#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 0.68 0.00 1.61 5.15 -1.26 -5.18 115.26 116.27 2k9p n ASN 32 Ca 0.00 0.12 0.00 0.00 -0.60 0.00 0.00 54.58 54.10 2k9p n ASN 32 Cb 0.00 -0.18 0.00 0.00 -0.53 0.00 0.00 39.78 39.07 2k9p n ASN 32 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k9p n GLY 33 N 3.32 -1.25 2.68 8.20 0.00 -1.26 -4.96 105.19 111.92 2k9p n GLY 33 Ca 0.00 -1.53 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 2k9p n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k9p s SER 34 N -2.60 3.38 -0.08 1.61 0.01 -1.26 -4.92 113.70 109.84 2k9p s SER 34 Ca 0.00 -3.31 0.21 0.00 1.31 0.00 0.00 55.95 54.16 2k9p s SER 34 Cb 0.00 -1.09 0.43 0.00 0.21 0.00 0.00 66.02 65.57 2k9p s SER 34 CO 0.00 -0.15 1.19 1.07 0.41 0.00 0.00 173.24 175.75 2k9p n THR 35 N 2.62 0.80 -4.18 1.44 5.66 -1.26 -5.09 114.28 114.28 2k9p n THR 35 Ca 0.21 -1.82 -0.27 0.00 -3.05 0.00 0.00 64.05 59.12 2k9p n THR 35 Cb 0.39 0.55 -0.07 0.00 -1.55 0.00 0.00 70.33 69.65 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 -1.18 3.86 0.95 1.09 1.09 -1.26 -5.13 121.20 120.62 2k9p s ILE 36 Ca 0.35 -1.33 -0.12 0.00 -1.10 0.00 0.00 60.65 58.46 2k9p s ILE 36 Cb 0.38 -2.93 0.09 0.00 -1.06 0.00 0.00 42.46 38.94 2k9p s ILE 36 CO -0.13 -0.08 0.69 0.35 -0.10 0.00 0.00 174.94 175.66 2k9p n THR 37 N -0.07 0.00 0.22 2.92 -2.24 -1.26 -4.91 114.28 108.95 2k9p n THR 37 Ca -0.10 -0.13 0.09 0.00 -2.27 0.00 0.00 64.05 61.65 2k9p n THR 37 Cb 0.55 -0.77 0.44 0.00 -2.10 0.00 0.00 70.33 68.45 2k9p n THR 37 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2k9p n PHE 38 N -3.90 0.57 -0.34 4.78 3.72 -1.26 -2.78 117.46 118.25 2k9p n PHE 38 Ca 0.08 0.27 0.22 0.00 -0.05 0.00 0.00 57.45 57.97 2k9p n PHE 38 Cb 0.53 -0.93 0.45 0.00 -0.94 0.00 0.00 39.48 38.59 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 0.57 0.62 4.37 5.19 -1.99 -0.63 116.42 124.55 2k9p h ASP 39 Ca 0.00 0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.54 2k9p h ASP 39 Cb 0.12 0.09 0.01 0.00 0.18 0.00 0.00 39.33 39.72 2k9p h ASP 39 CO 0.00 -0.03 -0.30 -0.33 -3.12 0.00 0.00 179.24 175.46 2k9p h GLU 40 N 0.42 -0.81 -0.98 3.56 5.08 -1.89 -1.63 114.58 118.34 2k9p h GLU 40 Ca 0.70 0.05 0.04 0.00 -1.00 0.00 0.00 59.36 59.16 2k9p h GLU 40 Cb 1.52 0.18 -0.06 0.00 0.50 0.00 0.00 28.75 30.90 2k9p h GLU 40 CO -0.53 -0.52 0.64 -0.07 -1.00 0.00 0.00 179.01 177.52 2k9p h LEU 41 N -0.87 1.05 0.12 1.33 -0.00 -1.63 -0.60 115.31 114.71 2k9p h LEU 41 Ca -0.09 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 2k9p h LEU 41 Cb 0.65 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.06 2k9p h LEU 41 CO 0.14 0.71 -0.26 1.56 -0.00 0.00 0.00 178.44 180.59 2k9p h GLN 42 N 1.21 -0.40 -0.80 1.13 1.08 -0.99 -1.68 115.11 114.67 2k9p h GLN 42 Ca 0.40 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.71 2k9p h GLN 42 Cb 0.05 0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.52 2k9p h GLN 42 CO -0.13 -0.26 0.52 0.78 -0.95 0.00 0.00 178.83 178.78 2k9p h GLY 43 N -0.41 1.08 0.58 3.46 0.00 -1.00 -0.53 103.07 106.25 2k9p h GLY 43 Ca -0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2k9p h GLY 43 CO -0.11 0.21 -0.48 1.41 0.00 0.00 0.00 176.54 177.57 2k9p h LEU 44 N 0.79 -1.31 -1.27 3.11 3.38 -1.01 -2.73 115.31 116.28 2k9p h LEU 44 Ca 0.36 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.37 2k9p h LEU 44 Cb 0.35 0.42 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2k9p h LEU 44 CO -0.13 -0.66 -0.28 0.58 0.09 0.00 0.00 178.44 178.03 2k9p h VAL 45 N -1.01 0.81 0.34 1.22 2.07 -0.93 0.14 116.25 118.90 2k9p h VAL 45 Ca -0.06 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 2k9p h VAL 45 Cb 0.86 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2k9p h VAL 45 CO -0.04 0.28 -0.34 -1.13 0.02 0.00 0.00 177.57 176.36 2k9p h ASN 46 N 0.00 -0.93 0.00 0.57 -1.24 -0.91 -3.42 115.58 109.64 2k9p h ASN 46 Ca -0.00 0.08 -0.21 0.00 0.71 0.00 0.00 56.30 56.88 2k9p h ASN 46 Cb 0.69 