#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9p n ASN 32 N 0.00 -1.43 -3.20 1.61 6.94 -1.26 -5.18 115.26 112.74 2k9p n ASN 32 Ca 0.00 -1.68 -0.21 0.00 -0.02 0.00 0.00 54.58 52.67 2k9p n ASN 32 Cb 0.00 2.30 0.18 0.00 -2.36 0.00 0.00 39.78 39.90 2k9p n ASN 32 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2k9p n GLY 33 N -0.67 -3.02 3.23 4.83 0.00 -1.26 -5.02 105.19 103.28 2k9p n GLY 33 Ca -0.01 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2k9p n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k9p s SER 34 N -3.30 6.01 -0.04 1.61 1.04 -1.26 -4.83 113.70 112.92 2k9p s SER 34 Ca 0.48 -2.50 0.14 0.00 0.48 0.00 0.00 55.95 54.55 2k9p s SER 34 Cb -0.06 -2.06 0.27 0.00 0.10 0.00 0.00 66.02 64.27 2k9p s SER 34 CO 0.38 -0.56 1.12 1.07 0.98 0.00 0.00 173.24 176.22 2k9p n THR 35 N 4.12 0.49 -2.87 2.02 5.66 -1.26 -5.10 114.28 117.35 2k9p n THR 35 Ca 0.05 -1.09 -0.30 0.00 -3.05 0.00 0.00 64.05 59.67 2k9p n THR 35 Cb 0.42 0.53 -0.03 0.00 -1.55 0.00 0.00 70.33 69.71 2k9p n THR 35 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2k9p s ILE 36 N -0.73 4.83 1.21 1.09 1.09 -1.26 -5.09 121.20 122.34 2k9p s ILE 36 Ca 0.23 0.49 -0.15 0.00 -1.10 0.00 0.00 60.65 60.12 2k9p s ILE 36 Cb 0.24 -3.75 0.30 0.00 -1.06 0.00 0.00 42.46 38.18 2k9p s ILE 36 CO -0.08 -0.55 1.02 -0.89 -0.10 0.00 0.00 174.94 174.33 2k9p s THR 37 N -2.40 1.84 -0.56 2.92 2.01 -1.26 -4.90 115.64 113.29 2k9p s THR 37 Ca 0.50 0.00 0.13 0.00 0.31 0.00 0.00 61.69 62.63 2k9p s THR 37 Cb -0.10 -2.13 0.13 0.00 0.01 0.00 0.00 72.50 70.40 2k9p s THR 37 CO 0.33 0.00 1.39 0.49 -0.69 0.00 0.00 174.62 176.15 2k9p n PHE 38 N -5.00 0.42 -0.13 4.92 3.72 -1.26 -3.14 117.46 116.98 2k9p n PHE 38 Ca 0.05 0.21 -0.04 0.00 -0.05 0.00 0.00 57.45 57.63 2k9p n PHE 38 Cb 0.56 -0.84 0.04 0.00 -0.94 0.00 0.00 39.48 38.29 2k9p n PHE 38 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2k9p h ASP 39 N 0.00 -0.20 -0.71 4.37 5.19 -1.99 0.11 116.42 123.19 2k9p h ASP 39 Ca 0.00 0.10 0.09 0.00 -0.62 0.00 0.00 57.03 56.60 2k9p h ASP 39 Cb 0.02 0.19 -0.07 0.00 0.18 0.00 0.00 39.33 39.65 2k9p h ASP 39 CO 0.00 -0.06 0.36 1.05 -3.12 0.00 0.00 179.24 177.47 2k9p h GLU 40 N 0.10 0.61 0.42 3.56 4.11 -1.91 -1.13 114.58 120.33 2k9p h GLU 40 Ca 0.21 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.59 2k9p h GLU 40 Cb 0.31 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2k9p h GLU 40 CO -0.36 0.40 -0.20 -0.07 0.07 0.00 0.00 179.01 178.85 2k9p h LEU 41 N 0.62 -0.48 -0.92 3.06 -0.00 -1.47 0.40 115.31 116.53 2k9p h LEU 41 Ca 0.35 -0.04 0.17 0.00 -0.00 0.00 0.00 57.88 58.36 2k9p h LEU 41 Cb 0.35 0.12 -0.10 0.00 -0.00 0.00 0.00 40.66 41.03 2k9p h LEU 41 CO -0.26 -0.26 0.51 1.56 -0.00 0.00 0.00 178.44 179.99 2k9p h GLN 42 