLN 93 Ca 0.54 0.25 -0.39 0.00 -1.83 0.00 0.00 57.00 55.57 1bu9 n GLN 93 Cb 0.75 -4.19 -0.06 0.00 -0.86 0.00 0.00 30.24 25.88 1bu9 n GLN 93 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1bu9 s ALA 94 N -4.03 3.52 -0.70 2.61 0.00 0.26 -4.84 121.76 118.57 1bu9 s ALA 94 Ca 0.13 -0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.53 1bu9 s ALA 94 Cb -0.07 -2.85 -0.14 0.00 0.00 0.00 0.00 23.12 20.06 1bu9 s ALA 94 CO 0.95 -0.39 2.51 -0.25 0.00 0.00 0.00 175.76 178.58 1bu9 n ASP 95 N 4.63 1.44 0.21 0.00 8.00 -1.26 -4.51 116.55 125.07 1bu9 n ASP 95 Ca -0.04 -0.34 0.18 0.00 0.71 0.00 0.00 54.79 55.30 1bu9 n ASP 95 Cb 0.50 -1.32 0.78 0.00 -0.02 0.00 0.00 41.12 41.06 1bu9 n ASP 95 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1bu9 h VAL 96 N 7.78 0.20 -0.56 2.53 3.04 -1.97 1.81 116.25 129.08 1bu9 h VAL 96 Ca -0.15 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.49 1bu9 h VAL 96 Cb 1.26 0.66 -0.03 0.00 -2.01 0.00 0.00 31.29 31.18 1bu9 h VAL 96 CO 1.25 0.00 0.06 0.59 -1.01 0.00 0.00 177.57 178.46 1bu9 n ASN 97 N -3.32 5.14 -4.60 3.17 5.03 -1.26 -4.45 115.26 114.97 1bu9 n ASN 97 Ca 0.03 -2.91 -0.43 0.00 0.87 0.00 0.00 54.58 52.14 1bu9 n ASN 97 Cb 0.49 -0.69 -0.02 0.00 -1.02 0.00 0.00 39.78 38.54 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 -2.64 3.76 0.00 2.41 -1.16 0.61 -4.87 121.20 119.32 1bu9 s ILE 98 Ca 0.50 0.76 0.00 0.00 -0.51 0.00 0.00 60.65 61.40 1bu9 s ILE 98 Cb 0.38 -4.05 0.00 0.00 0.61 0.00 0.00 42.46 39.41 1bu9 s ILE 98 CO 0.14 -0.68 0.00 -0.62 -2.81 0.00 0.00 174.94 170.97 1bu9 n GLU 99 N 8.23 3.32 0.00 3.50 1.02 -1.25 -3.01 120.64 132.46 1bu9 n GLU 99 Ca 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1bu9 n GLU 99 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.90 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 -1.49 1.62 5.75 0.31 -3.70 116.55 119.03 1bu9 n ASP 100 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 54.79 54.72 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 0.59 -0.11 0.00 0.00 177.20 177.68 1bu9 n ASN 101 N 0.00 3.46 0.00 -1.12 3.02 -1.07 -4.32 115.26 115.23 1bu9 n ASN 101 Ca 0.00 -2.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.83 1bu9 n ASN 101 Cb 0.00 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.52 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 -0.10 0.00 0.00 3.52 1.02 -1.26 -5.03 120.64 118.79 1bu9 n GLU 102 Ca 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1bu9 n GLU 102 Cb 0.98 -0.08 0.00 0.00 -0.02 0.00 0.00 31.44 32.33 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 -0.61 0.23 3.77 0.62 0.00 -1.26 -3.73 105.19 104.20 1bu9 n GLY 103 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 6.48 0.41 1.61 0.01 -1.26 -4.47 114.94 117.72 1bu9 