#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 1.93 -3.62 3.04 0.00 -1.26 -3.23 120.51 117.38 1bu9 n ALA 2 Ca 0.00 0.38 -0.27 0.00 0.00 0.00 0.00 53.44 53.55 1bu9 n ALA 2 Cb 0.00 -2.49 0.01 0.00 0.00 0.00 0.00 19.45 16.97 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 4.60 -1.52 -2.06 0.00 2.13 -1.26 -4.88 120.64 117.66 1bu9 n GLU 3 Ca 0.18 0.84 -0.28 0.00 0.66 0.00 0.00 57.16 58.55 1bu9 n GLU 3 Cb 0.33 -1.99 0.06 0.00 0.27 0.00 0.00 31.44 30.10 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 -4.14 2.57 0.20 5.31 0.04 -1.20 -4.33 135.00 133.45 1bu9 s PRO 4 Ca 0.09 0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.29 1bu9 s PRO 4 Cb -0.01 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1bu9 s PRO 4 CO 0.83 -1.12 0.00 1.87 0.04 0.00 0.00 177.00 178.62 1bu9 n TRP 5 N -2.97 -4.64 0.00 0.56 -0.00 -1.26 -4.48 117.44 104.66 1bu9 n TRP 5 Ca 0.07 2.80 0.00 0.00 -0.00 0.00 0.00 57.50 60.36 1bu9 n TRP 5 Cb 0.59 -3.41 0.00 0.00 -0.00 0.00 0.00 31.31 28.48 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 1.93 3.19 0.32 5.87 0.00 -1.26 -4.54 105.19 110.69 1bu9 n GLY 6 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1bu9 n GLY 6 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bu9 n ASN 7 N 0.99 0.00 0.29 1.61 5.15 -1.26 -4.47 115.26 117.57 1bu9 n ASN 7 Ca 0.00 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.82 1bu9 n ASN 7 Cb 0.00 -0.07 -0.08 0.00 -0.53 0.00 0.00 39.78 39.10 1bu9 n ASN 7 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1bu9 h GLU 8 N 0.00 -0.73 0.28 1.20 3.07 -1.88 -1.45 114.58 115.07 1bu9 h GLU 8 Ca 0.00 0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1bu9 h GLU 8 Cb 0.00 0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 28.05 1bu9 h GLU 8 CO 0.00 -0.49 -0.43 1.25 -1.40 0.00 0.00 179.01 177.95 1bu9 h LEU 9 N -0.76 -1.23 -1.69 1.33 5.85 -1.88 0.12 115.31 117.06 1bu9 h LEU 9 Ca -0.06 0.11 0.40 0.00 0.84 0.00 0.00 57.88 59.17 1bu9 h LEU 9 Cb 0.61 0.43 -0.09 0.00 0.37 0.00 0.00 40.66 41.98 1bu9 h LEU 9 CO 0.07 -0.51 0.92 0.00 -0.34 0.00 0.00 178.44 178.57 1bu9 h ALA 10 N -0.91 2.96 -0.23 1.25 0.00 -1.77 0.40 119.26 120.96 1bu9 h ALA 10 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bu9 h ALA 10 Cb 0.68 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1bu9 h ALA 10 CO -0.13 -1.44 0.00 0.45 0.00 0.00 0.00 179.25 178.13 1bu9 n SER 11 N -4.38 0.00 0.35 0.00 2.88 0.38 0.22 113.62 113.07 1bu9 n SER 11 Ca 0.32 0.96 -0.18 0.00 -1.33 0.00 0.00 58.87 58.64 1bu9 n SER 11 Cb 1.37 -0.46 -0.09 0.00 -0.75 0.00 0.00 64.21 64.27 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 -1.83 -1.07 -0.64 -1.46 0.00 -0.64 0.57 119.26 114.20 1bu9 h ALA 12 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.83 1bu9 h ALA 12 Cb 0.00 0.57 -0.12 0.00 0.00 0.00 0.00 17.79 18.24 1bu9 h ALA 12 CO 0.00 -1.12 -0.20 0.00 0.00 0.00 0.00 179.25 177.93 1bu9 h ALA 13 N -0.80 0.34 -0.18 0.00 0.00 -0.32 1.41 119.26 119.71 1bu9 h ALA 13 Ca -0.08 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bu9 h ALA 13 Cb 0.84 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1bu9 h ALA 13 CO 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.82 1bu9 n ALA 14 N -3.11 2.79 -0.01 0.00 0.00 0.58 0.28 120.51 121.04 1bu9 n ALA 14 Ca 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1bu9 n ALA 14 Cb 0.34 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 0.17 2.13 -0.40 0.00 3.00 0.46 -4.67 116.66 117.34 1bu9 n ARG 15 Ca 0.08 -0.29 0.00 0.00 -0.00 0.00 0.00 57.85 57.63 1bu9 n ARG 15 Cb 0.44 -0.79 0.00 0.00 0.00 0.00 0.00 32.46 32.11 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 0.39 0.84 3.65 5.14 0.00 0.15 -4.99 105.19 110.37 1bu9 n GLY 16 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 3.94 -0.11 1.61 9.92 -0.14 -4.87 116.55 126.90 1bu9 n ASP 17 Ca 0.00 0.79 -0.23 0.00 -0.53 0.00 0.00 54.79 54.81 1bu9 n ASP 17 Cb 0.00 -1.51 -0.11 0.00 -0.64 0.00 0.00 41.12 38.85 1bu9 n ASP 17 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1bu9 n LEU 18 N 8.17 1.88 -0.06 0.64 -0.00 -1.26 -4.16 117.00 122.20 1bu9 n LEU 18 Ca 0.22 0.41 -0.13 0.00 -0.00 0.00 0.00 56.01 56.50 1bu9 n LEU 18 Cb 0.40 -0.94 -0.07 0.00 -0.00 0.00 0.00 43.42 42.82 1bu9 n LEU 18 CO 0.68 0.33 0.57 -0.08 -0.00 0.00 0.00 177.39 178.89 1bu9 h GLU 19 N -1.00 0.46 -0.95 1.96 4.81 -2.00 -3.08 114.58 114.78 1bu9 h GLU 19 Ca -0.42 -0.26 0.30 0.00 -0.13 0.00 0.00 59.36 58.85 1bu9 h GLU 19 Cb 1.36 0.02 -0.16 0.00 0.63 0.00 0.00 28.75 30.59 1bu9 h GLU 19 CO -0.25 0.84 0.27 0.37 -0.73 0.00 0.00 179.01 179.51 1bu9 h GLN 20 N 0.11 0.11 -0.15 1.92 5.75 -1.97 0.90 115.11 121.78 1bu9 h GLN 20 Ca 0.02 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1bu9 h GLN 20 Cb 0.78 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.30 1bu9 h GLN 20 CO 0.05 0.07 0.08 -0.07 -2.65 0.00 0.00 178.83 176.31 1bu9 h LEU 21 N 0.11 0.19 0.17 -2.39 4.07 -1.70 -2.38 115.31 113.39 1bu9 h LEU 21 Ca 0.65 -0.10 -0.00 0.00 0.08 0.00 0.00 57.88 58.50 1bu9 h LEU 21 Cb 1.45 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 43.13 1bu9 h LEU 21 CO -0.76 0.24 -0.22 0.74 -1.08 0.00 0.00 178.44 177.36 1bu9 h THR 22 N 0.13 0.00 -0.22 0.22 2.02 0.81 -0.63 112.91 115.24 1bu9 h THR 22 Ca 0.05 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.25 1bu9 h THR 22 Cb 0.10 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 1bu9 h THR 22 CO -0.01 0.00 -0.14 -1.28 