N -0.67 0.64 0.48 1.13 1.08 -0.50 0.32 115.11 117.58 2k9p h GLN 42 Ca -0.06 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.08 2k9p h GLN 42 Cb 0.49 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 2k9p h GLN 42 CO 0.09 0.42 -0.23 0.78 -0.95 0.00 0.00 178.83 178.95 2k9p h GLY 43 N 0.66 -0.67 1.18 3.46 0.00 -1.05 -1.04 103.07 105.61 2k9p h GLY 43 Ca 0.52 0.25 0.07 0.00 0.00 0.00 0.00 47.33 48.17 2k9p h GLY 43 CO -0.39 -0.24 0.39 0.17 0.00 0.00 0.00 176.54 176.46 2k9p h LEU 44 N -0.86 0.45 -0.44 3.11 8.10 -0.64 0.14 115.31 125.17 2k9p h LEU 44 Ca -0.07 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 57.80 2k9p h LEU 44 Cb 0.49 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.61 2k9p h LEU 44 CO 0.11 0.29 -0.24 0.58 -4.11 0.00 0.00 178.44 175.07 2k9p h VAL 45 N 0.51 1.27 -0.58 0.15 2.07 -0.44 0.24 116.25 119.48 2k9p h VAL 45 Ca 0.25 -1.40 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 2k9p h VAL 45 Cb 0.34 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 2k9p h VAL 45 CO -0.07 0.48 0.04 -3.20 0.02 0.00 0.00 177.57 174.83 2k9p n ASN 46 N -4.14 5.47 0.00 0.57 5.15 -0.40 -1.35 115.26 120.56 2k9p n ASN 46 Ca -0.01 -2.99 0.00 0.00 -0.60 0.00 0.00 54.58 50.98 2k9p n ASN 46 Cb 0.47 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 2k9p n ASN 46 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2k9p n SER 47 N 0.41 0.00 -0.10 1.20 2.88 0.39 -4.78 113.62 113.62 2k9p n SER 47 Ca 0.29 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.64 2k9p n SER 47 Cb 1.21 0.09 -0.10 0.00 -0.75 0.00 0.00 64.21 64.66 2k9p n SER 47 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2k9p n THR 48 N -2.14 1.52 -0.05 2.46 -1.04 0.20 -4.15 114.28 111.09 2k9p n THR 48 Ca 0.00 -0.01 -0.14 0.00 -2.04 0.00 0.00 64.05 61.86 2k9p n THR 48 Cb 0.00 -2.09 -0.08 0.00 -1.82 0.00 0.00 70.33 66.34 2k9p n THR 48 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2k9p h VAL 49 N -1.00 1.38 -0.92 12.58 2.07 -0.77 -3.26 116.25 126.34 2k9p h VAL 49 Ca -0.32 -1.51 0.26 0.00 0.82 0.00 0.00 66.70 65.96 2k9p h VAL 49 Cb 1.20 2.06 -0.15 0.00 -1.52 0.00 0.00 31.29 32.89 2k9p h VAL 49 CO -0.19 0.44 0.32 0.00 0.02 0.00 0.00 177.57 178.16 2k9p h THR 50 N -0.05 0.30 -0.62 2.57 1.03 -1.43 0.14 112.91 114.86 2k9p h THR 50 Ca 0.00 -0.08 -0.06 0.00 -0.01 0.00 0.00 66.41 66.27 2k9p h THR 50 Cb 0.82 0.05 -0.03 0.00 -1.07 0.00 0.00 68.15 67.92 2k9p h THR 50 CO 0.05 0.04 0.15 -0.61 -0.01 0.00 0.00 175.52 175.14 2k9p h GLN 51 N 0.23 0.97 -0.38 0.00 -0.00 -1.72 -2.54 115.11 111.67 2k9p h GLN 51 Ca 0.61 -0.21 0.03 0.00 -0.00 0.00 0.00 58.65 59.07 2k9p h GLN 51 Cb 1.28 -0.14 -0.03 0.00 0.00 0.00 0.00 27.48 28.59 2k9p h GLN 51 CO -0.65 0.86 0.20 0.00 0.00 0.00 0.00 178.83 179.23 