#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 -1.88 -3.89 3.04 0.00 -1.26 -5.00 120.51 111.52 1bu9 n ALA 2 Ca 0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 53.44 52.06 1bu9 n ALA 2 Cb 0.00 -1.59 0.01 0.00 0.00 0.00 0.00 19.45 17.87 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 2.41 -0.55 -2.15 0.00 2.13 -1.26 -4.90 120.64 116.32 1bu9 n GLU 3 Ca 0.14 -0.02 -0.26 0.00 0.66 0.00 0.00 57.16 57.67 1bu9 n GLU 3 Cb 0.59 -1.43 0.07 0.00 0.27 0.00 0.00 31.44 30.95 1bu9 n GLU 3 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1bu9 s PRO 4 N -6.33 2.20 -0.27 5.31 0.04 -1.26 -4.58 135.00 130.11 1bu9 s PRO 4 Ca 0.29 -0.17 -0.00 0.00 0.04 0.00 0.00 61.00 61.16 1bu9 s PRO 4 Cb -0.16 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.24 1bu9 s PRO 4 CO 0.67 -1.27 0.01 1.87 0.04 0.00 0.00 177.00 178.32 1bu9 n TRP 5 N -2.98 -3.48 0.00 0.56 -0.00 -1.26 -4.37 117.44 105.91 1bu9 n TRP 5 Ca 0.08 1.54 0.00 0.00 -0.00 0.00 0.00 57.50 59.12 1bu9 n TRP 5 Cb 0.60 -3.70 0.00 0.00 -0.00 0.00 0.00 31.31 28.22 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 0.59 1.59 0.05 5.87 0.00 -1.26 -4.12 105.19 107.92 1bu9 n GLY 6 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 2.48 -0.11 1.61 5.15 -1.26 -4.22 115.26 118.91 1bu9 n ASN 7 Ca 0.00 -0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 53.73 1bu9 n ASN 7 Cb 0.00 0.73 -0.11 0.00 -0.53 0.00 0.00 39.78 39.87 1bu9 n ASN 7 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1bu9 n GLU 8 N -2.39 0.59 0.25 1.20 2.13 -1.26 -3.95 120.64 117.21 1bu9 n GLU 8 Ca -0.17 0.42 -0.13 0.00 0.66 0.00 0.00 57.16 57.94 1bu9 n GLU 8 Cb 0.83 -1.64 -0.07 0.00 0.27 0.00 0.00 31.44 30.83 1bu9 n GLU 8 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1bu9 h LEU 9 N -0.89 -0.57 -1.62 4.31 5.85 -1.89 -2.31 115.31 118.20 1bu9 h LEU 9 Ca -0.50 -0.07 0.30 0.00 0.84 0.00 0.00 57.88 58.46 1bu9 h LEU 9 Cb 1.49 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.63 1bu9 h LEU 9 CO -0.27 -0.19 0.98 0.00 -0.34 0.00 0.00 178.44 178.63 1bu9 h ALA 10 N -0.77 2.92 -1.73 1.25 0.00 -1.81 0.30 119.26 119.43 1bu9 h ALA 10 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1bu9 h ALA 10 Cb 0.60 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1bu9 h ALA 10 CO 0.11 -1.52 0.00 0.45 0.00 0.00 0.00 179.25 178.29 1bu9 n SER 11 N -3.64 0.00 0.31 0.00 2.88 -0.88 0.19 113.62 112.47 1bu9 n SER 11 Ca 0.23 0.63 -0.18 0.00 -1.33 0.00 0.00 58.87 58.22 1bu9 n SER 11 Cb 1.32 -0.21 -0.09 0.00 -0.75 0.00 0.00 64.21 64.48 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 -1.00 -0.66 -1.46 0.00 -1.06 0.63 119.26 113.71 1bu9 h ALA 12 Ca 0.00 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.85 1bu9 h ALA 12 Cb 0.00 0.58 -0.12 0.00 0.00 0.00 0.00 17.79 18.25 1bu9 h ALA 12 CO 0.00 -1.09 -0.30 0.00 0.00 0.00 0.00 179.25 177.85 1bu9 h ALA 13 N -0.68 0.10 -0.20 0.00 0.00 -0.59 1.31 119.26 119.21 1bu9 h ALA 13 Ca -0.06 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1bu9 h ALA 13 Cb 0.80 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1bu9 h ALA 13 CO -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 179.25 178.64 1bu9 n ALA 14 N -3.19 2.94 0.05 0.00 0.00 0.13 0.27 120.51 120.71 1bu9 n ALA 14 Ca 0.06 -0.64 0.01 0.00 0.00 0.00 0.00 53.44 52.87 1bu9 n ALA 14 Cb 0.36 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.78 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 0.22 0.98 -0.65 0.00 5.12 0.43 -4.61 116.66 118.15 1bu9 n ARG 15 Ca 0.09 -0.44 0.00 0.00 -1.93 0.00 0.00 57.85 55.58 1bu9 n ARG 15 Cb 0.55 -0.91 0.00 0.00 -1.16 0.00 0.00 32.46 30.94 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 0.30 0.65 3.60 -0.13 0.00 -0.35 -4.98 105.19 104.27 1bu9 n GLY 16 Ca 0.01 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 1bu9 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bu9 s ASP 17 N -2.21 6.29 -0.14 1.61 1.11 -0.13 -4.88 116.67 118.32 1bu9 s ASP 17 Ca 0.00 0.77 -0.25 0.00 0.18 0.00 0.00 52.55 53.25 1bu9 s ASP 17 Cb 0.00 -2.54 -0.25 0.00 1.07 0.00 0.00 42.92 41.20 1bu9 s ASP 17 CO 0.00 -1.48 0.62 0.25 1.18 0.00 0.00 175.17 175.74 1bu9 h LEU 18 N 12.39 0.09 -0.08 1.23 7.12 -1.94 -3.30 115.31 130.81 1bu9 h LEU 18 Ca -0.28 -0.85 -0.02 0.00 0.13 0.00 0.00 57.88 56.86 1bu9 h LEU 18 Cb 1.11 -0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 41.21 1bu9 h LEU 18 CO 1.10 1.23 -0.04 -0.08 -0.13 0.00 0.00 178.44 180.52 1bu9 h GLU 19 N -0.86 0.16 -0.81 1.25 4.22 -2.00 -3.05 114.58 113.49 1bu9 h GLU 19 Ca -0.13 -0.07 0.15 0.00 0.08 0.00 0.00 59.36 59.39 1bu9 h GLU 19 Cb 1.22 -0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.32 1bu9 h GLU 19 CO -0.03 0.53 -0.26 0.37 -2.18 0.00 0.00 179.01 177.44 1bu9 h GLN 20 N -0.22 -0.03 -0.82 1.92 4.15 -1.98 1.31 115.11 119.44 1bu9 h GLN 20 Ca 0.02 0.00 0.13 0.00 0.77 0.00 0.00 58.65 59.57 1bu9 h GLN 20 Cb 0.49 0.01 -0.09 0.00 0.21 0.00 0.00 27.48 28.10 1bu9 h GLN 20 CO 0.01 -0.02 0.43 -0.07 -1.93 0.00 0.00 178.83 177.25 1bu9 h LEU 21 N -0.03 0.54 0.00 -2.39 4.07 -1.62 0.95 115.31 116.82 1bu9 h LEU 21 Ca 0.36 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.40 1bu9 h LEU 21 Cb 0.59 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.32 1bu9 h LEU 21 CO -0.84 0.26 0.00 0.41 -1.08 0.00 0.00 178.44 177.19 1bu9 n THR 22 N -4.84 0.00 -0.27 0.22 -1.04 0.43 -0.96 114.28 107.82 1bu9 n THR 22 Ca 0.15 1.39 0.06 0.00 -2.04 0.00 0.00 64.05 63.61 1bu9 n THR 22 Cb 0.38 -2.39 0.17 0.00 -1.82 0.00 0.00 70.33 66.66 1bu9 n THR 22 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1bu9 h SER 23 N 0.00 -0.38 -0.79 8.00 0.87 -0.65 1.44 113.55 122.04 1bu9 h SER 23 Ca 0.00 0.21 0.19 0.00 -1.23 0.00 0.00 61.79 60.95 1bu9 h SER 23 Cb 0.00 0.37 -0.05 0.00 -0.44 0.00 0.00 62.40 62.28 1bu9 h SER 23 CO 0.00 -0.20 0.54 -0.07 -0.53 0.00 0.00 176.83 176.57 1bu9 h LEU 24 N 0.09 0.26 0.00 2.23 -0.00 0.10 0.24 115.31 118.23 1bu9 h LEU 24 Ca 0.43 0.02 -0.09 0.00 -0.00 0.00 0.00 57.88 58.24 1bu9 h LEU 24 Cb 0.76 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.38 1bu9 h LEU 24 CO -0.70 0.12 -0.94 -0.07 -0.00 0.00 0.00 178.44 176.86 1bu9 h LEU 25 N 0.27 0.00 0.00 1.67 4.07 0.36 -2.91 115.31 118.77 1bu9 h LEU 25 Ca 0.39 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.35 1bu9 h LEU 25 Cb 1.