0.37 0.00 0.00 175.52 174.46 1bu9 h SER 23 N -0.40 -0.52 -0.99 4.18 0.87 -1.10 0.61 113.55 116.20 1bu9 h SER 23 Ca -0.02 0.08 0.33 0.00 -1.23 0.00 0.00 61.79 60.94 1bu9 h SER 23 Cb 0.36 0.23 -0.15 0.00 -0.44 0.00 0.00 62.40 62.39 1bu9 h SER 23 CO -0.05 -0.06 0.52 -0.07 -0.53 0.00 0.00 176.83 176.64 1bu9 h LEU 24 N -0.02 0.42 -0.76 2.23 4.07 -1.38 1.15 115.31 121.03 1bu9 h LEU 24 Ca 0.04 0.20 -0.08 0.00 0.08 0.00 0.00 57.88 58.11 1bu9 h LEU 24 Cb 0.11 0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 1bu9 h LEU 24 CO -0.22 -0.18 0.02 0.25 -1.08 0.00 0.00 178.44 177.23 1bu9 h LEU 25 N 0.26 0.93 -1.51 1.67 5.85 0.17 0.83 115.31 123.51 1bu9 h LEU 25 Ca 0.73 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 59.17 1bu9 h LEU 25 Cb 1.70 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.47 1bu9 h LEU 25 CO -0.64 0.98 -0.20 1.56 -0.34 0.00 0.00 178.44 179.79 1bu9 h GLN 26 N 0.89 0.00 0.00 1.25 1.08 0.44 -3.30 115.11 115.47 1bu9 h GLN 26 Ca 0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 1bu9 h GLN 26 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 1bu9 h GLN 26 CO 0.02 0.20 -0.38 -0.97 -0.95 0.00 0.00 178.83 176.76 1bu9 h ASN 27 N 0.00 0.00 0.00 1.46 -1.24 -0.00 -3.51 115.58 112.29 1bu9 h ASN 27 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1bu9 h ASN 27 Cb 0.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.60 1bu9 h ASN 27 CO 0.03 0.57 0.00 -3.20 -1.29 0.00 0.00 177.43 173.54 1bu9 n ASN 28 N -4.07 0.00 -3.54 1.15 5.15 0.28 -4.90 115.26 109.33 1bu9 n ASN 28 Ca -0.05 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.77 1bu9 n ASN 28 Cb 0.20 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.39 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 -1.98 0.00 -1.19 3.44 -7.23 -1.26 -4.41 120.40 107.76 1bu9 s VAL 29 Ca 0.00 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 60.06 1bu9 s VAL 29 Cb 0.00 -1.00 0.21 0.00 0.56 0.00 0.00 36.38 36.15 1bu9 s VAL 29 CO 0.00 0.00 1.42 0.59 -0.31 0.00 0.00 175.10 176.80 1bu9 n ASN 30 N 0.85 5.35 -0.35 4.85 3.02 -1.26 -4.84 115.26 122.87 1bu9 n ASN 30 Ca -0.16 -3.03 0.34 0.00 -0.03 0.00 0.00 54.58 51.70 1bu9 n ASN 30 Cb 0.57 -1.50 0.53 0.00 -0.61 0.00 0.00 39.78 38.78 1bu9 n ASN 30 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1bu9 n VAL 31 N 3.78 0.00 -0.06 2.41 0.31 -1.26 0.27 118.33 123.79 1bu9 n VAL 31 Ca 0.33 1.28 0.03 0.00 -0.01 0.00 0.00 64.34 65.97 1bu9 n VAL 31 Cb 0.40 -2.24 0.07 0.00 -0.91 0.00 0.00 33.84 31.17 1bu9 n VAL 31 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1bu9 n ASN 32 N -3.37 2.37 -3.56 4.52 5.03 -1.26 -4.71 115.26 114.28 1bu9 n ASN 32 Ca 0.29 -1.93 -0.16 0.00 0.87 0.00 0.00 54.58 53.65 1bu9 n ASN 32 Cb 1.62 -0.10 0.14 0.00 -1.02 0.00 0.00 39.78 40.42 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 0.03 -0.16 -3.46 5.41 0.00 0.77 -5.01 120.51 118.09 1bu9 n ALA 33 Ca 0.06 -0.95 0.01 0.00 0.00 0.00 0.00 53.44 52.55 1bu9 n ALA 33 Cb 0.32 -0.78 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 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 -3.41 0.19 0.77 0.00 -0.21 -1.26 -4.51 119.66 111.22 1bu9 s GLN 34 Ca 0.33 0.40 -0.05 0.00 0.02 0.00 0.00 55.36 56.06 1bu9 s GLN 34 Cb -0.06 0.16 0.13 0.00 1.00 0.00 0.00 33.01 34.24 1bu9 s GLN 34 CO 0.29 -0.05 1.06 1.21 -2.12 0.00 0.00 175.29 175.68 1bu9 s ASN 35 N 1.77 4.17 0.65 5.90 3.84 -1.18 -4.80 114.94 125.28 1bu9 s ASN 35 Ca -0.05 -0.09 0.26 0.00 0.21 0.00 0.00 52.86 53.19 1bu9 s ASN 35 Cb -0.03 -0.27 1.36 0.00 -0.55 0.00 0.00 41.25 41.76 1bu9 s ASN 35 CO -0.15 -1.99 1.78 1.23 -2.79 0.00 0.00 177.10 175.18 1bu9 h GLY 36 N -0.76 0.00 2.00 1.21 0.00 -1.92 1.68 103.07 105.28 1bu9 h GLY 36 Ca -0.40 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 1bu9 h GLY 36 CO 0.43 0.00 -0.28 -2.75 0.00 0.00 0.00 176.54 173.94 1bu9 h PHE 37 N 0.00 0.00 0.00 5.60 3.04 -1.94 -3.46 116.94 120.18 1bu9 h PHE 37 Ca 0.07 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1bu9 h PHE 37 Cb 1.03 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.54 1bu9 h PHE 37 CO 0.00 0.28 0.00 0.41 -2.02 0.00 0.00 178.31 176.98 1bu9 n GLY 38 N -0.10 1.04 3.79 2.40 0.00 0.57 -4.47 105.19 108.42 1bu9 n GLY 38 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.68 2.84 0.36 1.61 1.04 -1.26 -4.67 118.95 118.18 1bu9 s ARG 39 Ca 0.00 -1.00 0.08 0.00 -1.04 0.00 0.00 55.73 53.77 1bu9 s ARG 39 Cb 0.00 -2.56 -0.02 0.00 -2.04 0.00 0.00 34.95 30.33 1bu9 s ARG 39 CO 0.00 0.44 0.32 0.95 -0.04 0.00 0.00 175.30 176.97 1bu9 s THR 40 N -1.94 3.32 0.65 4.99 -4.23 -1.26 -3.12 115.64 114.04 1bu9 s THR 40 Ca 0.31 -1.36 0.31 0.00 -1.18 0.00 0.00 61.69 59.78 1bu9 s THR 40 Cb -0.09 -3.14 0.31 0.00 1.34 0.00 0.00 72.50 70.92 1bu9 s THR 40 CO 0.23 -0.13 1.95 0.00 -0.54 0.00 0.00 174.62 176.13 1bu9 h ALA 41 N 1.19 1.30 0.00 3.99 0.00 -1.90 1.20 119.26 125.04 1bu9 h ALA 41 Ca -0.44 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 1bu9 h ALA 41 Cb 1.26 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1bu9 h ALA 41 CO 0.58 -0.30 -0.85 1.25 0.00 0.00 0.00 179.25 179.94 1bu9 h LEU 42 N 0.00 0.00 0.17 0.00 5.85 -1.92 0.43 115.31 119.84 1bu9 h LEU 42 Ca 0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 1bu9 h LEU 42 Cb 0.60 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.63 1bu9 h LEU 42 CO 0.00 0.85 -1.78 -0.61 -0.34 0.00 0.00 178.44 176.56 1bu9 h GLN 43 N 0.00 0.37 -0.03 1.25 4.15 0.85 -3.34 115.11 118.36 