s ASN 104 Ca 0.00 2.40 0.03 0.00 -0.71 0.00 0.00 52.86 54.57 1bu9 s ASN 104 Cb 0.00 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 39.07 1bu9 s ASN 104 CO 0.00 -0.71 0.23 0.18 -1.51 0.00 0.00 177.10 175.29 1bu9 n LEU 105 N 0.07 0.00 0.29 0.60 4.77 -1.26 0.11 117.00 121.58 1bu9 n LEU 105 Ca 0.04 -2.26 0.16 0.00 -0.03 0.00 0.00 56.01 53.92 1bu9 n LEU 105 Cb 0.46 0.05 0.93 0.00 -2.33 0.00 0.00 43.42 42.53 1bu9 n LEU 105 CO 0.51 -0.47 1.14 1.55 -1.33 0.00 0.00 177.39 178.79 1bu9 h PRO 106 N 0.00 0.00 0.45 3.23 0.13 -1.79 -0.42 132.00 133.61 1bu9 h PRO 106 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 1bu9 h PRO 106 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1bu9 h PRO 106 CO 0.45 0.00 -0.22 1.25 -0.23 0.00 0.00 178.00 179.25 1bu9 h LEU 107 N 0.00 -0.52 -1.54 1.56 7.12 -1.88 -1.13 115.31 118.92 1bu9 h LEU 107 Ca 0.01 -0.00 0.33 0.00 0.13 0.00 0.00 57.88 58.35 1bu9 h LEU 107 Cb 0.10 0.13 -0.09 0.00 -0.53 0.00 0.00 40.66 40.27 1bu9 h LEU 107 CO -0.00 -0.09 0.77 0.45 -0.13 0.00 0.00 178.44 179.44 1bu9 h HIS 108 N -1.15 0.45 0.00 1.25 3.86 -1.63 0.19 115.15 118.12 1bu9 h HIS 108 Ca -0.06 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1bu9 h HIS 108 Cb 0.49 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.83 1bu9 h HIS 108 CO 0.00 -0.01 0.00 1.28 0.86 0.00 0.00 177.93 180.07 1bu9 n LEU 109 N -4.51 0.06 -0.36 2.43 4.32 -0.23 0.70 117.00 119.41 1bu9 n LEU 109 Ca 0.28 0.84 0.37 0.00 -0.02 0.00 0.00 56.01 57.48 1bu9 n LEU 109 Cb 1.10 -0.38 0.70 0.00 -1.62 0.00 0.00 43.42 43.22 1bu9 n LEU 109 CO 0.29 -0.38 1.34 0.00 -1.22 0.00 0.00 177.39 177.42 1bu9 h ALA 110 N -2.00 3.18 -0.09 -1.18 0.00 -0.50 2.40 119.26 121.07 1bu9 h ALA 110 Ca 0.00 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 54.62 1bu9 h ALA 110 Cb 0.00 0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1bu9 h ALA 110 CO 0.00 -1.72 -0.88 0.00 0.00 0.00 0.00 179.25 176.65 1bu9 h ALA 111 N 1.08 0.23 -0.81 0.00 0.00 -0.47 2.70 119.26 121.99 1bu9 h ALA 111 Ca 0.61 -0.64 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1bu9 h ALA 111 Cb 2.72 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 20.47 1bu9 h ALA 111 CO -0.01 0.68 0.53 0.87 0.00 0.00 0.00 179.25 181.32 1bu9 h LYS 112 N 0.48 0.61 0.02 0.00 1.79 1.00 -2.08 116.57 118.38 1bu9 h LYS 112 Ca -0.08 -0.04 -0.34 0.00 -2.18 0.00 0.00 60.65 58.00 1bu9 h LYS 112 Cb 1.52 -0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 31.98 1bu9 h LYS 112 CO 0.18 0.40 -2.10 0.39 -1.08 0.00 0.00 179.45 177.24 1bu9 n GLU 113 N -4.52 0.68 0.00 3.15 -0.58 -0.80 -4.92 120.64 113.65 1bu9 n GLU 113 Ca 0.15 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.06 1bu9 n GLU 113 Cb 0.43 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 