2k9p h ALA 52 N 1.24 0.47 0.65 3.38 0.00 -0.76 0.11 119.26 124.35 2k9p h ALA 52 Ca 0.20 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2k9p h ALA 52 Cb 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2k9p h ALA 52 CO -0.00 -0.16 -0.33 0.82 0.00 0.00 0.00 179.25 179.58 2k9p h ILE 53 N 0.40 0.33 -0.18 0.00 5.03 -1.28 -1.00 117.51 120.81 2k9p h ILE 53 Ca 0.16 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.94 2k9p h ILE 53 Cb 0.06 0.33 -0.04 0.00 -3.03 0.00 0.00 36.82 34.14 2k9p h ILE 53 CO -0.11 0.00 -0.06 -0.07 -0.68 0.00 0.00 178.15 177.23 2k9p h LEU 54 N -0.89 -0.21 0.00 1.44 3.38 -1.28 -1.32 115.31 116.44 2k9p h LEU 54 Ca -0.09 0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2k9p h LEU 54 Cb 0.69 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2k9p h LEU 54 CO 0.13 -0.08 -0.18 0.15 0.09 0.00 0.00 178.44 178.56 2k9p h PHE 55 N -0.02 -0.46 -0.79 1.13 3.57 -0.77 -1.52 116.94 118.08 2k9p h PHE 55 Ca 0.09 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.69 2k9p h PHE 55 Cb 0.16 0.20 -0.07 0.00 2.79 0.00 0.00 35.95 39.04 2k9p h PHE 55 CO -0.22 -0.25 0.45 0.78 -2.23 0.00 0.00 178.31 176.84 2k9p h GLY 56 N -0.29 1.22 0.65 2.40 0.00 -0.89 0.03 103.07 106.18 2k9p h GLY 56 Ca 0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 2k9p h GLY 56 CO -0.16 0.13 -0.31 -2.08 0.00 0.00 0.00 176.54 174.12 2k9p h VAL 57 N 0.77 0.00 -0.93 4.60 2.07 -0.79 -0.41 116.25 121.56 2k9p h VAL 57 Ca 0.38 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.93 2k9p h VAL 57 Cb 0.33 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.04 2k9p h VAL 57 CO -0.24 0.00 0.60 0.08 0.02 0.00 0.00 177.57 178.03 2k9p h ARG 58 N -0.91 1.00 0.40 1.57 0.11 -1.24 -1.74 114.38 113.58 2k9p h ARG 58 Ca -0.09 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 59.91 2k9p h ARG 58 Cb 0.67 -0.23 0.00 0.00 1.11 0.00 0.00 29.97 31.52 2k9p h ARG 58 CO 0.15 0.66 -0.19 1.03 0.10 0.00 0.00 179.97 181.72 2k9p h SER 59 N 1.03 -0.46 -0.47 0.08 0.87 -0.95 0.66 113.55 114.32 2k9p h SER 59 Ca 0.41 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.98 2k9p h SER 59 Cb 0.24 0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 2k9p h SER 59 CO -0.16 -0.29 0.26 1.23 -0.53 0.00 0.00 176.83 177.34 2k9p h GLY 60 N -0.59 0.66 0.99 5.77 0.00 -0.77 0.15 103.07 109.29 2k9p h GLY 60 Ca -0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 2k9p h GLY 60 CO 0.09 0.15 -0.08 0.00 0.00 0.00 0.00 176.54 176.70 2k9p h ALA 61 N 1.23 -0.22 -0.80 3.60 0.00 -1.29 -0.12 119.26 121.65 2k9p h ALA 61 Ca 0.19 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.12 2k9p h ALA 61 Cb 0.05 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2k9p h ALA 61 CO -0.11 -0.62 0.52 0.00 0.00 0.00 0.00 179.25 