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.87 1bu9 h LEU 25 CO -0.10 0.34 0.00 0.00 -1.08 0.00 0.00 178.44 177.60 1bu9 n GLN 26 N -2.93 0.62 0.04 1.13 1.13 0.94 -4.10 117.38 114.21 1bu9 n GLN 26 Ca -0.03 0.02 -0.01 0.00 -1.94 0.00 0.00 57.00 55.05 1bu9 n GLN 26 Cb 0.70 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.55 1bu9 n GLN 26 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1bu9 n ASN 27 N -1.11 1.19 -3.65 1.08 2.85 -0.99 -5.06 115.26 109.57 1bu9 n ASN 27 Ca 0.16 0.16 -0.02 0.00 -0.11 0.00 0.00 54.58 54.77 1bu9 n ASN 27 Cb 0.13 -0.38 -0.07 0.00 1.24 0.00 0.00 39.78 40.70 1bu9 n ASN 27 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1bu9 s ASN 28 N -5.98 -0.01 0.17 1.20 0.01 -1.10 -4.78 114.94 104.45 1bu9 s ASN 28 Ca -0.03 0.02 -0.20 0.00 -0.71 0.00 0.00 52.86 51.94 1bu9 s ASN 28 Cb 0.00 0.02 0.05 0.00 0.41 0.00 0.00 41.25 41.73 1bu9 s ASN 28 CO 0.04 -0.00 0.55 0.68 -1.51 0.00 0.00 177.10 176.85 1bu9 s VAL 29 N -0.06 0.02 -0.98 1.60 -7.23 -1.26 -4.69 120.40 107.80 1bu9 s VAL 29 Ca 0.08 -0.44 -0.03 0.00 -1.81 0.00 0.00 61.98 59.78 1bu9 s VAL 29 Cb -0.05 -1.29 0.27 0.00 0.56 0.00 0.00 36.38 35.87 1bu9 s VAL 29 CO -0.16 -0.10 1.10 0.59 -0.31 0.00 0.00 175.10 176.22 1bu9 n ASN 30 N -0.34 5.23 -0.26 4.85 4.13 -1.26 -4.88 115.26 122.73 1bu9 n ASN 30 Ca -0.14 -3.25 0.31 0.00 1.68 0.00 0.00 54.58 53.18 1bu9 n ASN 30 Cb 0.63 -1.15 0.52 0.00 -1.54 0.00 0.00 39.78 38.24 1bu9 n ASN 30 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1bu9 h VAL 31 N 3.61 0.04 -0.32 2.41 2.07 -1.95 2.34 116.25 124.45 1bu9 h VAL 31 Ca 0.19 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1bu9 h VAL 31 Cb 0.74 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1bu9 h VAL 31 CO 1.06 0.00 0.00 0.59 0.02 0.00 0.00 177.57 179.24 1bu9 n ASN 32 N -3.39 2.84 -3.11 0.57 5.03 -1.26 -4.50 115.26 111.44 1bu9 n ASN 32 Ca 0.25 -1.96 0.00 0.00 0.87 0.00 0.00 54.58 53.74 1bu9 n ASN 32 Cb 1.52 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 40.07 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 0.51 0.00 -3.24 5.41 0.00 0.79 -4.94 120.51 119.05 1bu9 n ALA 33 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.59 1bu9 n ALA 33 Cb 0.41 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.40 0.26 0.90 0.00 0.74 -1.26 -4.14 119.66 114.76 1bu9 s GLN 34 Ca 0.00 0.54 -0.11 0.00 0.05 0.00 0.00 55.36 55.84 1bu9 s GLN 34 Cb 0.00 0.31 0.13 0.00 1.10 0.00 0.00 33.01 34.55 1bu9 s GLN 34 CO 0.00 -0.21 1.10 1.21 -0.55 0.00 0.00 175.29 176.84 1bu9 s ASN 35 N 2.74 3.30 0.62 6.67 3.04 -1.20 -4.70 114.94 125.41 1bu9 s ASN 35 Ca 0.01 1.83 0.28 0.00 0.04 0.00 0.00 52.86 55.02 1bu9 s ASN 35 Cb -0.09 -2.43 1.42 0.00 -1.54 0.00 0.00 41.25 38.62 1bu9 s ASN 35 CO -0.15 -2.80 1.83 1.23 -3.04 0.00 0.00 177.10 174.17 1bu9 h GLY 36 N -1.66 0.00 2.00 1.21 0.00 -1.93 2.25 103.07 104.94 1bu9 h GLY 36 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1bu9 h GLY 36 CO 0.49 0.00 0.00 -2.75 0.00 0.00 0.00 176.54 174.28 1bu9 h PHE 37 N 0.00 0.00 -0.46 5.60 3.04 -1.93 -3.46 116.94 119.72 1bu9 h PHE 37 Ca 0.14 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.09 1bu9 h PHE 37 Cb 1.13 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.64 1bu9 h PHE 37 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 178.31 176.70 1bu9 n GLY 38 N 0.11 1.00 3.18 2.40 0.00 0.76 -4.51 105.19 108.12 1bu9 n GLY 38 Ca 0.01 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.70 0.29 0.70 1.61 3.03 -1.24 -4.31 118.95 116.33 1bu9 s ARG 39 Ca 0.00 0.94 -0.16 0.00 2.03 0.00 0.00 55.73 58.53 1bu9 s ARG 39 Cb 0.00 0.19 0.00 0.00 -1.03 0.00 0.00 34.95 34.11 1bu9 s ARG 39 CO 0.00 -0.29 1.07 0.25 -1.13 0.00 0.00 175.30 175.20 1bu9 n THR 40 N 5.38 3.36 0.11 4.99 -2.24 -1.26 -3.21 114.28 121.41 1bu9 n THR 40 Ca -0.08 -0.40 0.20 0.00 -2.27 0.00 0.00 64.05 61.50 1bu9 n THR 40 Cb 0.50 -1.21 0.72 0.00 -2.10 0.00 0.00 70.33 68.23 1bu9 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bu9 h ALA 41 N -0.06 2.05 0.00 6.98 0.00 -1.90 2.26 119.26 128.58 1bu9 h ALA 41 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1bu9 h ALA 41 Cb 1.34 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1bu9 h ALA 41 CO 0.49 -0.70 0.00 1.25 0.00 0.00 0.00 179.25 180.29 1bu9 h LEU 42 N 0.00 0.00 0.05 0.00 5.85 -1.92 0.68 115.31 119.97 1bu9 h LEU 42 Ca 0.18 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.57 1bu9 h LEU 42 Cb 1.19 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.18 1bu9 h LEU 42 CO -0.00 0.00 -1.86 1.67 -0.34 0.00 0.00 178.44 177.91 1bu9 n GLN 43 N -2.56 0.65 0.06 1.25 7.27 0.76 -4.27 117.38 120.54 1bu9 n GLN 43 Ca 0.00 0.36 -0.07 0.00 0.07 0.00 0.00 57.00 57.36 1bu9 n GLN 43 Cb 