1bu9 h GLN 43 Ca -0.01 -0.63 -0.18 0.00 0.77 0.00 0.00 58.65 58.59 1bu9 h GLN 43 Cb 1.59 0.24 -0.01 0.00 0.21 0.00 0.00 27.48 29.51 1bu9 h GLN 43 CO 0.11 1.30 -0.79 -0.39 -1.93 0.00 0.00 178.83 177.14 1bu9 h VAL 44 N 0.08 1.44 0.00 2.39 -1.51 -0.20 -3.46 116.25 114.98 1bu9 h VAL 44 Ca -0.36 -2.35 0.00 0.00 -1.23 0.00 0.00 66.70 62.76 1bu9 h VAL 44 Cb 2.07 2.28 0.00 0.00 -2.13 0.00 0.00 31.29 33.51 1bu9 h VAL 44 CO 0.16 0.69 0.00 1.15 -1.23 0.00 0.00 177.57 178.34 1bu9 n MET 45 N -3.75 0.00 -0.33 5.19 0.00 0.15 -4.44 117.12 113.94 1bu9 n MET 45 Ca -0.04 0.00 0.33 0.00 0.00 0.00 0.00 57.70 58.00 1bu9 n MET 45 Cb 0.74 0.00 0.51 0.00 0.00 0.00 0.00 33.22 34.47 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 0.01 0.00 3.17 3.00 0.79 -4.67 118.16 120.46 1bu9 n LYS 46 Ca 0.00 1.00 0.00 0.00 -0.00 0.00 0.00 58.31 59.31 1bu9 n LYS 46 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 35.03 32.59 1bu9 n LYS 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1bu9 n LEU 47 N -3.34 0.00 -0.32 3.14 4.77 -1.26 -4.59 117.00 115.40 1bu9 n LEU 47 Ca 0.28 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.25 1bu9 n LEU 47 Cb 1.60 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.75 1bu9 n LEU 47 CO 0.28 0.00 0.62 1.23 -1.33 0.00 0.00 177.39 178.19 1bu9 h GLY 48 N 0.00 0.18 -5.42 -0.72 0.00 -1.97 -3.22 103.07 91.93 1bu9 h GLY 48 Ca 0.00 0.44 -0.60 0.00 0.00 0.00 0.00 47.33 47.17 1bu9 h GLY 48 CO 0.00 -0.24 -0.26 0.54 0.00 0.00 0.00 176.54 176.58 1bu9 s ASN 49 N -5.28 6.64 -0.12 0.19 2.20 -1.26 -4.95 114.94 112.35 1bu9 s ASN 49 Ca -0.14 0.75 -0.09 0.00 -0.94 0.00 0.00 52.86 52.44 1bu9 s ASN 49 Cb 0.20 -2.22 -0.26 0.00 -2.00 0.00 0.00 41.25 36.98 1bu9 s ASN 49 CO 0.72 0.22 0.40 1.55 -2.94 0.00 0.00 177.10 177.05 1bu9 h PRO 50 N 5.63 0.26 -0.86 3.55 0.13 -1.85 -3.26 132.00 135.60 1bu9 h PRO 50 Ca -0.47 -0.45 0.25 0.00 -0.87 0.00 0.00 66.00 64.46 1bu9 h PRO 50 Cb 1.20 0.17 -0.03 0.00 0.13 0.00 0.00 31.00 32.46 1bu9 h PRO 50 CO 0.67 1.21 0.82 1.05 -0.23 0.00 0.00 178.00 181.53 1bu9 h GLU 51 N -0.02 0.00 0.00 0.86 4.11 -1.92 -0.45 114.58 117.16 1bu9 h GLU 51 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.03 1bu9 h GLU 51 Cb 1.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.23 1bu9 h GLU 51 CO 0.08 0.00 0.00 -0.89 0.07 0.00 0.00 179.01 178.27 1bu9 n ILE 52 N -3.68 0.00 -0.25 -1.06 2.08 -1.23 0.19 119.36 115.41 1bu9 n ILE 52 Ca 0.18 1.37 0.09 0.00 0.56 0.00 0.00 62.75 64.95 1bu9 n ILE 52 Cb 1.11 -1.85 0.35 0.00 -0.75 0.00 0.00 39.64 38.51 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 -1.09 1.76 0.00 -1.39 0.00 -1.32 -1.54 119.26 115.68 1bu9 h ALA 53 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1bu9 h ALA 53 Cb 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1bu9 h ALA 53 CO 0.00 0.05 -0.20 -0.09 0.00 0.00 0.00 179.25 179.01 1bu9 h ARG 54 N 0.75 -0.31 -1.32 0.00 2.43 0.15 2.31 114.38 118.40 1bu9 h ARG 54 Ca 0.40 0.02 0.42 0.00 -0.81 0.00 0.00 59.98 60.01 1bu9 h ARG 54 Cb 0.52 0.07 -0.12 0.00 -0.42 0.00 0.00 29.97 30.02 1bu9 h ARG 54 CO -0.17 -0.21 0.86 0.00 -1.51 0.00 0.00 179.97 178.95 1bu9 h ARG 55 N -0.32 0.11 0.06 0.20 2.47 0.32 1.75 114.38 118.96 1bu9 h ARG 55 Ca 0.06 -0.01 -0.32 0.00 -1.26 0.00 0.00 59.98 58.45 1bu9 h ARG 55 Cb 0.40 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.66 1bu9 h ARG 55 CO -0.19 0.07 -1.80 -0.07 0.56 0.00 0.00 179.97 178.54 1bu9 h LEU 56 N 0.11 0.18 -0.48 3.04 3.38 -0.76 -3.34 115.31 117.44 1bu9 h LEU 56 Ca 0.80 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1bu9 h LEU 56 Cb 2.51 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 43.20 1bu9 h LEU 56 CO -0.38 1.36 0.00 -0.11 0.09 0.00 0.00 178.44 179.40 1bu9 n LEU 57 N -3.24 0.60 0.12 1.67 0.00 0.75 -2.67 117.00 114.23 1bu9 n LEU 57 Ca -0.22 0.63 0.12 0.00 0.00 0.00 0.00 56.01 56.54 1bu9 n LEU 57 Cb 1.05 -0.52 0.46 0.00 0.00 0.00 0.00 43.42 44.41 1bu9 n LEU 57 CO 0.45 -0.44 0.87 0.18 0.00 0.00 0.00 177.39 178.44 1bu9 n LEU 58 N -2.14 0.73 -0.00 -1.96 7.99 0.38 -2.45 117.00 119.55 1bu9 n LEU 58 Ca 0.03 0.63 0.09 0.00 -0.01 0.00 0.00 56.01 56.75 1bu9 n LEU 58 Cb 0.26 -0.47 -0.11 0.00 -0.11 0.00 0.00 43.42 42.99 1bu9 n LEU 58 CO 0.21 -0.40 -0.16 -1.14 -1.51 0.00 0.00 177.39 174.40 1bu9 n ARG 59 N -2.25 0.77 0.00 3.23 3.00 -1.09 -4.95 116.66 115.37 1bu9 n ARG 59 Ca 0.04 -0.03 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 1bu9 n ARG 59 Cb 0.31 -1.40 0.00 0.00 0.00 0.00 0.00 32.46 31.38 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 1.44 0.59 3.41 5.14 0.00 -1.03 -5.09 105.19 109.65 1bu9 n GLY 60 Ca 0.02 -0.24 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 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 3.27 -0.42 4.61 0.00 -1.21 -4.90 121.76 123.11 1bu9 s ALA 61 Ca 0.00 -2.05 -0.42 0.00 0.00 0.00 0.00 51.96 49.50 1bu9 s ALA 61 Cb 0.00 -3.69 -0.17 0.00 0.00 0.00 0.00 23.12 19.26 1bu9 s ALA 61 CO 0.00 -2.56 1.99 0.09 0.00 0.00 0.00 175.76 175.28 1bu9 n ASN 62 N 7.00 1.46 0.02 0.00 3.02 -1.26 -4.72 115.26 120.78 1bu9 n ASN 62 Ca -0.07 0.78 0.05 0.00 -0.03 0.00 0.00 54.58 55.31 1bu9 n ASN 62 Cb 0.44 -1.03 0.24 0.00 -0.61 0.00 0.00 39.78 38.82 1bu9 n ASN 62 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1bu9 n PRO 63 N 6.67 0.03 -0.39 3.52 -0.04 -1.26 -1.57 135.00 141.95 1bu9 n PRO 63 Ca 0.42 0.38 0.08 0.00 -0.04 0.00 0.00 63.50 64.34 1bu9 n PRO 63 Cb 0.05 -1.56 0.26 0.00 -0.04 0.00 