179.04 2k9p h ALA 62 N 0.60 1.64 0.12 0.00 0.00 -0.58 -0.77 119.26 120.28 2k9p h ALA 62 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2k9p h ALA 62 Cb 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2k9p h ALA 62 CO 0.04 0.24 -0.06 0.00 0.00 0.00 0.00 179.25 179.47 2k9p h ALA 63 N 1.57 -0.16 -0.30 0.00 0.00 -0.53 -1.82 119.26 118.01 2k9p h ALA 63 Ca 0.34 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.15 2k9p h ALA 63 Cb 0.25 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2k9p h ALA 63 CO -0.12 -0.45 -0.00 1.25 0.00 0.00 0.00 179.25 179.93 2k9p h LEU 64 N -0.45 -0.12 -0.70 0.00 6.46 -0.56 -1.23 115.31 118.71 2k9p h LEU 64 Ca -0.02 0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.79 2k9p h LEU 64 Cb 0.36 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 2k9p h LEU 64 CO 0.03 -0.03 0.34 0.00 -0.62 0.00 0.00 178.44 178.16 2k9p h THR 65 N 0.09 1.23 -0.52 1.05 1.03 -1.20 -1.56 112.91 113.02 2k9p h THR 65 Ca 0.14 -0.65 -0.05 0.00 -0.01 0.00 0.00 66.41 65.84 2k9p h THR 65 Cb 0.19 0.36 -0.02 0.00 -1.07 0.00 0.00 68.15 67.61 2k9p h THR 65 CO -0.24 0.27 0.10 0.17 -0.01 0.00 0.00 175.52 175.81 2k9p h LEU 66 N 0.98 0.75 0.19 0.00 8.10 -0.93 -0.66 115.31 123.75 2k9p h LEU 66 Ca 0.24 -0.14 -0.01 0.00 0.11 0.00 0.00 57.88 58.08 2k9p h LEU 66 Cb 0.12 -0.20 0.00 0.00 -0.44 0.00 0.00 40.66 40.14 2k9p h LEU 66 CO -0.03 0.76 -0.09 0.40 -4.11 0.00 0.00 178.44 175.36 2k9p h ILE 67 N 0.77 0.79 -0.14 0.15 2.04 -0.92 -0.52 117.51 119.68 2k9p h ILE 67 Ca 0.17 -1.02 0.04 0.00 1.00 0.00 0.00 64.86 65.05 2k9p h ILE 67 Cb 0.32 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 2k9p h ILE 67 CO 0.00 0.19 -0.09 1.62 0.00 0.00 0.00 178.15 179.88 2k9p h VAL 68 N -0.85 0.73 -0.84 1.67 3.04 -1.30 -0.88 116.25 117.82 2k9p h VAL 68 Ca -0.03 0.00 0.01 0.00 -1.01 0.00 0.00 66.70 65.67 2k9p h VAL 68 Cb 0.52 0.73 -0.04 0.00 -2.01 0.00 0.00 31.29 30.48 2k9p h VAL 68 CO 0.04 0.00 0.55 1.62 -1.01 0.00 0.00 177.57 178.77 2k9p h VAL 69 N -0.09 1.22 -0.30 1.51 3.04 -1.20 -2.04 116.25 118.40 2k9p h VAL 69 Ca 0.08 -0.41 -0.04 0.00 -1.01 0.00 0.00 66.70 65.32 2k9p h VAL 69 Cb 0.21 -0.01 -0.02 0.00 -2.01 0.00 0.00 31.29 29.47 2k9p h VAL 69 CO -0.20 0.21 0.02 -0.25 -1.01 0.00 0.00 177.57 176.35 2k9p h TRP 70 N 1.14 0.46 0.34 3.17 -0.00 -0.52 0.25 115.95 120.79 2k9p h TRP 70 Ca 0.31 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 59.15 2k9p h TRP 70 Cb -0.12 -0.14 0.00 0.00 -0.00 0.00 0.00 29.16 28.91 2k9p h TRP 70 CO -0.01 0.45 -0.16 0.82 -0.00 0.00 0.00 178.44 179.53 2k9p h ILE 71 N 0.44 0.00 0.02 2.65 2.04 -0.60 -3.09 117.51 118.96 2k9p h ILE 71 Ca 0.10 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2k9p h ILE 71 Cb 0.26 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.34 