1bu9 n GLU 113 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1bu9 n GLY 114 N 1.80 1.81 3.23 0.62 0.00 0.74 -4.94 105.19 108.45 1bu9 n GLY 114 Ca -0.29 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.04 0.83 0.00 1.61 8.25 0.74 -4.76 115.22 120.85 1bu9 n HIS 115 Ca 0.00 -1.12 0.00 0.00 -0.26 0.00 0.00 57.72 56.34 1bu9 n HIS 115 Cb 0.00 -1.18 0.00 0.00 1.12 0.00 0.00 29.99 29.93 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 7.71 0.00 -0.56 2.41 0.00 -1.26 0.16 117.00 125.45 1bu9 n LEU 116 Ca 0.44 0.42 0.44 0.00 0.00 0.00 0.00 56.01 57.30 1bu9 n LEU 116 Cb 0.36 0.00 0.69 0.00 0.00 0.00 0.00 43.42 44.47 1bu9 n LEU 116 CO 1.04 0.00 1.25 -2.11 0.00 0.00 0.00 177.39 177.57 1bu9 n ARG 117 N -0.72 -0.01 0.03 1.96 -4.01 -1.26 0.20 116.66 112.85 1bu9 n ARG 117 Ca 0.00 1.03 -0.02 0.00 -1.04 0.00 0.00 57.85 57.82 1bu9 n ARG 117 Cb 0.00 -2.24 -0.01 0.00 -3.04 0.00 0.00 32.46 27.18 1bu9 n ARG 117 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1bu9 h VAL 118 N 0.00 0.00 -0.71 8.89 2.07 -1.41 -2.46 116.25 122.63 1bu9 h VAL 118 Ca 0.83 -0.18 0.17 0.00 0.82 0.00 0.00 66.70 68.34 1bu9 h VAL 118 Cb 3.09 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.82 1bu9 h VAL 118 CO -0.16 0.00 0.49 0.58 0.02 0.00 0.00 177.57 178.50 1bu9 h VAL 119 N -0.28 0.72 -0.05 2.57 2.07 0.43 0.97 116.25 122.68 1bu9 h VAL 119 Ca -0.01 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.46 1bu9 h VAL 119 Cb 0.08 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1bu9 h VAL 119 CO 0.02 0.04 0.04 -0.08 0.02 0.00 0.00 177.57 177.60 1bu9 h GLU 120 N 0.20 0.00 -0.22 1.57 4.22 0.23 -1.61 114.58 118.96 1bu9 h GLU 120 Ca 0.35 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.65 1bu9 h GLU 120 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1bu9 h GLU 120 CO -0.07 0.00 -0.39 0.35 -2.18 0.00 0.00 179.01 176.73 1bu9 h PHE 121 N 0.00 0.82 -0.82 0.92 3.04 0.15 -0.04 116.94 121.01 1bu9 h PHE 121 Ca 0.02 -0.29 -0.02 0.00 3.98 0.00 0.00 57.97 61.67 1bu9 h PHE 121 Cb 0.10 -0.16 -0.04 0.00 2.56 0.00 0.00 35.95 38.41 1bu9 h PHE 121 CO 0.00 1.05 0.43 -0.07 -2.02 0.00 0.00 178.31 177.70 1bu9 h LEU 122 N 0.36 1.03 -0.30 0.59 4.07 -1.20 -1.03 115.31 118.83 1bu9 h LEU 122 Ca 0.02 -0.10 -0.10 0.00 0.08 0.00 0.00 57.88 57.78 1bu9 h LEU 122 Cb 0.98 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 1bu9 h LEU 122 CO 0.09 0.84 -0.50 1.62 -1.08 0.00 0.00 178.44 179.41 1bu9 h VAL 123 N 1.15 0.92 0.00 1.22 3.04 -1.35 -3.17 116.25 118.06 1bu9 h VAL 123 Ca 0.29 -2.08 -0.18 0.00 -1.01 0.00 0.00 66.70 63.72 1bu9 h VAL 123 Cb 0.05 2.30 -0.02 0.00 -2.01 0.00 0.00 31.29 31.61 1bu9 h VAL 123 CO -0.04 0.49 -0.83 0.50 -1.01 0.00 0.00 177.57 176.68 1bu9 h LYS 124 N 0.00 0.07 0.00 4.17 