0.00 33.50 32.21 1bu9 n PRO 63 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bu9 n ASP 64 N -1.62 3.82 -4.52 3.54 -0.08 -1.26 -1.94 116.55 114.49 1bu9 n ASP 64 Ca 0.02 -2.37 -0.23 0.00 -1.51 0.00 0.00 54.79 50.70 1bu9 n ASP 64 Cb 0.11 -0.43 -0.17 0.00 2.34 0.00 0.00 41.12 42.96 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 0.58 -0.21 -4.36 -2.67 4.77 -0.61 -4.50 117.00 110.00 1bu9 n LEU 65 Ca 0.19 -0.71 -0.30 0.00 -0.03 0.00 0.00 56.01 55.16 1bu9 n LEU 65 Cb 0.70 -0.93 0.22 0.00 -2.33 0.00 0.00 43.42 41.07 1bu9 n LEU 65 CO 0.15 -1.68 -0.06 1.17 -1.33 0.00 0.00 177.39 175.64 1bu9 n LYS 66 N 6.91 -2.09 0.00 3.23 3.00 -1.26 -2.86 118.16 125.08 1bu9 n LYS 66 Ca 0.61 -0.59 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1bu9 n LYS 66 Cb 0.23 -1.91 0.00 0.00 0.00 0.00 0.00 35.03 33.34 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 -3.25 0.00 -0.04 3.14 5.75 -0.64 -4.77 116.55 116.74 1bu9 n ASP 67 Ca 0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.66 1bu9 n ASP 67 Cb 0.58 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.59 1bu9 n ASP 67 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1bu9 h ARG 68 N 0.00 0.32 -0.96 0.11 -0.00 -1.85 -2.94 114.38 109.06 1bu9 h ARG 68 Ca 0.00 -0.20 -0.07 0.00 -0.50 0.00 0.00 59.98 59.21 1bu9 h ARG 68 Cb 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 29.97 29.95 1bu9 h ARG 68 CO 0.00 0.79 0.09 0.25 0.00 0.00 0.00 179.97 181.10 1bu9 n THR 69 N -4.53 1.16 -1.07 2.04 -2.24 -1.26 -4.76 114.28 103.63 1bu9 n THR 69 Ca -0.07 -0.41 -0.02 0.00 -2.27 0.00 0.00 64.05 61.27 1bu9 n THR 69 Cb 0.41 -0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 67.94 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 0.12 0.27 3.61 3.38 0.00 -1.11 0.27 105.19 111.73 1bu9 n GLY 70 Ca 0.11 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.30 2.33 0.64 1.61 0.40 -1.26 -3.34 117.98 117.07 1bu9 s PHE 71 Ca 0.00 0.68 -0.15 0.00 -0.60 0.00 0.00 56.93 56.86 1bu9 s PHE 71 Cb 0.00 -4.22 -0.01 0.00 0.51 0.00 0.00 43.02 39.30 1bu9 s PHE 71 CO 0.00 -2.14 1.09 0.00 0.70 0.00 0.00 175.22 174.87 1bu9 s ALA 72 N 5.49 2.57 0.52 5.36 0.00 -1.24 -1.62 121.76 132.84 1bu9 s ALA 72 Ca 0.64 0.47 0.32 0.00 0.00 0.00 0.00 51.96 53.39 1bu9 s ALA 72 Cb -0.16 -3.28 1.46 0.00 0.00 0.00 0.00 23.12 21.14 1bu9 s ALA 72 CO 0.31 -1.12 1.83 0.28 0.00 0.00 0.00 175.76 177.06 1bu9 h VAL 73 N 0.12 0.48 -0.68 0.00 2.07 -1.57 2.65 116.25 119.32 1bu9 h VAL 73 Ca -0.47 -0.02 0.15 0.00 0.82 0.00 0.00 66.70 67.18 1bu9 h VAL 73 Cb 1.24 0.41 -0.11 0.00 -1.52 0.00 0.00 31.29 31.31 1bu9 h VAL 73 CO 0.55 0.01 0.09 -0.29 0.02 0.00 0.00 177.57 177.96 1bu9 h ILE 74 N 0.06 0.50 0.08 4.57 2.10 -1.71 0.38 117.51 123.49 1bu9 h ILE 74 Ca 0.52 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 66.39 1bu9 h ILE 74 Cb 1.96 0.29 -0.01 0.00 -1.09 0.00 0.00 36.82 37.96 1bu9 h ILE 74 CO -0.05 0.04 -0.14 0.45 -1.08 0.00 0.00 178.15 177.36 1bu9 h HIS 75 N 0.20 -0.40 -1.12 2.19 3.86 0.44 0.21 115.15 120.52 1bu9 h HIS 75 Ca 0.37 0.01 0.41 0.00 -1.16 0.00 0.00 60.37 60.00 1bu9 h HIS 75 Cb 0.62 0.17 -0.14 0.00 1.06 0.00 0.00 27.41 29.12 1bu9 h HIS 75 CO -0.31 -0.17 0.68 -0.25 0.86 0.00 0.00 177.93 178.74 1bu9 n ASP 76 N -3.21 0.23 -0.13 2.45 8.00 -0.11 0.31 116.55 124.09 1bu9 n ASP 76 Ca -0.03 1.33 -0.11 0.00 0.71 0.00 0.00 54.79 56.69 1bu9 n ASP 76 Cb 0.12 -0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 40.55 1bu9 n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bu9 h ALA 77 N 1.56 0.54 -0.10 2.24 0.00 0.17 -3.27 119.26 120.40 1bu9 h ALA 77 Ca 0.78 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1bu9 h ALA 77 Cb 2.36 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 20.01 1bu9 h ALA 77 CO -0.52 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1bu9 n ALA 78 N -2.45 2.42 -0.04 0.00 0.00 0.38 0.27 120.51 121.09 1bu9 n ALA 78 Ca -0.01 -0.72 -0.13 0.00 0.00 0.00 0.00 53.44 52.57 1bu9 n ALA 78 Cb 0.37 -0.44 -0.11 0.00 0.00 0.00 0.00 19.45 19.27 1bu9 n ALA 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1bu9 h ARG 79 N 2.44 -0.01 0.00 0.00 1.12 0.48 0.01 114.38 118.42 1bu9 h ARG 79 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1bu9 h ARG 79 Cb 0.58 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.54 1bu9 h ARG 79 CO 0.00 0.75 -1.29 0.00 -3.11 0.00 0.00 179.97 176.32 1bu9 n ALA 80 N -2.51 3.02 0.00 2.80 0.00 -1.25 -4.53 120.51 118.05 1bu9 n ALA 80 Ca -0.09 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1bu9 n ALA 80 Cb 0.37 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1bu9 n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bu9 n GLY 81 N 1.29 0.60 2.52 0.00 0.00 -1.25 -4.97 105.19 103.38 1bu9 n GLY 81 Ca -0.00 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.95 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 2.82 0.38 1.61 3.72 0.78 -4.95 117.46 121.81 1bu9 n PHE 82 Ca 0.00 -3.98 -0.18 0.00 -0.05 0.00 0.00 57.45 53.23 1bu9 n PHE 82 Cb 0.00 -0.49 -0.09 0.00 -0.94 0.00 0.00 39.48 37.96 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 3.64 -1.03 -1.59 4.37 6.46 -1.94 1.33 115.31 126.56 1bu9 h LEU 83 Ca 0.15 0.06 0.14 0.00 -0.12 0.00 0.00 57.88 58.11 1bu9 h LEU 83 Cb 0.68 0.30 -0.02 0.00 -0.73 0.00 0.00 40.66 40.88 1bu9 h LEU 83 CO 0.74 -0.64 0.68 0.44 -0.62 0.00 0.00 178.44 179.04 1bu9 h ASP 84 N -1.02 0.00 0.33 1.25 3.32 -1.92 3.20 116.42 121.58 1bu9 h ASP 84 Ca -0.09 