2k9p h ILE 71 CO 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 178.15 178.15 2k9p h THR 72 N -0.86 1.47 -2.09 -0.27 1.03 -1.41 -3.35 112.91 107.43 2k9p h THR 72 Ca -0.05 -1.66 -0.77 0.00 -0.01 0.00 0.00 66.41 63.92 2k9p h THR 72 Cb 0.35 2.56 -0.28 0.00 -1.07 0.00 0.00 68.15 69.71 2k9p h THR 72 CO 0.08 0.42 0.89 -1.20 -0.01 0.00 0.00 175.52 175.69 2k9p n SER 73 N -4.76 7.19 -4.39 0.00 7.64 0.87 -5.00 113.62 115.18 2k9p n SER 73 Ca -0.09 -3.77 -0.16 0.00 1.01 0.00 0.00 58.87 55.86 2k9p n SER 73 Cb 0.35 -1.06 -0.17 0.00 -1.01 0.00 0.00 64.21 62.32 2k9p n SER 73 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2k9p n ARG 74 N -0.33 0.03 0.00 1.43 0.00 -1.17 -4.38 116.66 112.23 2k9p n ARG 74 Ca 0.49 -0.06 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 2k9p n ARG 74 Cb 0.27 -1.16 0.00 0.00 -0.00 0.00 0.00 32.46 31.57 2k9p n ARG 74 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k9p n SER 75 N 6.07 0.00 0.00 2.89 2.88 -1.26 -5.00 113.62 119.21 2k9p n SER 75 Ca 0.51 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 2k9p n SER 75 Cb 0.24 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.45 2k9p n SER 75 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k9p n ARG 76 N -1.26 0.00 0.00 -1.46 5.12 -1.26 -5.18 116.66 112.62 2k9p n ARG 76 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2k9p n ARG 76 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2k9p n ARG 76 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 2k9p n LYS 77 N -2.11 0.00 -4.14 5.56 2.85 -1.26 -5.19 118.16 113.86 2k9p n LYS 77 Ca 0.00 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.02 2k9p n LYS 77 Cb 0.00 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.33 2k9p n LYS 77 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2k9p s THR 78 N -2.00 4.24 0.60 0.58 -4.23 -1.26 -5.12 115.64 108.45 2k9p s THR 78 Ca 0.00 -1.40 -0.17 0.00 -1.18 0.00 0.00 61.69 58.94 2k9p s THR 78 Cb 0.00 -3.24 -0.03 0.00 1.34 0.00 0.00 72.50 70.56 2k9p s THR 78 CO 0.00 -0.27 1.12 -2.16 -0.54 0.00 0.00 174.62 172.77 2k9p s PRO 79 N -3.55 3.11 0.31 3.99 0.04 -1.26 -4.87 135.00 132.78 2k9p s PRO 79 Ca 0.32 1.50 0.06 0.00 0.04 0.00 0.00 61.00 62.92 2k9p s PRO 79 Cb -0.08 -1.98 0.76 0.00 0.04 0.00 0.00 34.50 33.23 2k9p s PRO 79 CO 0.23 -1.02 1.78 -0.84 0.04 0.00 0.00 177.00 177.19 2k9p h ILE 80 N 0.66 0.71 -0.84 0.56 3.07 -1.99 -1.09 117.51 118.59 2k9p h ILE 80 Ca -0.48 -0.26 -0.00 0.00 1.55 0.00 0.00 64.86 65.66 2k9p h ILE 80 Cb 1.25 -0.11 -0.04 0.00 -0.27 0.00 0.00 36.82 37.65 2k9p h ILE 80 CO 0.56 0.14 0.51 0.15 -1.05 0.00 0.00 178.15 178.45 2k9p h PHE 81 N 0.75 1.10 0.21 0.16 3.04 -1.99 0.54 116.94 120.75 2k9p h PHE 81 Ca 0.57 