0.17 -1.67 0.08 0.00 2.41 0.00 0.00 30.24 31.22 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 -0.46 1.37 0.00 1.69 -1.51 -1.10 -3.47 116.25 112.76 1bu9 h VAL 44 Ca -0.45 -1.98 0.00 0.00 -1.23 0.00 0.00 66.70 63.03 1bu9 h VAL 44 Cb 1.70 1.98 0.00 0.00 -2.13 0.00 0.00 31.29 32.84 1bu9 h VAL 44 CO -0.11 0.60 0.00 1.15 -1.23 0.00 0.00 177.57 177.98 1bu9 n MET 45 N -3.88 0.00 -0.47 5.19 0.00 0.23 -4.36 117.12 113.82 1bu9 n MET 45 Ca -0.03 0.00 0.39 0.00 0.00 0.00 0.00 57.70 58.05 1bu9 n MET 45 Cb 0.64 0.00 0.59 0.00 0.00 0.00 0.00 33.22 34.45 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 0.00 0.00 3.17 3.00 0.78 -4.66 118.16 120.45 1bu9 n LYS 46 Ca 0.00 0.89 0.00 0.00 -0.00 0.00 0.00 58.31 59.20 1bu9 n LYS 46 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 35.03 32.92 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 -3.40 0.00 -0.27 3.14 4.77 -1.26 -4.66 117.00 115.32 1bu9 n LEU 47 Ca 0.32 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.31 1bu9 n LEU 47 Cb 1.58 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 42.75 1bu9 n LEU 47 CO 0.32 0.00 0.69 1.23 -1.33 0.00 0.00 177.39 178.30 1bu9 h GLY 48 N 0.00 0.46 -5.47 -0.72 0.00 -1.97 -3.27 103.07 92.11 1bu9 h GLY 48 Ca 0.00 0.30 -0.62 0.00 0.00 0.00 0.00 47.33 47.01 1bu9 h GLY 48 CO 0.00 -0.28 -0.32 0.54 0.00 0.00 0.00 176.54 176.48 1bu9 s ASN 49 N -5.24 6.58 0.19 0.19 2.20 -1.26 -4.94 114.94 112.65 1bu9 s ASN 49 Ca -0.15 0.68 0.22 0.00 -0.94 0.00 0.00 52.86 52.68 1bu9 s ASN 49 Cb 0.22 -2.18 -0.02 0.00 -2.00 0.00 0.00 41.25 37.27 1bu9 s ASN 49 CO 0.75 0.28 1.02 -0.81 -2.94 0.00 0.00 177.10 175.39 1bu9 n PRO 50 N 2.43 0.61 0.27 3.55 -0.04 -1.24 -3.31 135.00 137.27 1bu9 n PRO 50 Ca -0.15 0.11 0.13 0.00 -0.04 0.00 0.00 63.50 63.56 1bu9 n PRO 50 Cb 0.53 -1.82 0.75 0.00 -0.04 0.00 0.00 33.50 32.92 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 0.00 0.54 4.11 -1.91 -2.11 114.58 115.21 1bu9 h GLU 51 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1bu9 h GLU 51 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1bu9 h GLU 51 CO 0.00 0.11 0.00 -0.89 0.07 0.00 0.00 179.01 178.30 1bu9 n ILE 52 N -3.61 0.00 -0.34 -1.06 2.08 -1.21 0.21 119.36 115.43 1bu9 n ILE 52 Ca -0.02 1.24 0.03 0.00 0.56 0.00 0.00 62.75 64.56 1bu9 n ILE 52 Cb 0.23 -1.84 0.17 0.00 -0.75 0.00 0.00 39.64 37.45 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 -1.63 1.31 -0.35 -1.39 0.00 -1.76 -1.90 119.26 113.55 1bu9 h ALA 53 Ca 0.00 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1bu9 h ALA 53 Cb 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 17.79 17.46 1bu9 h ALA 53 CO 0.00 0.30 -0.35 -0.09 0.00 0.00 0.00 179.25 179.11 1bu9 h ARG 54 N 1.02 -0.29 -0.94 0.00 2.43 -0.35 2.09 114.38 118.34 1bu9 h ARG 54 Ca 0.42 0.02 0.28 0.00 -0.81 0.00 0.00 59.98 59.89 1bu9 h ARG 54 Cb 0.25 0.07 -0.16 0.00 -0.42 0.00 0.00 29.97 29.71 1bu9 h ARG 54 CO -0.20 -0.19 0.27 -0.09 -1.51 0.00 0.00 179.97 178.24 1bu9 h ARG 55 N -0.30 0.13 0.02 0.20 9.65 0.33 1.74 114.38 126.15 1bu9 h ARG 55 Ca 0.15 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.02 1bu9 h ARG 55 Cb 0.56 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 1bu9 h ARG 55 CO -0.51 0.09 -0.01 -0.07 2.80 0.00 0.00 179.97 182.27 1bu9 h LEU 56 N 0.14 -0.02 -0.33 3.80 3.38 -0.39 -3.35 115.31 118.54 1bu9 h LEU 56 Ca 0.63 -0.76 0.07 0.00 0.09 0.00 0.00 57.88 57.91 1bu9 h LEU 56 Cb 1.38 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.06 1bu9 h LEU 56 CO -0.73 0.82 -0.14 0.25 0.09 0.00 0.00 178.44 178.73 1bu9 h LEU 57 N -0.92 -0.47 -1.51 1.67 7.12 0.56 -0.21 115.31 121.55 1bu9 h LEU 57 Ca -0.00 0.12 0.21 0.00 0.13 0.00 0.00 57.88 58.34 1bu9 h LEU 57 Cb 0.78 0.27 -0.03 0.00 -0.53 0.00 0.00 40.66 41.15 1bu9 h LEU 57 CO 0.00 -0.17 0.85 -0.07 -0.13 0.00 0.00 178.44 178.92 1bu9 h LEU 58 N -0.08 0.00 0.00 2.25 -0.00 0.24 1.06 115.31 118.78 1bu9 h LEU 58 Ca 0.17 0.00 -0.22 0.00 -0.00 0.00 0.00 57.88 57.83 1bu9 h LEU 58 Cb 0.33 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.95 1bu9 h LEU 58 CO -0.38 0.00 -1.42 -0.09 -0.00 0.00 0.00 178.44 176.55 1bu9 h ARG 59 N 0.00 0.00 0.00 1.13 9.65 -1.18 -3.47 114.38 120.51 1bu9 h ARG 59 Ca 0.35 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.23 1bu9 h ARG 59 Cb 2.04 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.62 1bu9 h ARG 59 CO -0.00 0.48 0.00 0.41 2.80 0.00 0.00 179.97 183.65 1bu9 n GLY 60 N 1.44 0.00 3.80 2.80 0.00 0.36 -5.14 105.19 108.45 1bu9 n GLY 60 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 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 2.80 -0.52 4.61 0.00 -1.05 -4.93 121.76 122.67 1bu9 s ALA 61 Ca 0.00 0.56 -0.13 0.00 0.00 0.00 0.00 51.96 52.39 1bu9 s ALA 61 Cb 0.00 -3.26 0.13 0.00 0.00 0.00 0.00 23.12 19.99 1bu9 s ALA 61 CO 0.00 -0.55 0.45 -0.80 0.00 0.00 0.00 175.76 174.86 1bu9 s ASN 62 N -2.23 6.01 0.41 0.00 0.01 -1.26 -4.78 114.94 113.09 1bu9 s ASN 62 Ca 0.67 -1.89 0.09 0.00 -0.71 0.00 0.00 52.86 51.02 1bu9 s ASN 62 Cb -0.17 -2.13 0.88 0.00 0.41 0.00 0.00 41.25 40.24 1bu9 s ASN 62 CO 0.27 -0.78 2.01 1.55 -1.51 0.00 0.00 177.10 178.64 1bu9 h PRO 63 N 8.65 0.55 0.00 -0.60 0.13 -1.92 0.17 132.00 138.97 1bu9 h PRO 63 Ca -0.24 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1bu9 h PRO 63 Cb 1.08 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1bu9 h PRO 63 CO 0.95 0.36 0.00 -0.40 -0.23 0.00 0.00 178.00 178.68 1bu9 n ASP 64 N -4.47 0.00 -4.51 1.44 5.75 -1.26 -1.40 116.55 112.10 1bu9 n ASP 64 Ca 0.07 