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.64 1bu9 h ASP 84 Cb 0.82 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.38 1bu9 h ASP 84 CO 0.09 0.00 -1.60 0.74 -1.72 0.00 0.00 179.24 176.75 1bu9 h THR 85 N 0.00 1.10 0.00 0.35 2.02 -1.23 -2.59 112.91 112.55 1bu9 h THR 85 Ca 0.24 -2.68 -0.01 0.00 0.77 0.00 0.00 66.41 64.72 1bu9 h THR 85 Cb 1.60 2.81 -0.00 0.00 -1.74 0.00 0.00 68.15 70.82 1bu9 h THR 85 CO -0.00 0.84 -0.07 0.25 0.37 0.00 0.00 175.52 176.90 1bu9 h LEU 86 N 0.10 0.00 -0.12 2.58 6.46 1.51 -0.98 115.31 124.85 1bu9 h LEU 86 Ca -0.28 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.40 1bu9 h LEU 86 Cb 2.07 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 42.00 1bu9 h LEU 86 CO 0.19 0.07 -0.22 1.56 -0.62 0.00 0.00 178.44 179.42 1bu9 h GLN 87 N 0.00 0.37 -1.16 1.25 4.20 0.20 -2.00 115.11 117.97 1bu9 h GLN 87 Ca -0.00 -0.23 0.34 0.00 0.06 0.00 0.00 58.65 58.82 1bu9 h GLN 87 Cb 0.17 0.03 -0.11 0.00 0.30 0.00 0.00 27.48 27.87 1bu9 h GLN 87 CO 0.01 0.82 0.75 1.15 -0.67 0.00 0.00 178.83 180.89 1bu9 h THR 88 N -0.04 0.35 0.25 -0.54 2.02 -0.77 1.21 112.91 115.39 1bu9 h THR 88 Ca 0.01 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1bu9 h THR 88 Cb 0.80 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1bu9 h THR 88 CO 0.05 0.04 -0.12 -0.07 0.37 0.00 0.00 175.52 175.79 1bu9 h LEU 89 N 0.24 -0.28 -0.23 2.58 4.07 -1.32 -2.45 115.31 117.92 1bu9 h LEU 89 Ca 0.69 0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.72 1bu9 h LEU 89 Cb 1.99 0.07 -0.07 0.00 1.08 0.00 0.00 40.66 43.73 1bu9 h LEU 89 CO -0.33 0.14 -0.26 0.25 -1.08 0.00 0.00 178.44 177.16 1bu9 h LEU 90 N -1.03 -0.82 -0.86 1.67 5.85 -0.36 0.12 115.31 119.89 1bu9 h LEU 90 Ca -0.03 0.14 0.21 0.00 0.84 0.00 0.00 57.88 59.04 1bu9 h LEU 90 Cb 0.26 0.38 -0.15 0.00 0.37 0.00 0.00 40.66 41.51 1bu9 h LEU 90 CO 0.06 -0.29 0.01 -0.08 -0.34 0.00 0.00 178.44 177.79 1bu9 h GLU 91 N -0.27 0.07 -0.94 1.25 4.57 0.13 1.80 114.58 121.19 1bu9 h GLU 91 Ca 0.13 -0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.10 1bu9 h GLU 91 Cb 0.47 -0.02 -0.13 0.00 -0.16 0.00 0.00 28.75 28.92 1bu9 h GLU 91 CO -0.39 0.05 0.27 1.19 -1.18 0.00 0.00 179.01 178.95 1bu9 n PHE 92 N -5.40 1.54 -2.92 0.92 3.01 0.25 -4.92 117.46 109.94 1bu9 n PHE 92 Ca 0.17 -1.02 -0.11 0.00 1.01 0.00 0.00 57.45 57.50 1bu9 n PHE 92 Cb 0.58 -0.55 0.01 0.00 -0.01 0.00 0.00 39.48 39.51 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 -0.21 -2.32 -3.29 -1.08 1.13 0.61 -4.79 117.38 107.44 1bu9 n GLN 93 Ca 0.28 2.04 -0.20 0.00 -1.94 0.00 0.00 57.00 57.19 1bu9 n GLN 93 Cb 1.05 -5.33 0.00 0.00 0.11 0.00 0.00 30.24 26.07 1bu9 n GLN 93 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bu9 s ALA 94 N -2.51 4.39 -1.04 -1.58 0.00 -0.55 -4.74 121.76 115.74 1bu9 s ALA 94 Ca 0.26 -1.80 -0.16 0.00 0.00 0.00 0.00 51.96 50.26 1bu9 s ALA 94 Cb -0.07 -1.30 0.16 0.00 0.00 0.00 0.00 23.12 21.92 1bu9 s ALA 94 CO 0.78 -0.39 1.21 -0.51 0.00 0.00 0.00 175.76 176.86 1bu9 s ASP 95 N -4.33 6.84 0.59 0.00 1.11 -1.26 -4.82 116.67 114.80 1bu9 s ASP 95 Ca 0.52 -2.54 0.19 0.00 0.18 0.00 0.00 52.55 50.91 1bu9 s ASP 95 Cb -0.06 -2.37 1.04 0.00 1.07 0.00 0.00 42.92 42.60 1bu9 s ASP 95 CO 0.31 -0.86 1.56 1.62 1.18 0.00 0.00 175.17 178.98 1bu9 h VAL 96 N 5.20 0.00 -0.14 -1.27 3.04 -1.96 0.72 116.25 121.84 1bu9 h VAL 96 Ca 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.90 1bu9 h VAL 96 Cb 0.96 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.67 1bu9 h VAL 96 CO 1.12 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.27 1bu9 n ASN 97 N -2.60 2.90 -4.74 3.17 5.03 -1.26 -4.81 115.26 112.95 1bu9 n ASN 97 Ca -0.01 -1.89 -0.41 0.00 0.87 0.00 0.00 54.58 53.15 1bu9 n ASN 97 Cb 0.52 -0.08 -0.05 0.00 -1.02 0.00 0.00 39.78 39.15 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 -1.59 4.12 0.00 2.41 -1.16 0.25 -4.90 121.20 120.33 1bu9 s ILE 98 Ca 0.27 1.96 0.00 0.00 -0.51 0.00 0.00 60.65 62.38 1bu9 s ILE 98 Cb 0.18 -4.25 0.00 0.00 0.61 0.00 0.00 42.46 39.00 1bu9 s ILE 98 CO 0.26 0.40 0.00 -0.62 -2.81 0.00 0.00 174.94 172.17 1bu9 n GLU 99 N 2.00 2.15 0.00 3.50 1.02 -1.26 -4.14 120.64 123.91 1bu9 n GLU 99 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1bu9 n GLU 99 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.89 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 0.10 -1.59 1.62 5.75 0.42 -3.63 116.55 119.22 1bu9 n ASP 100 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.71 1bu9 n ASP 100 Cb 0.00 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.25 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 3.61 0.00 -1.12 2.85 0.76 -4.38 115.26 116.98 1bu9 n ASN 101 Ca 0.00 -2.81 0.00 0.00 -0.11 0.00 0.00 54.58 51.66 1bu9 n ASN 101 Cb 0.00 -0.67 0.00 0.00 1.24 0.00 0.00 39.78 40.35 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 -0.16 0.00 0.00 1.20 1.02 -1.26 -4.93 120.64 116.50 1bu9 n GLU 102 Ca 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1bu9 n GLU 102 Cb 1.06 -0.11 0.00 0.00 -0.02 0.00 0.00 31.44 32.37 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 -0.13 0.00 2.86 0.62 0.00 -1.26 -4.04 105.19 103.24 1bu9 n GLY 103 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 0.13 0.32 1.61 -0.87 -1.26 -3.70 114.94 111.17 1bu9 s ASN 104 Ca 0.00 -0.01 0.04 0.00 -1.57 0.00 0.00 52.86 51.32 1bu9 s ASN 104 Cb 0.00 -0.04 0.04 0.00 -0.02 0.00 0.00 41.25 41.23 1bu9 s ASN 104 CO 0.00 -0.02 0.35 0.18 -2.57 0.00 0.00 177.10 175.04 1bu9 n LEU 105 N 3.32 0.00 0.33 0.60 4.77 -1.26 0.16 117.00 124.92 1bu9 n LEU 105 Ca -0.16 -1.50 0.22 0.00 -0.03 0.00 0.00 56.01 54.54 1bu9 n LEU 105 Cb 0.57 -0.14 1.17 0.00 -2.33 0.00 0.00 43.42 42.69 1bu9 n LEU 105 CO 0.25 -0.54 1.17 1.55 -1.33 0.00 0.00 177.39 178.50 1bu9 h PRO 106 N 0.00 0.00 0.37 3.23 0.13 -1.82 0.35 132.00 134.25 1bu9 h PRO 106 Ca -0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1bu9 h PRO 106 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1bu9 h PRO 106 CO 0.26 0.00 -0.18 1.25 -0.23 0.00 0.00 178.00 179.10 1bu9 h LEU 107 N 0.00 -0.42 -1.19 1.56 6.46 -1.88 1.39 115.31 121.23 1bu9 h LEU 107 Ca -0.00 0.01 0.22 0.00 -0.12 0.00 0.00 57.88 58.00 1bu9 h LEU 107 Cb 0.03 0.11 -0.10 0.00 -0.73 0.00 0.00 40.66 39.96 1bu9 h LEU 107 CO 0.00 -0.08 0.62 0.45 -0.62 0.00 0.00 178.44 178.81 1bu9 h HIS 108 N -0.93 0.86 0.18 1.25 3.86 -1.66 0.64 115.15 119.35 1bu9 h HIS 108 Ca -0.05 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.18 1bu9 h HIS 108 Cb 0.38 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1bu9 h HIS 108 CO 0.02 0.14 -0.09 -0.07 0.86 0.00 0.00 177.93 178.80 1bu9 h LEU 109 N 0.57 -0.20 -1.75 2.43 4.07 -0.77 1.50 115.31 121.16 1bu9 h LEU 109 Ca 0.58 0.01 0.30 0.00 0.08 0.00 0.00 57.88 58.84 1bu9 h LEU 109 Cb 1.18 0.05 -0.04 0.00 1.08 0.00 0.00 40.66 42.93 1bu9 h LEU 109 CO -0.34 -0.13 0.90 0.00 -1.08 0.00 0.00 178.44 177.79 1bu9 h ALA 110 N -1.85 2.89 0.13 1.53 0.00 0.39 2.54 119.26 124.89 1bu9 h ALA 110 Ca -0.02 -0.04 -0.28 0.00 0.00 0.00 0.00 54.91 54.57 1bu9 h ALA 110 Cb 0.19 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1bu9 h ALA 110 CO 0.04 -1.42 -1.24 0.00 0.00 0.00 0.00 179.25 176.63 1bu9 h ALA 111 N 1.16 0.08 0.69 0.00 0.00 0.88 0.71 119.26 122.79 1bu9 h ALA 111 Ca 0.48 -0.84 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1bu9 h ALA 111 Cb 2.28 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 20.10 1bu9 h ALA 111 CO -0.01 0.86 -0.50 0.87 0.00 0.00 0.00 179.25 180.48 1bu9 h LYS 112 N 0.13 -1.10 0.30 0.00 1.79 1.57 -3.10 116.57 116.17 1bu9 h LYS 112 Ca -0.15 0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 1bu9 h LYS 112 Cb 1.94 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 32.84 1bu9 h LYS 112 CO 0.21 -0.73 -0.14 0.93 -1.08 0.00 0.00 179.45 178.64 1bu9 h GLU 113 N -1.14 -0.39 0.00 3.15 4.39 -1.42 -3.48 114.58 115.70 1bu9 h GLU 113 Ca -0.09 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1bu9 h GLU 113 Cb 0.94 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1bu9 h GLU 113 CO 0.05 -0.12 0.00 0.41 -1.16 0.00 0.00 179.01 178.18 1bu9 n GLY 114 N -0.67 1.37 3.44 -3.84 0.00 0.45 -4.95 105.19 100.99 1bu9 n GLY 114 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 0.52 0.00 1.61 8.25 0.22 -4.77 115.22 121.06 1bu9 n HIS 115 Ca 0.00 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.74 1bu9 n HIS 115 Cb 0.00 -1.21 0.00 0.00 1.12 0.00 0.00 29.99 29.90 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 10.29 0.00 -0.67 2.41 7.94 -1.26 0.04 117.00 135.75 1bu9 n LEU 116 Ca 0.47 0.31 0.51 0.00 -1.11 0.00 0.00 56.01 56.19 1bu9 n LEU 116 Cb 0.42 0.00 0.79 0.00 0.53 0.00 0.00 43.42 45.16 1bu9 n LEU 116 CO 1.08 0.00 1.42 -1.14 -1.11 0.00 0.00 177.39 177.64 1bu9 n ARG 117 N -0.54 -0.00 0.18 1.96 0.00 -1.26 -0.30 116.66 116.70 1bu9 n ARG 117 Ca 0.00 1.08 -0.07 0.00 -0.00 0.00 0.00 57.85 58.86 1bu9 n ARG 117 Cb 0.00 -2.44 -0.04 0.00 0.00 0.00 0.00 32.46 29.98 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 -0.93 5.15 2.07 -1.42 -2.87 116.25 118.25 1bu9 h VAL 118 Ca 0.91 -0.22 0.20 0.00 0.82 0.00 0.00 66.70 68.42 1bu9 h VAL 118 Cb 3.58 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 33.28 1bu9 h VAL 118 CO -0.07 0.00 0.60 0.58 0.02 0.00 0.00 177.57 178.71 1bu9 h VAL 119 N -0.70 0.69 -1.01 2.57 2.07 0.27 0.90 116.25 121.04 1bu9 h VAL 119 Ca -0.05 -0.17 0.26 0.00 0.82 0.00 0.00 66.70 67.56 1bu9 h VAL 119 Cb 0.37 0.15 -0.08 0.00 -1.52 0.00 0.00 31.29 30.21 1bu9 h VAL 119 CO 0.08 0.09 0.67 -0.08 0.02 0.00 0.00 177.57 178.35 1bu9 h GLU 120 N 0.50 0.34 0.08 1.57 4.81 -0.79 0.66 114.58 121.75 1bu9 h GLU 120 Ca 0.50 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.70 1bu9 h GLU 120 Cb 1.10 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1bu9 h GLU 120 CO -0.22 0.22 -0.04 0.35 -0.73 0.00 0.00 179.01 178.59 1bu9 h PHE 121 N 0.35 -0.11 -1.09 0.92 3.04 0.11 -2.78 116.94 117.38 1bu9 h PHE 121 Ca 0.55 -0.00 0.37 0.00 3.98 0.00 0.00 57.97 62.87 1bu9 h PHE 121 Cb 1.49 0.03 -0.15 0.00 2.56 0.00 0.00 35.95 39.89 1bu9 h PHE 121 CO -0.00 0.29 0.65 -0.07 -2.02 0.00 0.00 178.31 177.16 1bu9 h LEU 122 N -0.53 0.40 -0.74 0.59 -0.00 -0.78 2.00 115.31 116.25 1bu9 h LEU 122 Ca -0.01 0.18 -0.07 0.00 -0.00 0.00 0.00 57.88 57.98 1bu9 h LEU 122 Cb 0.44 0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.24 1bu9 h LEU 122 CO 0.02 -0.19 -0.33 1.62 -0.00 0.00 0.00 178.44 179.55 1bu9 h VAL 123 N 0.20 0.71 -2.36 1.22 3.04 -1.29 -3.28 116.25 114.49 1bu9 h VAL 123 Ca 0.77 -1.52 -0.55 0.00 -1.01 0.00 0.00 66.70 64.40 1bu9 h VAL 123 Cb 2.03 1.99 -0.08 0.00 -2.01 0.00 0.00 31.29 33.22 1bu9 h VAL 123 CO -0.57 0.33 -0.59 -0.54 -1.01 0.00 0.00 177.57 175.19 1bu9 s LYS 124 N -3.44 2.62 0.00 4.17 3.01 0.68 -4.50 119.74 122.27 1bu9 s LYS 124 Ca 0.02 -1.17 0.00 0.00 -1.01 0.00 0.00 55.97 53.81 1bu9 s LYS 124 Cb 0.10 -2.40 0.00 0.00 -1.01 0.00 0.00 