1.63 -0.21 -3.45 116.57 118.77 1bu9 h LYS 124 Ca -0.00 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1bu9 h LYS 124 Cb 1.26 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 1bu9 h LYS 124 CO 0.06 0.85 0.00 0.72 -3.45 0.00 0.00 179.45 177.64 1bu9 n HIS 125 N -3.61 0.00 0.00 1.91 8.25 -0.46 -5.07 115.22 116.24 1bu9 n HIS 125 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1bu9 n HIS 125 Cb 0.78 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.89 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 0.67 1.59 -2.24 -1.26 -2.68 114.28 110.35 1bu9 n THR 126 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1bu9 n THR 126 Cb 0.00 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.39 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 0.72 2.69 -2.20 6.98 0.00 -1.26 -4.98 120.51 122.45 1bu9 n ALA 127 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1bu9 n ALA 127 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 0.40 -5.23 -4.55 0.00 7.64 -1.09 -4.54 113.62 106.24 1bu9 n SER 128 Ca 0.12 0.71 -0.33 0.00 1.01 0.00 0.00 58.87 60.37 1bu9 n SER 128 Cb 0.42 -1.13 -0.04 0.00 -1.01 0.00 0.00 64.21 62.46 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 2.11 2.24 -4.18 6.43 6.94 -1.26 -4.86 115.26 122.67 1bu9 n ASN 129 Ca 0.00 -0.64 -0.39 0.00 -0.02 0.00 0.00 54.58 53.53 1bu9 n ASN 129 Cb 0.00 -1.59 -0.05 0.00 -2.36 0.00 0.00 39.78 35.78 1bu9 n ASN 129 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1bu9 s VAL 130 N 12.61 4.81 0.00 3.53 -7.23 -1.26 -4.31 120.40 128.54 1bu9 s VAL 130 Ca 0.98 -3.58 0.00 0.00 -1.81 0.00 0.00 61.98 57.56 1bu9 s VAL 130 Cb -0.17 -3.96 0.00 0.00 0.56 0.00 0.00 36.38 32.80 1bu9 s VAL 130 CO 0.24 -1.09 0.00 0.61 -0.31 0.00 0.00 175.10 174.55 1bu9 n GLY 131 N 2.63 1.33 3.50 2.32 0.00 -0.64 -4.84 105.19 109.50 1bu9 n GLY 131 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.90 0.35 -2.01 1.61 -0.00 -1.26 -4.86 115.22 108.15 1bu9 n HIS 132 Ca 0.00 -0.51 -0.42 0.00 -0.00 0.00 0.00 57.72 56.79 1bu9 n HIS 132 Cb 0.00 -1.26 -0.03 0.00 -0.00 0.00 0.00 29.99 28.71 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 7.25 4.21 0.00 1.57 0.52 -1.26 -2.80 118.95 128.43 1bu9 s ARG 133 Ca 0.71 2.22 0.00 0.00 -0.52 0.00 0.00 55.73 58.14 1bu9 s ARG 133 Cb 0.10 -3.69 0.00 0.00 0.52 0.00 0.00 34.95 31.88 1bu9 s ARG 133 CO 0.30 -0.73 0.00 0.27 0.02 0.00 0.00 175.30 175.16 1bu9 n ASN 134 N 5.93 0.00 0.05 0.23 0.23 -1.20 -4.55 115.26 115.96 1bu9 n ASN 134 Ca 0.16 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 54.09 1bu9 n ASN 134 Cb 0.42 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.06 1bu9 n ASN 134 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 1bu9 h HIS 135 N -0.10 -0.17 0.06 -2.53 3.86 -1.82 -2.64 115.15 111.81 1bu9 h HIS 135 Ca 0.00 0.01 -0.24 0.00 -1.16 0.00 0.00 60.37 58.98 1bu9 h HIS 135 Cb 0.00 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1bu9 h HIS 135 CO 0.00 -0.10 -1.08 -0.22 0.86 0.00 0.00 177.93 177.39 1bu9 h LYS 136 N -0.12 0.19 0.00 2.45 3.64 -1.91 -3.47 116.57 117.35 1bu9 h LYS 136 Ca 0.02 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1bu9 h LYS 136 Cb 0.15 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1bu9 h LYS 136 CO -0.06 1.10 0.00 0.41 -2.27 0.00 0.00 179.45 178.62 1bu9 n GLY 137 N 1.30 0.65 3.56 5.01 0.00 -1.00 -5.02 105.19 109.69 1bu9 n GLY 137 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.27 4.57 1.07 1.61 1.01 -1.26 -3.73 116.67 119.67 1bu9 s ASP 138 Ca 0.00 -0.48 -0.12 0.00 0.71 0.00 0.00 52.55 52.66 1bu9 s ASP 138 Cb 0.00 -2.56 0.19 0.00 1.01 0.00 0.00 42.92 41.56 1bu9 s ASP 138 CO 0.00 -3.30 0.42 0.35 0.21 0.00 0.00 175.17 172.85 1bu9 n THR 139 N 8.28 0.00 0.41 -1.27 -2.24 -1.25 -3.21 114.28 114.99 1bu9 n THR 139 Ca 0.43 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.25 1bu9 n THR 139 Cb 0.45 -0.48 0.21 0.00 -2.10 0.00 0.00 70.33 68.41 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 -4.13 1.61 -0.11 6.98 0.00 -1.12 -1.90 120.51 121.85 1bu9 n ALA 140 Ca -0.10 -0.04 -0.18 0.00 0.00 0.00 0.00 53.44 53.12 1bu9 n ALA 140 Cb 0.29 -1.13 -0.12 0.00 0.00 0.00 0.00 19.45 18.49 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 -3.27 0.00 -0.03 0.00 8.00 -0.80 -1.30 116.55 119.17 1bu9 n ASP 142 Ca -0.43 0.42 -0.02 0.00 0.71 0.00 0.00 54.79 55.47 1bu9 n ASP 142 Cb 1.01 -0.46 -0.01 0.00 -0.02 0.00 0.00 41.12 41.64 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 -1.46 0.62 0.02 0.64 4.77 -0.80 -2.96 117.00 117.83 1bu9 n LEU 143 Ca 0.04 0.30 0.22 0.00 -0.03 0.00 0.00 56.01 56.54 1bu9 n LEU 143 Cb 0.15 -0.61 0.73 0.00 -2.33 0.00 0.00 43.42 41.35 1bu9 n LEU 143 CO 0.12 -0.47 1.20 0.00 -1.33 0.00 0.00 177.39 176.90 1bu9 h ALA 144 N -1.67 2.33 0.37 -1.18 0.00 -1.56 -1.71 119.26 115.85 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 0.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1bu9 h ALA 144 CO 0.00 -0.74 -0.18 -0.09 0.00 0.00 0.00 179.25 178.24 1bu9 h ARG 145 N 0.00 -0.48 -0.83 0.00 2.43 -1.32 0.71 114.38 114.89 1bu9 h ARG 145 Ca 0.25 0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.61 1bu9 h ARG 145 Cb 1.19 0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 30.75 1bu9 h ARG 145 CO -0.00 -0.21 0.39 -0.07 -1.51 0.00 0.00 179.97 178.56 1bu9 h LEU 146 N -1.04 0.43 0.00 3.80 -0.00 -1.22 0.61 115.31 117.88 1bu9 h LEU 146 Ca -0.05 0.10 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 1bu9 h LEU 146 Cb 0.49 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1bu9 