0.31 -0.38 0.00 -0.01 0.00 0.00 54.79 54.78 1bu9 n ASP 64 Cb 0.20 -0.40 -0.14 0.00 -1.03 0.00 0.00 41.12 39.75 1bu9 n ASP 64 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1bu9 n LEU 65 N -1.40 0.43 -4.62 -2.12 4.77 0.60 -4.55 117.00 110.12 1bu9 n LEU 65 Ca 0.05 -0.04 -0.30 0.00 -0.03 0.00 0.00 56.01 55.69 1bu9 n LEU 65 Cb 0.13 -0.99 0.23 0.00 -2.33 0.00 0.00 43.42 40.46 1bu9 n LEU 65 CO 0.11 -0.97 0.63 -0.75 -1.33 0.00 0.00 177.39 175.09 1bu9 s LYS 66 N 8.68 -0.92 0.00 3.23 2.47 -1.26 -2.99 119.74 128.95 1bu9 s LYS 66 Ca 1.29 0.01 0.00 0.00 -1.56 0.00 0.00 55.97 55.71 1bu9 s LYS 66 Cb -1.03 -1.62 0.00 0.00 -1.46 0.00 0.00 37.83 33.72 1bu9 s LYS 66 CO 0.46 -3.53 0.00 -0.40 0.16 0.00 0.00 175.35 172.04 1bu9 n ASP 67 N -4.64 0.00 -0.03 1.43 5.75 -0.63 -4.75 116.55 113.67 1bu9 n ASP 67 Ca 0.12 0.00 -0.12 0.00 -0.01 0.00 0.00 54.79 54.78 1bu9 n ASP 67 Cb 0.59 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.61 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 0.20 -0.99 0.11 -0.00 -1.79 -2.44 114.38 109.46 1bu9 h ARG 68 Ca 0.00 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.98 59.29 1bu9 h ARG 68 Cb 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 29.97 29.88 1bu9 h ARG 68 CO 0.00 0.44 0.16 0.25 0.00 0.00 0.00 179.97 180.83 1bu9 n THR 69 N -4.80 1.53 -1.93 2.04 -2.24 -1.26 -4.76 114.28 102.85 1bu9 n THR 69 Ca -0.06 -0.50 -0.14 0.00 -2.27 0.00 0.00 64.05 61.08 1bu9 n THR 69 Cb 0.20 -0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 67.57 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 0.07 0.39 3.63 3.38 0.00 -0.92 0.19 105.19 111.92 1bu9 n GLY 70 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1bu9 n GLY 70 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bu9 s PHE 71 N -2.43 2.86 0.48 1.61 0.40 -1.26 -3.13 117.98 116.52 1bu9 s PHE 71 Ca 0.00 0.98 -0.20 0.00 -0.60 0.00 0.00 56.93 57.11 1bu9 s PHE 71 Cb 0.00 -3.86 -0.09 0.00 0.51 0.00 0.00 43.02 39.59 1bu9 s PHE 71 CO 0.00 -1.35 1.03 0.00 0.70 0.00 0.00 175.22 175.60 1bu9 s ALA 72 N 4.10 2.88 0.57 5.36 0.00 -1.22 -1.60 121.76 131.86 1bu9 s ALA 72 Ca 0.52 0.59 0.36 0.00 0.00 0.00 0.00 51.96 53.42 1bu9 s ALA 72 Cb -0.15 -3.25 1.42 0.00 0.00 0.00 0.00 23.12 21.15 1bu9 s ALA 72 CO 0.21 -0.28 1.65 0.28 0.00 0.00 0.00 175.76 177.62 1bu9 h VAL 73 N 1.58 0.21 -0.46 0.00 2.07 -1.13 2.34 116.25 120.87 1bu9 h VAL 73 Ca -0.49 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.05 1bu9 h VAL 73 Cb 1.22 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1bu9 h VAL 73 CO 0.59 0.00 0.26 0.40 0.02 0.00 0.00 177.57 178.85 1bu9 h ILE 74 N 0.00 1.04 -0.23 4.57 2.04 -1.89 0.22 117.51 123.26 1bu9 h ILE 74 Ca 0.55 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 66.26 1bu9 h ILE 74 Cb 2.53 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 39.01 1bu9 h ILE 74 CO -0.01 0.10 -0.44 0.45 0.00 0.00 0.00 178.15 178.25 1bu9 h HIS 75 N 0.53 -1.33 -0.91 1.37 3.86 0.36 0.32 115.15 119.36 1bu9 h HIS 75 Ca 0.18 0.06 0.21 0.00 -1.16 0.00 0.00 60.37 59.66 1bu9 h HIS 75 Cb 0.03 0.61 -0.12 0.00 1.06 0.00 0.00 27.41 28.99 1bu9 h HIS 75 CO -0.07 -0.41 0.45 -0.44 0.86 0.00 0.00 177.93 178.32 1bu9 h ASP 76 N -0.38 0.46 -0.60 2.45 3.32 -1.32 2.20 116.42 122.56 1bu9 h ASP 76 Ca 0.04 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1bu9 h ASP 76 Cb 0.50 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1bu9 h ASP 76 CO -0.42 0.08 0.30 0.00 -1.72 0.00 0.00 179.24 177.49 1bu9 h ALA 77 N 1.68 0.77 0.00 3.45 0.00 0.28 -3.22 119.26 122.22 1bu9 h ALA 77 Ca 0.56 -0.12 -0.38 0.00 0.00 0.00 0.00 54.91 54.97 1bu9 h ALA 77 Cb 1.00 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1bu9 h ALA 77 CO -0.48 0.32 -2.06 0.00 0.00 0.00 0.00 179.25 177.04 1bu9 n ALA 78 N -2.33 1.04 -0.34 0.00 0.00 0.32 0.27 120.51 119.47 1bu9 n ALA 78 Ca 0.04 -0.87 -0.01 0.00 0.00 0.00 0.00 53.44 52.60 1bu9 n ALA 78 Cb 0.11 -0.13 0.04 0.00 0.00 0.00 0.00 19.45 19.47 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 -4.32 -0.21 0.06 0.00 0.00 0.73 -0.92 116.66 111.99 1bu9 n ARG 79 Ca -0.46 1.37 -0.20 0.00 -0.00 0.00 0.00 57.85 58.55 1bu9 n ARG 79 Cb 0.81 -2.03 -0.13 0.00 0.00 0.00 0.00 32.46 31.10 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 1.23 -0.04 0.00 5.13 0.00 -1.71 -3.41 119.26 120.46 1bu9 h ALA 80 Ca 0.31 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1bu9 h ALA 80 Cb 0.53 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1bu9 h ALA 80 CO -0.88 0.47 0.00 0.41 0.00 0.00 0.00 179.25 179.24 1bu9 n GLY 81 N 1.45 0.33 2.28 0.00 0.00 -0.10 -5.06 105.19 104.10 1bu9 n GLY 81 Ca -0.13 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 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 0.77 0.34 1.61 3.72 0.78 -4.98 117.46 119.69 1bu9 n PHE 82 Ca 0.00 -3.75 -0.17 0.00 -0.05 0.00 0.00 57.45 53.47 1bu9 n PHE 82 Cb 0.00 -0.41 -0.09 0.00 -0.94 0.00 0.00 39.48 38.04 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 3.74 -0.81 -1.67 4.37 6.46 -1.94 1.22 115.31 126.68 1bu9 h LEU 83 Ca 0.10 0.04 0.22 0.00 -0.12 0.00 0.00 57.88 58.12 1bu9 h LEU 83 Cb 0.83 0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.96 1bu9 h LEU 83 CO 0.56 -0.54 0.79 0.44 -0.62 0.00 0.00 178.44 179.07 1bu9 h ASP 84 N -0.87 0.00 0.40 1.25 3.32 -1.93 3.32 116.42 121.91 1bu9 h ASP 84 Ca -0.08 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.66 1bu9 h ASP 84 Cb 0.69 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 1bu9 h ASP 84 CO 0.10 0.00 -1.56 0.74 -1.72 