37.83 34.52 1bu9 s LYS 124 CO 0.68 0.41 0.00 0.72 0.51 0.00 0.00 175.35 177.67 1bu9 n HIS 125 N -0.82 0.00 -0.97 3.18 8.25 -1.26 -4.81 115.22 118.79 1bu9 n HIS 125 Ca -0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.25 1bu9 n HIS 125 Cb 0.57 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.79 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 0.51 1.59 -2.24 -1.26 -4.90 114.28 107.99 1bu9 n THR 126 Ca 0.00 -0.29 0.04 0.00 -2.27 0.00 0.00 64.05 61.53 1bu9 n THR 126 Cb 0.00 -1.34 0.15 0.00 -2.10 0.00 0.00 70.33 67.05 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 -3.67 2.85 -1.10 6.98 0.00 -1.26 -4.95 120.51 119.36 1bu9 n ALA 127 Ca -0.09 -0.69 0.11 0.00 0.00 0.00 0.00 53.44 52.77 1bu9 n ALA 127 Cb 0.26 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.63 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 0.30 -5.15 -2.32 0.00 7.64 -1.24 -4.67 113.62 108.19 1bu9 n SER 128 Ca 0.11 0.80 -0.26 0.00 1.01 0.00 0.00 58.87 60.53 1bu9 n SER 128 Cb 0.50 -3.63 0.01 0.00 -1.01 0.00 0.00 64.21 60.08 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 -4.02 4.77 -3.86 6.43 6.94 -1.26 -4.89 115.26 119.37 1bu9 n ASN 129 Ca -0.04 -3.73 -0.29 0.00 -0.02 0.00 0.00 54.58 50.50 1bu9 n ASN 129 Cb 0.51 -0.42 -0.10 0.00 -2.36 0.00 0.00 39.78 37.42 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 -0.56 0.00 0.00 3.53 0.24 -1.26 0.15 118.33 120.43 1bu9 n VAL 130 Ca 0.41 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.61 1bu9 n VAL 130 Cb 0.77 -1.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.54 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 5.03 -0.02 3.33 7.63 0.00 -1.03 -4.83 105.19 115.31 1bu9 n GLY 131 Ca 0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 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 0.62 -2.01 1.61 -0.00 0.12 -4.87 115.22 110.69 1bu9 n HIS 132 Ca 0.00 -0.95 -0.42 0.00 -0.00 0.00 0.00 57.72 56.35 1bu9 n HIS 132 Cb 0.00 -1.07 -0.03 0.00 -0.00 0.00 0.00 29.99 28.90 1bu9 n HIS 132 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1bu9 s ARG 133 N 6.19 4.22 0.00 1.57 0.52 -1.26 -2.87 118.95 127.32 1bu9 s ARG 133 Ca 0.61 2.23 0.00 0.00 -0.52 0.00 0.00 55.73 58.05 1bu9 s ARG 133 Cb 0.14 -3.57 0.00 0.00 0.52 0.00 0.00 34.95 32.04 1bu9 s ARG 133 CO 0.25 -0.68 0.00 0.27 0.02 0.00 0.00 175.30 175.16 1bu9 n ASN 134 N 5.45 0.00 0.02 0.23 0.23 -1.19 -4.55 115.26 115.45 1bu9 n ASN 134 Ca 0.15 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 54.10 1bu9 n ASN 134 Cb 0.41 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.08 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 -0.22 -0.72 0.13 -2.53 3.86 -1.70 -2.44 115.15 111.53 1bu9 h HIS 135 Ca 0.00 0.03 -0.28 0.00 -1.16 0.00 0.00 60.37 58.96 1bu9 h HIS 135 Cb 0.00 0.33 0.01 0.00 1.06 0.00 0.00 27.41 28.81 1bu9 h HIS 135 CO 0.00 -0.35 -1.23 -0.22 0.86 0.00 0.00 177.93 176.99 1bu9 h LYS 136 N -0.36 0.35 0.00 2.45 3.64 -1.92 -3.47 116.57 117.25 1bu9 h LYS 136 Ca 0.09 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1bu9 h LYS 136 Cb 0.49 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1bu9 h LYS 136 CO -0.30 1.24 0.00 0.41 -2.27 0.00 0.00 179.45 178.53 1bu9 n GLY 137 N 1.46 0.05 3.57 5.01 0.00 -0.92 -5.02 105.19 109.34 1bu9 n GLY 137 Ca -0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.15 4.28 1.16 1.61 1.01 -1.26 -3.62 116.67 119.70 1bu9 s ASP 138 Ca 0.00 -0.62 -0.16 0.00 0.71 0.00 0.00 52.55 52.47 1bu9 s ASP 138 Cb 0.00 -2.57 0.25 0.00 1.01 0.00 0.00 42.92 41.62 1bu9 s ASP 138 CO 0.00 -3.67 0.57 0.35 0.21 0.00 0.00 175.17 172.64 1bu9 n THR 139 N 8.46 0.00 0.00 -1.27 -2.24 -1.25 -3.16 114.28 114.82 1bu9 n THR 139 Ca 0.44 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.22 1bu9 n THR 139 Cb 0.45 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 68.03 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 -4.86 0.85 -0.06 6.98 0.00 -1.14 -1.66 120.51 120.63 1bu9 n ALA 140 Ca -0.13 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.11 1bu9 n ALA 140 Cb 0.40 -0.84 -0.13 0.00 0.00 0.00 0.00 19.45 18.88 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 -3.45 0.00 -0.07 0.00 8.00 -0.66 -2.30 116.55 118.07 1bu9 n ASP 142 Ca -0.39 -0.27 -0.06 0.00 0.71 0.00 0.00 54.79 54.79 1bu9 n ASP 142 Cb 1.00 -0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.90 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 -1.18 1.75 0.33 0.64 4.77 -0.83 -3.14 117.00 119.34 1bu9 n LEU 143 Ca 0.13 0.54 0.18 0.00 -0.03 0.00 0.00 56.01 56.82 1bu9 n LEU 143 Cb 0.14 -0.82 0.95 0.00 -2.33 0.00 0.00 43.42 41.36 1bu9 n LEU 143 CO 0.15 -0.42 1.15 0.00 -1.33 0.00 0.00 177.39 176.94 1bu9 h ALA 144 N -1.05 1.27 0.01 -1.18 0.00 -1.58 -1.81 119.26 114.93 1bu9 h ALA 144 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bu9 h ALA 144 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1bu9 h ALA 144 CO 0.00 -0.24 -0.01 -0.09 0.00 0.00 0.00 179.25 178.92 1bu9 h ARG 145 N 0.00 -0.02 -1.13 0.00 9.65 -1.53 -0.77 114.38 120.58 1bu9 h ARG 145 Ca 0.01 0.00 0.32 0.00 -1.10 0.00 0.00 59.98 59.21 1bu9 h ARG 145 Cb 0.46 0.00 -0.09 0.00 -1.39 0.00 0.00 29.97 28.95 1bu9 h ARG 145 CO -0.00 -0.01 0.75 -0.07 2.80 0.00 0.00 179.97 183.44 1bu9 h LEU 146 N -0.03 0.31 0.00 3.80 4.07 -1.42 1.81 115.31 123.85 1bu9 h LEU 146 Ca -0.00 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1bu9 h LEU 146 Cb 0.01 0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.78 