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.51 2k9p h PHE 81 Cb 0.91 -0.36 0.00 0.00 2.56 0.00 0.00 35.95 39.06 2k9p h PHE 81 CO -0.00 0.73 -0.10 0.82 -2.02 0.00 0.00 178.31 177.74 2k9p h ILE 82 N 1.15 0.86 -0.11 1.41 5.03 -1.60 -1.29 117.51 122.95 2k9p h ILE 82 Ca 0.30 -0.36 -0.02 0.00 -0.12 0.00 0.00 64.86 64.66 2k9p h ILE 82 Cb -0.05 1.07 -0.01 0.00 -3.03 0.00 0.00 36.82 34.80 2k9p h ILE 82 CO -0.06 0.08 -0.04 0.40 -0.68 0.00 0.00 178.15 177.85 2k9p h ILE 83 N -0.46 1.10 0.55 -0.67 1.08 -0.98 -1.30 117.51 116.83 2k9p h ILE 83 Ca -0.03 -0.42 -0.03 0.00 -0.39 0.00 0.00 64.86 63.99 2k9p h ILE 83 Cb 0.35 1.07 0.01 0.00 -3.07 0.00 0.00 36.82 35.18 2k9p h ILE 83 CO 0.05 0.13 -0.26 -1.13 -0.69 0.00 0.00 178.15 176.25 2k9p h ASN 84 N 0.16 -0.62 -0.46 1.72 -1.24 -0.78 -1.03 115.58 113.33 2k9p h ASN 84 Ca 0.04 -0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.05 2k9p h ASN 84 Cb 0.19 0.16 -0.04 0.00 0.73 0.00 0.00 38.32 39.36 2k9p h ASN 84 CO 0.01 -0.23 0.22 0.06 -1.29 0.00 0.00 177.43 176.19 2k9p h GLN 85 N -1.10 0.43 -0.18 6.67 3.07 -1.07 -1.71 115.11 121.21 2k9p h GLN 85 Ca -0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.63 2k9p h GLN 85 Cb 0.62 -0.10 -0.01 0.00 0.08 0.00 0.00 27.48 28.08 2k9p h GLN 85 CO 0.12 0.28 0.06 -0.39 0.09 0.00 0.00 178.83 178.99 2k9p h VAL 86 N 0.44 1.18 -0.11 1.86 -1.51 -1.35 -2.43 116.25 114.33 2k9p h VAL 86 Ca 0.20 -0.57 0.05 0.00 -1.23 0.00 0.00 66.70 65.14 2k9p h VAL 86 Cb 0.12 1.23 -0.06 0.00 -2.13 0.00 0.00 31.29 30.45 2k9p h VAL 86 CO -0.15 0.18 -0.28 -1.28 -1.23 0.00 0.00 177.57 174.81 2k9p h SER 87 N 0.11 -0.87 0.11 4.19 0.87 -0.81 0.47 113.55 117.62 2k9p h SER 87 Ca 0.06 0.13 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 2k9p h SER 87 Cb 0.23 0.37 -0.05 0.00 -0.44 0.00 0.00 62.40 62.51 2k9p h SER 87 CO -0.00 -0.33 -0.40 -0.07 -0.53 0.00 0.00 176.83 175.50 2k9p h LEU 88 N -0.36 -1.19 -1.38 2.23 3.38 -1.32 -1.94 115.31 114.73 2k9p h LEU 88 Ca 0.09 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.27 2k9p h LEU 88 Cb 0.51 0.45 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 2k9p h LEU 88 CO -0.32 -0.47 0.48 -0.26 0.09 0.00 0.00 178.44 177.96 2k9p h PHE 89 N -0.63 0.76 0.77 1.13 -1.00 -0.95 -1.88 116.94 115.14 2k9p h PHE 89 Ca 0.03 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.79 2k9p h PHE 89 Cb 0.66 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.97 2k9p h PHE 89 CO -0.36 0.40 -0.43 -0.07 -1.61 0.00 0.00 178.31 176.24 2k9p h LEU 90 N 0.75 -1.05 -0.04 1.54 -0.00 0.67 0.33 115.31 117.50 2k9p h LEU 90 Ca 0.32 0.05 -0.00 0.00 -0.00 0.00 0.00 57.88 58.25 2k9p h LEU 90 Cb 0.28 0.30 -0.00 0.00 -0.00 0.00 0.00 40.66 41.24 2k9p h LEU 90 CO -0.11 -0.69 0.02 0.40 -0.00 0.00 0.00 178.44 178.06 2k9p h ILE 