0.00 0.00 179.24 176.81 1bu9 h THR 85 N 0.00 1.14 0.00 0.35 2.02 -1.30 -2.60 112.91 112.51 1bu9 h THR 85 Ca 0.36 -2.75 -0.04 0.00 0.77 0.00 0.00 66.41 64.75 1bu9 h THR 85 Cb 1.93 2.79 -0.01 0.00 -1.74 0.00 0.00 68.15 71.12 1bu9 h THR 85 CO -0.00 0.83 -0.21 0.25 0.37 0.00 0.00 175.52 176.75 1bu9 h LEU 86 N 0.08 0.00 -0.25 2.58 6.46 1.44 -1.50 115.31 124.13 1bu9 h LEU 86 Ca -0.26 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.45 1bu9 h LEU 86 Cb 2.04 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.96 1bu9 h LEU 86 CO 0.17 0.21 -0.05 1.56 -0.62 0.00 0.00 178.44 179.72 1bu9 h GLN 87 N 0.00 0.47 0.15 1.25 4.20 0.33 -0.87 115.11 120.64 1bu9 h GLN 87 Ca -0.00 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.54 1bu9 h GLN 87 Cb 0.45 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1bu9 h GLN 87 CO 0.03 0.69 -0.33 1.15 -0.67 0.00 0.00 178.83 179.69 1bu9 h THR 88 N 0.22 0.00 -0.07 -0.54 2.02 -0.89 0.29 112.91 113.94 1bu9 h THR 88 Ca 0.06 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.25 1bu9 h THR 88 Cb 0.51 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1bu9 h THR 88 CO 0.02 0.00 -0.10 -0.07 0.37 0.00 0.00 175.52 175.74 1bu9 h LEU 89 N -0.53 -0.33 -0.26 2.58 4.07 -1.39 0.78 115.31 120.24 1bu9 h LEU 89 Ca -0.02 0.04 0.03 0.00 0.08 0.00 0.00 57.88 58.02 1bu9 h LEU 89 Cb 0.50 0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.33 1bu9 h LEU 89 CO -0.14 -0.07 -0.28 0.25 -1.08 0.00 0.00 178.44 177.11 1bu9 h LEU 90 N -0.07 -0.96 -1.69 1.67 7.12 -1.05 1.51 115.31 121.83 1bu9 h LEU 90 Ca 0.01 0.13 0.44 0.00 0.13 0.00 0.00 57.88 58.59 1bu9 h LEU 90 Cb 0.11 0.40 -0.09 0.00 -0.53 0.00 0.00 40.66 40.54 1bu9 h LEU 90 CO -0.10 -0.19 0.99 -0.08 -0.13 0.00 0.00 178.44 178.93 1bu9 h GLU 91 N -0.16 0.07 -0.98 1.25 4.57 -0.02 1.43 114.58 120.74 1bu9 h GLU 91 Ca 0.04 -0.00 -0.63 0.00 -1.18 0.00 0.00 59.36 57.59 1bu9 h GLU 91 Cb 0.28 -0.02 -0.30 0.00 -0.16 0.00 0.00 28.75 28.56 1bu9 h GLU 91 CO -0.33 0.05 0.75 1.19 -1.18 0.00 0.00 179.01 179.49 1bu9 n PHE 92 N -4.37 3.14 0.00 0.92 3.72 0.50 -4.97 117.46 116.40 1bu9 n PHE 92 Ca 0.36 -2.70 0.00 0.00 -0.05 0.00 0.00 57.45 55.06 1bu9 n PHE 92 Cb 1.50 -1.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 1bu9 n PHE 92 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1bu9 n GLN 93 N -0.97 0.00 0.00 -1.08 1.13 0.49 -4.65 117.38 112.30 1bu9 n GLN 93 Ca 0.61 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.67 1bu9 n GLN 93 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.27 1bu9 n GLN 93 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bu9 n ALA 94 N 0.35 0.00 0.00 -1.58 0.00 -1.17 -4.32 120.51 113.78 1bu9 n ALA 94 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bu9 n ALA 94 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bu9 n ALA 94 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1bu9 n ASP 95 N 3.35 0.00 0.23 0.00 9.92 -1.26 -4.56 116.55 124.23 1bu9 n ASP 95 Ca 0.00 0.00 0.17 0.00 -0.53 0.00 0.00 54.79 54.43 1bu9 n ASP 95 Cb 0.00 0.00 0.73 0.00 -0.64 0.00 0.00 41.12 41.21 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 0.00 0.13 -0.09 2.53 3.04 -1.90 1.84 116.25 121.80 1bu9 h VAL 96 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1bu9 h VAL 96 Cb 0.00 0.59 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 1bu9 h VAL 96 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.15 1bu9 n ASN 97 N -3.16 2.24 -4.71 3.17 5.03 -1.26 -4.51 115.26 112.07 1bu9 n ASN 97 Ca 0.02 -1.75 -0.38 0.00 0.87 0.00 0.00 54.58 53.34 1bu9 n ASN 97 Cb 0.54 -0.05 0.05 0.00 -1.02 0.00 0.00 39.78 39.30 1bu9 n ASN 97 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bu9 n ILE 98 N 0.73 4.03 -2.53 2.41 0.00 0.63 -4.90 119.36 119.73 1bu9 n ILE 98 Ca 0.17 -0.50 0.00 0.00 0.00 0.00 0.00 62.75 62.42 1bu9 n ILE 98 Cb 0.46 -1.50 0.00 0.00 0.00 0.00 0.00 39.64 38.60 1bu9 n ILE 98 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1bu9 n GLU 99 N -1.18 3.99 0.00 9.51 1.02 -1.26 -3.26 120.64 129.46 1bu9 n GLU 99 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1bu9 n GLU 99 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.88 1bu9 n GLU 99 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1bu9 n ASP 100 N 0.00 1.01 -1.09 1.62 5.75 0.72 -3.40 116.55 121.16 1bu9 n ASP 100 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 54.79 54.82 1bu9 n ASP 100 Cb 0.00 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.29 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 3.09 0.00 -1.12 2.85 0.49 -3.72 115.26 116.85 1bu9 n ASN 101 Ca 0.00 -2.37 0.00 0.00 -0.11 0.00 0.00 54.58 52.10 1bu9 n ASN 101 Cb 0.00 -0.52 0.00 0.00 1.24 0.00 0.00 39.78 40.50 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 0.38 0.00 0.00 1.20 -0.58 -1.26 -4.95 120.64 115.42 1bu9 n GLU 102 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1bu9 n GLU 102 Cb 0.64 -0.36 0.00 0.00 -0.57 0.00 0.00 31.44 31.15 1bu9 n GLU 102 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1bu9 n GLY 103 N 0.00 3.22 3.42 0.62 0.00 -1.24 -2.02 105.19 109.19 1bu9 n GLY 103 Ca 0.00 -0.97 -0.48 0.00 0.00 0.00 0.00 46.02 44.57 1bu9 n GLY 103 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bu9 n ASN 104 N 0.54 -0.92 -4.92 1.61 4.13 -1.26 -4.04 115.26 110.40 1bu9 n ASN 104 Ca 0.00 1.14 -0.21 0.00 1.68 0.00 0.00 54.58 57.19 1bu9 n ASN 104 Cb 0.00 -0.99 -0.01 0.00 -1.54 0.00 0.00 39.78 37.25 1bu9 n ASN 104 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1bu9 s