1bu9 h LEU 146 CO 0.00 0.02 0.00 -1.22 -1.08 0.00 0.00 178.44 176.16 1bu9 n TYR 147 N -4.54 0.00 0.00 1.13 4.01 -0.71 -4.85 117.16 112.20 1bu9 n TYR 147 Ca 0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.02 1bu9 n TYR 147 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.10 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 0.27 2.28 3.47 2.72 0.00 0.62 -4.97 105.19 109.58 1bu9 n GLY 148 Ca 0.15 -0.52 -0.44 0.00 0.00 0.00 0.00 46.02 45.21 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 0.00 0.55 -0.11 1.61 5.12 -0.31 -4.77 116.66 118.75 1bu9 n ARG 149 Ca 0.00 0.07 -0.25 0.00 -1.93 0.00 0.00 57.85 55.75 1bu9 n ARG 149 Cb 0.00 -2.26 -0.11 0.00 -1.16 0.00 0.00 32.46 28.93 1bu9 n ARG 149 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1bu9 n ASN 150 N 11.48 1.94 -0.13 0.55 6.94 -1.26 -2.94 115.26 131.84 1bu9 n ASN 150 Ca 0.51 0.30 0.27 0.00 -0.02 0.00 0.00 54.58 55.64 1bu9 n ASN 150 Cb 0.21 -0.83 0.66 0.00 -2.36 0.00 0.00 39.78 37.46 1bu9 n ASN 150 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1bu9 h GLU 151 N -0.77 0.00 0.25 -3.83 4.57 -1.95 2.74 114.58 115.59 1bu9 h GLU 151 Ca -0.54 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.31 1bu9 h GLU 151 Cb 1.59 0.00 0.04 0.00 -0.16 0.00 0.00 28.75 30.21 1bu9 h GLU 151 CO -0.26 0.00 -1.47 0.28 -1.18 0.00 0.00 179.01 176.38 1bu9 h VAL 152 N 0.00 1.26 0.33 0.32 2.07 -1.90 -2.15 116.25 116.19 1bu9 h VAL 152 Ca 0.40 -2.67 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 1bu9 h VAL 152 Cb 2.00 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 34.81 1bu9 h VAL 152 CO -0.00 0.81 -0.16 0.58 0.02 0.00 0.00 177.57 178.81 1bu9 h VAL 153 N 0.12 0.00 -1.06 2.57 2.07 0.43 -2.96 116.25 117.42 1bu9 h VAL 153 Ca -0.26 -0.15 0.30 0.00 0.82 0.00 0.00 66.70 67.40 1bu9 h VAL 153 Cb 2.14 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.79 1bu9 h VAL 153 CO 0.26 0.00 0.65 -1.28 0.02 0.00 0.00 177.57 177.22 1bu9 h SER 154 N -0.60 0.50 -0.44 0.57 0.87 0.14 0.36 113.55 114.96 1bu9 h SER 154 Ca -0.05 0.13 0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1bu9 h SER 154 Cb 0.34 0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 62.29 1bu9 h SER 154 CO 0.08 0.00 -0.49 0.25 -0.53 0.00 0.00 176.83 176.14 1bu9 h LEU 155 N 0.39 -1.66 0.07 2.23 7.12 -1.22 0.94 115.31 123.18 1bu9 h LEU 155 Ca 0.67 0.22 -0.00 0.00 0.13 0.00 0.00 57.88 58.90 1bu9 h LEU 155 Cb 1.61 0.69 0.00 0.00 -0.53 0.00 0.00 40.66 42.43 1bu9 h LEU 155 CO -0.44 -0.33 -0.03 0.24 -0.13 0.00 0.00 178.44 177.75 1bu9 h MET 156 N -0.29 -0.08 -1.31 1.25 2.86 -0.93 -1.13 114.93 115.30 1bu9 h MET 156 Ca 0.07 0.01 0.41 0.00 -2.06 0.00 0.00 59.70 58.13 1bu9 h MET 156 Cb 0.49 0.02 -0.11 0.00 0.06 0.00 0.00 31.60 32.05 1bu9 h MET 156 CO -0.56 0.17 0.86 1.96 1.06 0.00 0.00 176.91 180.39 1bu9 h GLN 157 N -1.00 0.12 0.11 1.72 4.20 -0.32 0.74 115.11 120.68 1bu9 h GLN 157 Ca -0.01 -0.01 -0.30 0.00 0.06 0.00 0.00 58.65 58.39 1bu9 h GLN 157 Cb 0.29 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1bu9 h GLN 157 CO 0.01 0.08 -1.54 0.00 -0.67 0.00 0.00 178.83 176.72 1bu9 h ALA 158 N 1.55 0.31 -0.14 3.87 0.00 0.87 -3.34 119.26 122.38 1bu9 h ALA 158 Ca 0.77 -1.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1bu9 h ALA 158 Cb 2.45 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 20.48 1bu9 h ALA 158 CO -0.35 1.17 0.06 0.09 0.00 0.00 0.00 179.25 180.23 1bu9 n ASN 159 N -3.43 5.66 -4.40 0.00 5.03 0.24 -4.76 115.26 113.60 1bu9 n ASN 159 Ca -0.16 -2.62 -0.39 0.00 0.87 0.00 0.00 54.58 52.28 1bu9 n ASN 159 Cb 1.04 -1.16 -0.06 0.00 -1.02 0.00 0.00 39.78 38.58 1bu9 n ASN 159 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bu9 n GLY 160 N 1.33 -0.38 0.00 7.41 0.00 -1.10 -4.73 105.19 107.73 1bu9 n GLY 160 Ca 0.16 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 -4.22 1.55 -1.00 4.61 0.00 -0.37 -4.57 120.51 116.50 1bu9 n ALA 161 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1bu9 n ALA 161 Cb 0.49 0.13 0.00 0.00 0.00 0.00 0.00 19.45 20.07 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 1.95 -2.35 0.00 0.00 0.00 -0.84 -2.46 105.19 101.49 1bu9 n GLY 162 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.14 0.00 -0.02 0.00 -1.26 -3.82 105.19 96.95 1bu9 n GLY 163 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.05 0.00 -2.59 4.61 0.00 -1.26 -4.39 120.51 115.83 1bu9 n ALA 164 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1bu9 n ALA 164 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1bu9 n ALA 164 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1bu9 s THR 165 N -1.37 4.87 0.00 0.00 2.01 -1.26 -4.81 115.64 115.09 1bu9 s THR 165 Ca 0.00 0.83 0.00 0.00 0.31 0.00 0.00 61.69 62.83 1bu9 s THR 165 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.43 1bu9 s THR 165 CO 0.00 -0.25 0.00 -0.46 -0.69 0.00 0.00 174.62 173.22 1bu9 n ASN 166 N 6.06 0.00 -3.42 3.53 6.94 -1.26 -5.04 115.26 122.07 1bu9 n ASN 166 Ca 0.00 0.00 -0.35 0.00 -0.02 0.00 0.00 54.58 54.22 1bu9 n ASN 166 Cb 0.49 0.00 0.04 0.00 -2.36 0.00 0.00 39.78 37.94 1bu9 n ASN 166 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1bu9 n LEU 167 N 0.00 -3.24 0.00 -4.53 4.32 -1.26 -5.32 117.00 106.96 1bu9 n LEU 167 Ca 0.00 -0.06 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1bu9 n LEU 167 Cb 0.00 -1.84 0.00 0.00 -1.62 0.00 0.00 43.42 39.96 1bu9 n LEU 167 CO 0.00 -0.35 0.00 0.00 -1.22 0.00 0.00 177.39 175.82