91 N -1.11 1.14 -0.92 1.22 5.03 -1.37 -1.59 117.51 119.90 2k9p h ILE 91 Ca -0.10 -0.41 0.09 0.00 -0.12 0.00 0.00 64.86 64.32 2k9p h ILE 91 Cb 0.88 1.34 -0.07 0.00 -3.03 0.00 0.00 36.82 35.95 2k9p h ILE 91 CO 0.13 0.11 0.59 0.40 -0.68 0.00 0.00 178.15 178.71 2k9p h ILE 92 N -0.10 1.00 0.70 -0.67 2.04 -1.28 0.01 117.51 119.21 2k9p h ILE 92 Ca 0.01 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 2k9p h ILE 92 Cb 0.17 -0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.20 2k9p h ILE 92 CO -0.00 0.18 -0.33 -0.07 0.00 0.00 0.00 178.15 177.92 2k9p h LEU 93 N 0.97 -0.79 -0.29 1.44 3.38 -0.16 -0.33 115.31 119.53 2k9p h LEU 93 Ca 0.42 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.44 2k9p h LEU 93 Cb 0.33 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2k9p h LEU 93 CO -0.18 -0.50 0.03 -0.74 0.09 0.00 0.00 178.44 177.14 2k9p h HIS 94 N -1.04 0.04 0.13 1.13 2.76 -0.67 0.23 115.15 117.73 2k9p h HIS 94 Ca -0.10 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 2k9p h HIS 94 Cb 0.74 0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.73 2k9p h HIS 94 CO -0.01 -0.02 -0.06 0.66 -1.30 0.00 0.00 177.93 177.20 2k9p h SER 95 N 0.12 -0.15 -0.73 3.26 4.64 -1.06 -0.10 113.55 119.54 2k9p h SER 95 Ca 0.14 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 2k9p h SER 95 Cb 0.16 0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 2k9p h SER 95 CO -0.21 -0.02 0.37 0.00 -0.87 0.00 0.00 176.83 176.10 2k9p h ALA 96 N 0.59 0.93 -0.11 5.18 0.00 -0.90 -0.63 119.26 124.33 2k9p h ALA 96 Ca -0.02 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2k9p h ALA 96 Cb 0.21 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2k9p h ALA 96 CO 0.03 0.48 0.00 -0.07 0.00 0.00 0.00 179.25 179.70 2k9p h LEU 97 N 1.01 -0.03 -0.23 0.00 3.38 -0.47 -0.55 115.31 118.42 2k9p h LEU 97 Ca 0.25 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 2k9p h LEU 97 Cb 0.09 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2k9p h LEU 97 CO -0.03 0.00 0.13 0.22 0.09 0.00 0.00 178.44 178.85 2k9p h TYR 98 N 0.05 0.32 0.34 1.13 5.03 -0.68 -0.34 116.97 122.81 2k9p h TYR 98 Ca 0.05 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.35 2k9p h TYR 98 Cb 0.06 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.21 2k9p h TYR 98 CO -0.13 0.27 -0.34 0.35 -1.32 0.00 0.00 178.16 176.99 2k9p h PHE 99 N 0.27 -0.92 -0.37 -3.82 3.57 -1.01 -0.79 116.94 113.87 2k9p h PHE 99 Ca 0.08 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 2k9p h PHE 99 Cb 0.06 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2k9p h PHE 99 CO -0.04 -0.48 0.16 1.57 -2.23 0.00 0.00 178.31 177.29 2k9p h LYS 100 N -0.71 0.51 -0.58 1.11 2.10 -1.06 -1.64 116.57 116.29 2k9p h LYS 100 Ca -0.02 -0.06 -0.10 0.00 -2.00 