LEU 105 N 2.60 3.31 0.61 3.41 1.02 -1.26 -0.20 118.68 128.18 1bu9 s LEU 105 Ca 0.65 -0.77 0.41 0.00 0.02 0.00 0.00 54.13 54.44 1bu9 s LEU 105 Cb -0.92 -2.00 2.11 0.00 0.02 0.00 0.00 46.19 45.41 1bu9 s LEU 105 CO 0.56 -0.81 2.24 1.55 0.02 0.00 0.00 176.35 179.91 1bu9 h PRO 106 N 0.82 0.00 0.20 1.29 0.13 -1.80 -0.30 132.00 132.34 1bu9 h PRO 106 Ca -0.39 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.41 1bu9 h PRO 106 Cb 1.28 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.43 1bu9 h PRO 106 CO 0.53 0.00 -1.55 1.25 -0.23 0.00 0.00 178.00 178.00 1bu9 h LEU 107 N 0.00 0.68 -2.58 1.56 5.85 -1.87 -2.83 115.31 116.11 1bu9 h LEU 107 Ca 0.00 -0.93 -0.00 0.00 0.84 0.00 0.00 57.88 57.79 1bu9 h LEU 107 Cb 0.11 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 1bu9 h LEU 107 CO 0.00 1.72 -0.01 0.45 -0.34 0.00 0.00 178.44 180.26 1bu9 h HIS 108 N 0.05 0.00 0.12 1.25 3.86 -1.37 -0.78 115.15 118.28 1bu9 h HIS 108 Ca -0.29 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.91 1bu9 h HIS 108 Cb 2.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.53 1bu9 h HIS 108 CO 0.12 0.01 -0.06 -0.07 0.86 0.00 0.00 177.93 178.79 1bu9 h LEU 109 N 0.00 -0.14 -1.92 2.43 3.38 -1.28 0.15 115.31 117.93 1bu9 h LEU 109 Ca -0.00 0.00 0.44 0.00 0.09 0.00 0.00 57.88 58.41 1bu9 h LEU 109 Cb 0.03 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.75 1bu9 h LEU 109 CO 0.00 0.12 1.07 0.00 0.09 0.00 0.00 178.44 179.72 1bu9 h ALA 110 N -1.49 3.35 -0.06 1.53 0.00 -1.29 2.38 119.26 123.69 1bu9 h ALA 110 Ca -0.02 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1bu9 h ALA 110 Cb 0.13 0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1bu9 h ALA 110 CO 0.03 -1.81 -0.55 0.00 0.00 0.00 0.00 179.25 176.92 1bu9 h ALA 111 N 1.28 0.14 0.02 0.00 0.00 -1.10 2.43 119.26 122.03 1bu9 h ALA 111 Ca 0.74 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 55.14 1bu9 h ALA 111 Cb 2.86 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 20.60 1bu9 h ALA 111 CO -0.06 0.37 -0.43 -0.22 0.00 0.00 0.00 179.25 178.91 1bu9 h LYS 112 N 0.03 -0.58 -0.19 0.00 1.63 0.69 -2.07 116.57 116.08 1bu9 h LYS 112 Ca -0.05 0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.73 1bu9 h LYS 112 Cb 1.22 0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.98 1bu9 h LYS 112 CO 0.11 -0.39 -0.10 0.93 -3.45 0.00 0.00 179.45 176.55 1bu9 h GLU 113 N -0.60 0.41 0.00 1.90 4.39 -1.09 -3.47 114.58 116.12 1bu9 h GLU 113 Ca 0.04 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1bu9 h GLU 113 Cb 0.67 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1bu9 h GLU 113 CO -0.31 0.71 0.00 0.41 -1.16 0.00 0.00 179.01 178.66 1bu9 n GLY 114 N 0.01 1.84 3.45 -3.84 0.00 0.68 -4.96 105.19 102.37 1bu9 n GLY 114 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.54 0.61 0.00 1.61 8.25 0.60 -4.79 115.22 120.97 1bu9 n HIS 115 Ca 0.00 -0.71 0.00 0.00 -0.26 0.00 0.00 57.72 56.75 1bu9 n HIS 115 Cb 0.00 -1.34 0.00 0.00 1.12 0.00 0.00 29.99 29.77 1bu9 n HIS 115 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1bu9 n LEU 116 N 11.01 0.00 -0.56 2.41 7.94 -1.26 0.12 117.00 136.66 1bu9 n LEU 116 Ca 0.46 0.00 0.44 0.00 -1.11 0.00 0.00 56.01 55.81 1bu9 n LEU 116 Cb 0.43 0.00 0.71 0.00 0.53 0.00 0.00 43.42 45.09 1bu9 n LEU 116 CO 1.04 0.00 1.28 -2.11 -1.11 0.00 0.00 177.39 176.49 1bu9 n ARG 117 N -0.01 -0.02 0.33 1.96 -4.01 -1.26 0.49 116.66 114.15 1bu9 n ARG 117 Ca 0.00 1.10 -0.13 0.00 -1.04 0.00 0.00 57.85 57.77 1bu9 n ARG 117 Cb 0.00 -2.34 -0.06 0.00 -3.04 0.00 0.00 32.46 27.02 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 -0.97 8.89 2.07 -1.40 -2.76 116.25 122.09 1bu9 h VAL 118 Ca 0.86 -0.28 0.12 0.00 0.82 0.00 0.00 66.70 68.21 1bu9 h VAL 118 Cb 3.14 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 32.83 1bu9 h VAL 118 CO -0.22 0.00 0.61 0.58 0.02 0.00 0.00 177.57 178.57 1bu9 h VAL 119 N -1.15 0.92 -1.06 2.57 2.07 0.62 0.60 116.25 120.82 1bu9 h VAL 119 Ca -0.09 -0.32 0.31 0.00 0.82 0.00 0.00 66.70 67.42 1bu9 h VAL 119 Cb 0.67 -0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 1bu9 h VAL 119 CO 0.15 0.17 0.76 -0.08 0.02 0.00 0.00 177.57 178.59 1bu9 h GLU 120 N 0.93 0.02 0.18 1.57 4.22 -0.38 -0.42 114.58 120.70 1bu9 h GLU 120 Ca 0.47 -0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.90 1bu9 h GLU 120 Cb 0.51 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1bu9 h GLU 120 CO -0.24 0.02 -0.09 0.35 -2.18 0.00 0.00 179.01 176.87 1bu9 h PHE 121 N 0.02 -0.22 -1.48 0.92 3.04 0.51 -2.28 116.94 117.45 1bu9 h PHE 121 Ca 0.51 -0.01 0.44 0.00 3.98 0.00 0.00 57.97 62.89 1bu9 h PHE 121 Cb 2.00 0.07 -0.08 0.00 2.56 0.00 0.00 35.95 40.51 1bu9 h PHE 121 CO -0.00 0.19 1.04 -0.07 -2.02 0.00 0.00 178.31 177.45 1bu9 h LEU 122 N -0.88 0.08 0.00 0.59 -0.00 -0.98 2.25 115.31 116.37 1bu9 h LEU 122 Ca -0.02 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.88 1bu9 h LEU 122 Cb 0.51 0.03 -0.00 0.00 -0.00 0.00 0.00 40.66 41.19 1bu9 h LEU 122 CO 0.04 -0.03 -0.61 1.62 -0.00 0.00 0.00 178.44 179.46 1bu9 h VAL 123 N 0.05 0.07 -3.64 1.22 3.04 -1.38 -3.31 116.25 112.29 1bu9 h VAL 123 Ca 0.75 -1.11 -0.67 0.00 -1.01 0.00 0.00 66.70 64.66 1bu9 h VAL 123 Cb 2.80 1.77 -0.17 0.00 -2.01 0.00 0.00 31.29 33.68 1bu9 h VAL 123 CO -0.11 0.04 -0.73 -0.75 -1.01 0.00 0.00 177.57 175.00 1bu9 s LYS 124 N -3.26 2.31 0.00 4.17 2.47 0.76 -4.41 119.74 121.77 1bu9 s LYS 124 Ca 0.03 -0.89 0.00 0.00 -1.56 0.00 0.00 55.97 53.55 1bu9 s LYS 124 Cb 0.08 -2.37 0.00 0.00 -1.46 0.00 0.00 37.83 34.07 1bu9 