h LEU 146 CO 0.08 0.16 0.00 -1.22 -0.00 0.00 0.00 178.44 177.46 1bu9 n TYR 147 N -4.93 0.00 0.00 1.13 4.01 -0.81 -4.82 117.16 111.73 1bu9 n TYR 147 Ca 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 1bu9 n TYR 147 Cb 0.45 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 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 0.00 1.35 3.54 2.72 0.00 0.21 -4.98 105.19 108.04 1bu9 n GLY 148 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.00 1.16 0.00 1.61 3.00 0.24 -4.67 116.66 116.01 1bu9 n ARG 149 Ca 0.00 -2.18 -0.17 0.00 -0.01 0.00 0.00 57.85 55.49 1bu9 n ARG 149 Cb 0.00 -3.68 -0.11 0.00 0.00 0.00 0.00 32.46 28.67 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 10.05 0.53 -1.16 0.55 -1.07 -1.87 -1.50 115.58 121.11 1bu9 h ASN 150 Ca 0.18 -0.77 0.33 0.00 0.07 0.00 0.00 56.30 56.12 1bu9 h ASN 150 Cb 0.92 -0.16 -0.07 0.00 -2.07 0.00 0.00 38.32 36.94 1bu9 h ASN 150 CO 1.26 1.22 0.81 -0.08 0.07 0.00 0.00 177.43 180.71 1bu9 h GLU 151 N -0.12 0.12 0.09 4.14 4.57 -1.94 2.74 114.58 124.18 1bu9 h GLU 151 Ca -0.08 -0.01 -0.25 0.00 -1.18 0.00 0.00 59.36 57.84 1bu9 h GLU 151 Cb 1.32 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.88 1bu9 h GLU 151 CO 0.12 0.08 -1.14 0.28 -1.18 0.00 0.00 179.01 177.17 1bu9 h VAL 152 N 0.12 1.51 0.28 0.32 2.07 -1.83 -2.22 116.25 116.50 1bu9 h VAL 152 Ca 0.59 -2.96 -0.01 0.00 0.82 0.00 0.00 66.70 65.14 1bu9 h VAL 152 Cb 2.08 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 34.67 1bu9 h VAL 152 CO -0.12 0.87 -0.13 0.58 0.02 0.00 0.00 177.57 178.78 1bu9 h VAL 153 N 0.09 0.00 -1.10 2.57 2.07 0.52 -3.04 116.25 117.35 1bu9 h VAL 153 Ca -0.11 -0.34 0.32 0.00 0.82 0.00 0.00 66.70 67.39 1bu9 h VAL 153 Cb 1.85 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 1bu9 h VAL 153 CO 0.18 0.00 0.78 -1.28 0.02 0.00 0.00 177.57 177.28 1bu9 h SER 154 N -0.71 0.06 0.23 0.57 0.87 0.18 0.55 113.55 115.30 1bu9 h SER 154 Ca -0.04 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1bu9 h SER 154 Cb 0.29 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 1bu9 h SER 154 CO 0.06 0.01 -0.51 0.25 -0.53 0.00 0.00 176.83 176.12 1bu9 h LEU 155 N 0.06 -1.49 0.00 2.23 7.12 -1.29 0.38 115.31 122.32 1bu9 h LEU 155 Ca 0.54 0.15 -0.00 0.00 0.13 0.00 0.00 57.88 58.70 1bu9 h LEU 155 Cb 2.04 0.53 0.00 0.00 -0.53 0.00 0.00 40.66 42.70 1bu9 h LEU 155 CO -0.05 -0.57 -0.00 0.24 -0.13 0.00 0.00 178.44 177.93 1bu9 h MET 156 N -0.80 -0.00 -0.95 1.25 2.86 -0.95 -1.13 114.93 115.20 1bu9 h MET 156 Ca -0.02 0.00 0.26 0.00 -2.06 0.00 0.00 59.70 57.88 1bu9 h MET 156 Cb 0.77 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.29 1bu9 h MET 156 CO -0.21 0.90 0.45 1.96 1.06 0.00 0.00 176.91 181.07 1bu9 h GLN 157 N -0.97 0.35 0.20 1.72 4.20 -0.02 0.10 115.11 120.69 1bu9 h GLN 157 Ca -0.00 -0.02 -0.28 0.00 0.06 0.00 0.00 58.65 58.41 1bu9 h GLN 157 Cb 0.91 -0.08 0.03 0.00 0.30 0.00 0.00 27.48 28.64 1bu9 h GLN 157 CO 0.00 0.23 -1.23 0.00 -0.67 0.00 0.00 178.83 177.16 1bu9 h ALA 158 N 1.78 -0.11 -0.01 3.87 0.00 -0.32 -3.32 119.26 121.15 1bu9 h ALA 158 Ca 0.63 -0.79 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1bu9 h ALA 158 Cb 1.32 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 1bu9 h ALA 158 CO -0.58 0.59 -0.22 0.09 0.00 0.00 0.00 179.25 179.13 1bu9 n ASN 159 N -3.86 5.31 -3.46 0.00 3.02 0.24 -4.80 115.26 111.71 1bu9 n ASN 159 Ca -0.15 -2.47 -0.35 0.00 -0.03 0.00 0.00 54.58 51.58 1bu9 n ASN 159 Cb 0.99 -1.30 0.03 0.00 -0.61 0.00 0.00 39.78 38.90 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 2.07 -0.11 0.00 7.41 0.00 -1.03 -4.81 105.19 108.71 1bu9 n GLY 160 Ca 0.26 1.13 0.00 0.00 0.00 0.00 0.00 46.02 47.41 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 -0.40 0.00 -2.77 4.61 0.00 -0.51 -4.75 120.51 116.69 1bu9 n ALA 161 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 1bu9 n ALA 161 Cb 0.66 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.09 1bu9 n ALA 161 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1bu9 s GLY 162 N -0.77 1.65 -0.84 0.00 0.00 -0.85 -1.61 107.32 104.89 1bu9 s GLY 162 Ca 0.00 -2.56 -0.03 0.00 0.00 0.00 0.00 44.72 42.13 1bu9 s GLY 162 CO 0.00 2.31 0.76 0.61 0.00 0.00 0.00 173.10 176.78 1bu9 n GLY 163 N 6.07 -1.08 3.36 0.20 0.00 -1.26 -4.45 105.19 108.02 1bu9 n GLY 163 Ca 0.28 0.48 -0.55 0.00 0.00 0.00 0.00 46.02 46.23 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 -2.47 0.67 -2.98 4.61 0.00 -1.26 -4.89 120.51 114.18 1bu9 n ALA 164 Ca -0.04 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1bu9 n ALA 164 Cb 0.56 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.68 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 6.89 0.00 0.00 0.00 5.66 -1.26 -5.09 114.28 120.48 1bu9 n THR 165 Ca 0.48 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.48 1bu9 n THR 165 Cb 0.10 -0.32 0.00 0.00 -1.55 0.00 0.00 70.33 68.56 1bu9 n THR 165 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1bu9 n ASN 166 N -0.50 0.00 -4.68 1.09 5.15 -1.26 -5.14 115.26 109.92 1bu9 n ASN 166 Ca 0.00 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.67 1bu9 n ASN 166 Cb 0.00 0.00 0.16 0.00 -0.53 0.00 0.00 39.78 39.41 1bu9 n ASN 166 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 1bu9 s LEU 167 N -1.10 2.71 0.00 1.20 2.34 -1.26 -5.36 118.68 117.22 1bu9 s LEU 167 Ca 0.00 2.04 0.00 0.00 0.06 0.00 0.00 54.13 56.23 1bu9 s LEU 167 Cb 0.00 -4.45 0.00 0.00 -0.56 0.00 0.00 46.19 41.18 1bu9 s LEU 167 CO 0.00 -2.95 0.04 0.00 -1.06 0.00 0.00 176.35 172.38