0.00 0.00 60.65 58.47 2k9p h LYS 100 Cb 0.64 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.85 2k9p h LYS 100 CO -0.06 0.41 -0.05 -0.92 -2.00 0.00 0.00 179.45 176.83 2k9p h TYR 101 N 0.51 1.16 -0.21 0.07 3.20 -0.75 0.42 116.97 121.37 2k9p h TYR 101 Ca 0.13 -0.22 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 2k9p h TYR 101 Cb 0.08 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2k9p h TYR 101 CO 0.00 1.04 0.01 -0.07 -1.64 0.00 0.00 178.16 177.51 2k9p h LEU 102 N 0.95 0.36 -1.18 2.82 3.38 -0.67 -3.17 115.31 117.79 2k9p h LEU 102 Ca 0.16 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2k9p h LEU 102 Cb 0.61 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2k9p h LEU 102 CO 0.04 0.57 -0.30 0.17 0.09 0.00 0.00 178.44 179.00 2k9p h LEU 103 N 0.15 0.17 -1.04 1.67 8.10 -1.22 -3.19 115.31 119.95 2k9p h LEU 103 Ca 0.06 -0.06 0.18 0.00 0.11 0.00 0.00 57.88 58.18 2k9p h LEU 103 Cb 0.38 -0.05 -0.10 0.00 -0.44 0.00 0.00 40.66 40.45 2k9p h LEU 103 CO 0.01 0.48 0.62 -1.28 -4.11 0.00 0.00 178.44 174.15 2k9p h SER 104 N 0.15 0.79 0.31 0.17 0.87 -0.88 -0.50 113.55 114.47 2k9p h SER 104 Ca 0.02 0.09 -0.28 0.00 -1.23 0.00 0.00 61.79 60.39 2k9p h SER 104 Cb 0.62 -0.06 0.02 0.00 -0.44 0.00 0.00 62.40 62.54 2k9p h SER 104 CO 0.05 0.31 -1.20 -1.13 -0.53 0.00 0.00 176.83 174.32 2k9p h ASN 105 N 0.78 0.69 0.06 6.23 -1.24 -1.66 -3.35 115.58 117.09 2k9p h ASN 105 Ca 0.56 -0.65 0.02 0.00 0.71 0.00 0.00 56.30 56.94 2k9p h ASN 105 Cb 0.85 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.66 2k9p h ASN 105 CO -0.35 1.47 -0.15 1.88 -1.29 0.00 0.00 177.43 178.99 2k9p h TYR 106 N 0.20 -0.40 -1.86 0.67 0.05 -1.18 -3.45 116.97 111.00 2k9p h TYR 106 Ca -0.16 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.64 2k9p h TYR 106 Cb 1.88 0.17 -0.23 0.00 1.01 0.00 0.00 36.73 39.56 2k9p h TYR 106 CO 0.09 -0.23 0.22 0.45 -1.05 0.00 0.00 178.16 177.64 2k9p s SER 107 N -4.96 -0.68 -0.07 3.88 0.15 -0.35 -5.05 113.70 106.62 2k9p s SER 107 Ca -0.15 1.27 0.10 0.00 0.70 0.00 0.00 55.95 57.87 2k9p s SER 107 Cb 0.08 1.28 0.17 0.00 -1.71 0.00 0.00 66.02 65.84 2k9p s SER 107 CO 0.66 -0.21 1.10 -0.24 1.20 0.00 0.00 173.24 175.74 2k9p n SER 108 N 2.84 2.28 -3.47 5.45 2.88 -1.26 -4.41 113.62 117.93 2k9p n SER 108 Ca -0.15 -2.55 0.01 0.00 -1.33 0.00 0.00 58.87 54.85 2k9p n SER 108 Cb 0.56 -0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.74 2k9p n SER 108 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k9p s VAL 109 N -1.95 -0.54 -2.79 2.46 0.11 -1.26 -5.17 120.40 111.26 2k9p s VAL 109 Ca 0.18 0.00 0.26 0.00 -2.93 0.00 0.00 61.98 59.48 2k9p s VAL 109 Cb 0.15 -1.00 0.34 0.00 -1.53 0.00 0.00 36.38 34.34 2k9p s VAL 109 CO 0.02 0.00 1.46 0.41 -3.33 0.00 0.00 175.10 173.67