s LYS 124 CO 0.74 0.55 0.00 0.72 0.16 0.00 0.00 175.35 177.52 1bu9 n HIS 125 N 1.18 0.00 -3.92 4.03 8.25 -1.26 -4.74 115.22 118.76 1bu9 n HIS 125 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1bu9 n HIS 125 Cb 0.52 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 31.17 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 -2.00 0.00 1.43 1.59 -2.24 -1.26 -4.94 114.28 106.85 1bu9 n THR 126 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 1bu9 n THR 126 Cb 0.00 0.00 0.06 0.00 -2.10 0.00 0.00 70.33 68.29 1bu9 n THR 126 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bu9 n ALA 127 N -3.00 2.53 -1.98 6.98 0.00 -1.26 -4.98 120.51 118.80 1bu9 n ALA 127 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.20 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 -0.08 -2.44 -2.89 0.00 7.64 -1.25 -4.54 113.62 110.06 1bu9 n SER 128 Ca 0.04 1.20 -0.20 0.00 1.01 0.00 0.00 58.87 60.92 1bu9 n SER 128 Cb 0.16 -2.46 -0.05 0.00 -1.01 0.00 0.00 64.21 60.86 1bu9 n SER 128 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1bu9 n ASN 129 N 1.88 5.07 0.00 6.43 6.94 -1.26 -4.77 115.26 129.55 1bu9 n ASN 129 Ca 0.00 -2.30 0.00 0.00 -0.02 0.00 0.00 54.58 52.26 1bu9 n ASN 129 Cb 0.00 -1.12 0.00 0.00 -2.36 0.00 0.00 39.78 36.30 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 3.65 0.00 0.90 3.53 0.24 -1.26 -2.59 118.33 122.80 1bu9 n VAL 130 Ca 0.45 0.28 -0.00 0.00 -2.04 0.00 0.00 64.34 63.02 1bu9 n VAL 130 Cb 0.29 -0.93 0.01 0.00 -1.47 0.00 0.00 33.84 31.74 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 0.00 1.82 3.51 7.63 0.00 -1.21 -4.35 105.19 112.58 1bu9 n GLY 131 Ca 0.00 -0.05 -0.12 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 0.20 0.79 -2.52 1.61 -0.00 -1.07 -4.87 115.22 109.36 1bu9 n HIS 132 Ca 0.02 -0.14 -0.42 0.00 -0.00 0.00 0.00 57.72 57.18 1bu9 n HIS 132 Cb 0.41 -2.35 -0.03 0.00 -0.00 0.00 0.00 29.99 28.03 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 8.12 4.41 0.00 1.57 0.52 -1.26 -2.88 118.95 129.43 1bu9 s ARG 133 Ca 0.72 1.61 0.00 0.00 -0.52 0.00 0.00 55.73 57.54 1bu9 s ARG 133 Cb -0.05 -3.50 0.00 0.00 0.52 0.00 0.00 34.95 31.92 1bu9 s ARG 133 CO 0.17 -0.34 0.00 0.27 0.02 0.00 0.00 175.30 175.42 1bu9 n ASN 134 N 4.76 0.00 0.10 0.23 6.94 -1.18 -4.48 115.26 121.63 1bu9 n ASN 134 Ca 0.10 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.53 1bu9 n ASN 134 Cb 0.47 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.83 1bu9 n ASN 134 CO 0.00 0.00 0.00 0.45 -1.03 0.00 0.00 177.26 176.68 1bu9 h HIS 135 N -0.48 -0.36 0.11 -2.53 3.86 -1.68 -2.74 115.15 111.32 1bu9 h HIS 135 Ca 0.00 0.01 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 1bu9 h HIS 135 Cb 0.00 0.15 0.01 0.00 1.06 0.00 0.00 27.41 28.63 1bu9 h HIS 135 CO 0.00 -0.21 -1.19 -0.22 0.86 0.00 0.00 177.93 177.17 1bu9 h LYS 136 N -0.28 0.36 0.00 2.45 3.64 -1.87 -3.47 116.57 117.39 1bu9 h LYS 136 Ca 0.02 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1bu9 h LYS 136 Cb 0.29 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1bu9 h LYS 136 CO -0.07 1.23 0.00 0.41 -2.27 0.00 0.00 179.45 178.75 1bu9 n GLY 137 N 1.39 -0.21 3.57 5.01 0.00 -1.04 -5.02 105.19 108.89 1bu9 n GLY 137 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.29 5.04 0.84 1.61 1.01 -1.26 -3.76 116.67 119.87 1bu9 s ASP 138 Ca 0.00 -1.40 -0.05 0.00 0.71 0.00 0.00 52.55 51.81 1bu9 s ASP 138 Cb 0.00 -2.58 0.08 0.00 1.01 0.00 0.00 42.92 41.43 1bu9 s ASP 138 CO 0.00 -3.01 0.18 0.35 0.21 0.00 0.00 175.17 172.89 1bu9 n THR 139 N 7.84 0.00 0.77 -1.27 -2.24 -1.25 -3.11 114.28 115.01 1bu9 n THR 139 Ca 0.44 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 62.28 1bu9 n THR 139 Cb 0.47 -0.20 0.37 0.00 -2.10 0.00 0.00 70.33 68.86 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 -2.94 1.94 -0.11 6.98 0.00 -1.14 -2.16 120.51 123.08 1bu9 n ALA 140 Ca -0.04 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.13 1bu9 n ALA 140 Cb 0.12 -1.21 -0.12 0.00 0.00 0.00 0.00 19.45 18.24 1bu9 n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bu9 h ASP 142 N -0.04 0.00 0.00 0.00 1.82 -1.67 0.18 116.42 116.72 1bu9 h ASP 142 Ca -0.56 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.08 1bu9 h ASP 142 Cb 1.90 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.91 1bu9 h ASP 142 CO -0.08 0.00 0.00 0.18 -1.61 0.00 0.00 179.24 177.73 1bu9 n LEU 143 N -2.83 0.26 0.16 2.28 4.77 -1.09 -2.94 117.00 117.61 1bu9 n LEU 143 Ca -0.02 0.25 0.10 0.00 -0.03 0.00 0.00 56.01 56.30 1bu9 n LEU 143 Cb 0.08 -0.43 0.53 0.00 -2.33 0.00 0.00 43.42 41.28 1bu9 n LEU 143 CO 0.17 -0.43 0.82 0.00 -1.33 0.00 0.00 177.39 176.62 1bu9 n ALA 144 N -2.02 0.94 -0.05 -1.18 0.00 -1.18 -2.05 120.51 114.97 1bu9 n ALA 144 Ca 0.00 0.18 -0.17 0.00 0.00 0.00 0.00 53.44 53.45 1bu9 n ALA 144 Cb 0.00 -1.19 -0.13 0.00 0.00 0.00 0.00 19.45 18.13 1bu9 n ALA 144 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1bu9 h ARG 145 N 0.00 0.06 -0.45 0.00 9.65 -0.76 0.85 114.38 123.74 1bu9 h ARG 145 Ca 0.00 -0.10 -0.10 0.00 -1.10 0.00 0.00 59.98 58.68 1bu9 h ARG 145 Cb 0.14 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1bu9 h ARG 145 CO 0.00 1.05 -0.11 -0.07 2.80 0.00 0.00 179.97 183.64 1bu9 h LEU 146 N -0.86 0.80 0.00 3.80 -0.00 -1.29 -2.32 115.31 115.43 1bu9 h LEU 146 Ca -0.10 -0.24 0.00 0.00 -0.00 0.00 0.00 57.88 57.54 1bu9 h LEU 146 Cb 1.20 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 1bu9 h LEU 146 CO -0.01 0.93 0.00 -1.22 -0.00 0.00 0.00 178.44 178.14 1bu9 n TYR 147 N -4.16 0.00 0.00 1.13 4.01 -0.96 -4.81 117.16 112.37 1bu9 n TYR 147 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1bu9 n TYR 147 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 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 0.25 2.78 3.56 2.72 0.00 -0.87 -4.96 105.19 108.67 1bu9 n GLY 148 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.58 1.73 -0.16 1.61 3.00 0.29 -4.72 118.95 120.12 1bu9 s ARG 149 Ca 0.00 0.10 -0.23 0.00 0.00 0.00 0.00 55.73 55.60 1bu9 s ARG 149 Cb 0.00 -4.89 -0.24 0.00 0.00 0.00 0.00 34.95 29.82 1bu9 s ARG 149 CO 0.00 -4.44 0.51 -2.95 0.00 0.00 0.00 175.30 168.42 1bu9 h ASN 150 N 12.09 0.11 -0.91 0.23 -1.07 -1.89 -2.41 115.58 121.72 1bu9 h ASN 150 Ca 0.03 -0.77 0.26 0.00 0.07 0.00 0.00 56.30 55.89 1bu9 h ASN 150 Cb 1.00 -0.03 -0.04 0.00 -2.07 0.00 0.00 38.32 37.18 1bu9 h ASN 150 CO 1.05 1.35 0.81 1.05 0.07 0.00 0.00 177.43 181.76 1bu9 h GLU 151 N -0.82 0.00 0.22 4.14 4.11 -1.92 2.80 114.58 123.11 1bu9 h GLU 151 Ca -0.21 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 58.89 1bu9 h GLU 151 Cb 1.32 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.60 1bu9 h GLU 151 CO -0.06 0.00 -1.45 0.28 0.07 0.00 0.00 179.01 177.84 1bu9 h VAL 152 N 0.00 1.30 0.41 -1.06 2.07 -1.90 -2.16 116.25 114.91 1bu9 h VAL 152 Ca 0.43 -2.78 -0.02 0.00 0.82 0.00 0.00 66.70 65.16 1bu9 h VAL 152 Cb 2.05 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 34.82 1bu9 h VAL 152 CO -0.00 0.83 -0.20 0.58 0.02 0.00 0.00 177.57 178.80 1bu9 h VAL 153 N 0.13 0.00 -1.05 2.57 2.07 0.48 -2.95 116.25 117.50 1bu9 h VAL 153 Ca -0.24 -0.25 0.28 0.00 0.82 0.00 0.00 66.70 67.31 1bu9 h VAL 153 Cb 2.12 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 31.80 1bu9 h VAL 153 CO 0.25 0.00 0.69 -1.28 0.02 0.00 0.00 177.57 177.25 1bu9 h SER 154 N -0.80 0.38 -0.50 0.57 0.87 0.14 0.86 113.55 115.08 1bu9 h SER 154 Ca -0.06 0.07 0.09 0.00 -1.23 0.00 0.00 61.79 60.66 1bu9 h SER 154 Cb 0.42 0.01 -0.10 0.00 -0.44 0.00 0.00 62.40 62.29 1bu9 h SER 154 CO 0.09 0.07 -0.37 0.25 -0.53 0.00 0.00 176.83 176.35 1bu9 h LEU 155 N 0.33 -1.24 0.00 2.23 7.12 -1.21 0.91 115.31 123.45 1bu9 h LEU 155 Ca 0.59 0.22 -0.11 0.00 0.13 0.00 0.00 57.88 58.70 1bu9 h LEU 155 Cb 1.61 0.58 -0.02 0.00 -0.53 0.00 0.00 40.66 42.30 1bu9 h LEU 155 CO -0.26 -0.33 -0.64 0.24 -0.13 0.00 0.00 178.44 177.33 1bu9 h MET 156 N -0.23 0.00 -0.97 1.25 2.86 -0.61 -2.37 114.93 114.87 1bu9 h MET 156 Ca 0.19 0.00 0.29 0.00 -2.06 0.00 0.00 59.70 58.12 1bu9 h MET 156 Cb 0.56 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.07 1bu9 h MET 156 CO -0.62 0.89 0.48 1.96 1.06 0.00 0.00 176.91 180.68 1bu9 h GLN 157 N -1.00 0.32 0.03 1.72 4.20 0.71 0.21 115.11 121.30 1bu9 h GLN 157 Ca -0.17 -0.02 -0.14 0.00 0.06 0.00 0.00 58.65 58.38 1bu9 h GLN 157 Cb 1.07 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.79 1bu9 h GLN 157 CO -0.10 0.21 -0.56 0.00 -0.67 0.00 0.00 178.83 177.70 1bu9 h ALA 158 N 1.82 0.03 -0.19 3.87 0.00 0.74 -3.25 119.26 122.27 1bu9 h ALA 158 Ca 0.67 -0.57 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1bu9 h ALA 158 Cb 1.46 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.23 1bu9 h ALA 158 CO -0.60 0.30 0.15 0.09 0.00 0.00 0.00 179.25 179.19 1bu9 n ASN 159 N -4.26 5.80 -2.75 0.00 3.02 0.60 -4.88 115.26 112.79 1bu9 n ASN 159 Ca -0.11 -2.68 -0.03 0.00 -0.03 0.00 0.00 54.58 51.74 1bu9 n ASN 159 Cb 0.66 -1.11 -0.02 0.00 -0.61 0.00 0.00 39.78 38.70 1bu9 n ASN 159 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bu9 n GLY 160 N 1.08 -2.90 0.00 7.41 0.00 -0.34 -4.89 105.19 105.55 1bu9 n GLY 160 Ca 0.13 0.89 0.00 0.00 0.00 0.00 0.00 46.02 47.04 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 2.08 0.00 -1.57 4.61 0.00 -0.94 -4.68 120.51 120.01 1bu9 n ALA 161 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.93 1bu9 n ALA 161 Cb 0.32 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.84 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 0.00 1.65 0.18 0.00 0.00 -1.21 -3.34 107.32 104.59 1bu9 s GLY 162 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 44.72 44.64 1bu9 s GLY 162 CO 0.00 0.31 0.18 0.61 0.00 0.00 0.00 173.10 174.20 1bu9 n GLY 163 N -2.07 -2.00 0.10 0.20 0.00 -1.26 -4.71 105.19 95.45 1bu9 n GLY 163 Ca 0.07 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 1bu9 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bu9 n ALA 164 N -3.23 1.55 0.00 4.61 0.00 -1.26 -4.95 120.51 117.24 1bu9 n ALA 164 Ca -0.03 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.42 1bu9 n ALA 164 Cb 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.50 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 -2.95 0.00 -3.10 0.00 5.66 -1.26 -5.15 114.28 107.47 1bu9 n THR 165 Ca -0.34 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1bu9 n THR 165 Cb 0.96 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.74 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 -0.03 -2.98 -3.35 1.09 5.15 -1.26 -4.74 115.26 109.14 1bu9 n ASN 166 Ca 0.00 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 53.75 1bu9 n ASN 166 Cb 0.00 0.00 0.18 0.00 -0.53 0.00 0.00 39.78 39.43 1bu9 n ASN 166 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1bu9 n LEU 167 N 0.00 0.00 0.00 1.20 4.32 -1.26 -5.26 117.00 116.00 1bu9 n LEU 167 Ca 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 56.01 55.03 1bu9 n LEU 167 Cb 0.00 -0.77 0.00 0.00 -1.62 0.00 0.00 43.42 41.03 1bu9 n LEU 167 CO 0.00 -1.69 0.00 1.67 -1.22 0.00 0.00 177.39 176.15