0.31 -0.15 0.00 0.73 0.00 0.00 38.32 39.91 2k9p h ASN 46 CO 0.04 -0.48 -0.33 -0.24 -1.29 0.00 0.00 177.43 175.13 2k9p n SER 47 N -5.45 -1.95 0.11 1.15 2.88 -1.04 -4.96 113.62 104.35 2k9p n SER 47 Ca -0.10 -2.69 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 2k9p n SER 47 Cb 0.36 1.24 0.00 0.00 -0.75 0.00 0.00 64.21 65.06 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 -0.34 0.01 -0.19 2.46 -1.04 -0.28 -4.85 114.28 110.05 2k9p n THR 48 Ca -0.02 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.95 2k9p n THR 48 Cb 0.80 -0.40 0.14 0.00 -1.82 0.00 0.00 70.33 69.05 2k9p n THR 48 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 2k9p h VAL 49 N 0.00 1.24 -0.34 12.58 3.04 -1.09 -2.77 116.25 128.91 2k9p h VAL 49 Ca 0.00 -0.82 -0.04 0.00 -1.01 0.00 0.00 66.70 64.83 2k9p h VAL 49 Cb 0.00 0.52 -0.02 0.00 -2.01 0.00 0.00 31.29 29.79 2k9p h VAL 49 CO 0.00 0.32 0.03 0.00 -1.01 0.00 0.00 177.57 176.91 2k9p h THR 50 N 0.95 1.18 -0.01 3.17 1.03 -1.80 -2.29 112.91 115.14 2k9p h THR 50 Ca 0.21 -0.69 -0.08 0.00 -0.01 0.00 0.00 66.41 65.84 2k9p h THR 50 Cb 0.26 0.90 -0.01 0.00 -1.07 0.00 0.00 68.15 68.23 2k9p h THR 50 CO -0.01 0.24 -0.38 1.56 -0.01 0.00 0.00 175.52 176.92 2k9p h GLN 51 N 0.49 0.02 -0.21 0.00 4.20 -1.82 -3.18 115.11 114.61 2k9p h GLN 51 Ca 0.11 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2k9p h GLN 51 Cb 0.27 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2k9p h GLN 51 CO 0.00 0.40 0.13 0.00 -0.67 0.00 0.00 178.83 178.69 2k9p h ALA 52 N 1.60 0.26 0.24 3.87 0.00 -1.41 0.52 119.26 124.34 2k9p h ALA 52 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2k9p h ALA 52 Cb 0.68 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2k9p h ALA 52 CO 0.05 -0.27 -0.15 0.82 0.00 0.00 0.00 179.25 179.70 2k9p h ILE 53 N 0.27 0.69 -0.01 0.00 5.03 -1.63 -0.44 117.51 121.41 2k9p h ILE 53 Ca 0.08 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.85 2k9p h ILE 53 Cb -0.02 0.69 -0.04 0.00 -3.03 0.00 0.00 36.82 34.41 2k9p h ILE 53 CO -0.02 0.00 -0.20 -0.07 -0.68 0.00 0.00 178.15 177.18 2k9p h LEU 54 N -0.37 -0.59 -0.31 1.44 3.38 -1.50 -1.07 115.31 116.28 2k9p h LEU 54 Ca -0.02 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.07 2k9p h LEU 54 Cb 0.31 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2k9p h LEU 54 CO 0.02 -0.27 0.11 0.15 0.09 0.00 0.00 178.44 178.55 2k9p h PHE 55 N -0.32 0.20 -0.08 1.13 3.57 -0.80 -1.64 116.94 119.00 2k9p h PHE 55 Ca 0.06 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2k9p h PHE 55 Cb 0.40 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.05 2k9p h PHE 55 CO -0.25 0.09 -0.18 0.78 -2.23 0.00 0.00 178.31 176.51 2k9p h GLY 56 N 0.25 -0.18 0.39 2.40 0.00 -0.83 0.31 103.07 105.41 2k9p h GLY 56 Ca 0.14 0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 2k9p h GLY 56 CO -0.14 -0.17 -0.46 -2.08 0.00 0.00 0.00 176.54 173.68 2k9p h VAL 57 N -0.26 0.00 -0.94 4.60 2.07 -0.82 -0.72 116.25 120.18 2k9p h VAL 57 Ca 0.08 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.64 2k9p h VAL 57 Cb 0.37 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 2k9p h VAL 57 CO -0.23 0.00 0.62 0.08 0.02 0.00 0.00 177.57 178.06 2k9p h ARG 58 N -0.87 1.14 0.01 1.57 0.11 -1.31 -2.02 114.38 113.00 2k9p h ARG 58 Ca -0.05 -0.07 0.02 0.00 0.10 0.00 0.00 59.98 59.98 2k9p h ARG 58 Cb 0.77 -0.26 -0.02 0.00 1.11 0.00 0.00 29.97 31.58 2k9p h ARG 58 CO -0.10 0.76 -0.09 1.03 0.10 0.00 0.00 179.97 181.67 2k9p h SER 59 N 1.18 -0.26 0.19 0.08 0.87 -0.53 0.17 113.55 115.24 2k9p h SER 59 Ca 0.38 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.97 2k9p h SER 59 Cb 0.02 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 2k9p h SER 59 CO -0.12 -0.14 -0.12 1.23 -0.53 0.00 0.00 176.83 177.16 2k9p h GLY 60 N -0.16 -0.30 0.93 5.77 0.00 -0.84 0.64 103.07 109.10 2k9p h GLY 60 Ca 0.03 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2k9p h GLY 60 CO -0.09 -0.13 0.12 0.00 0.00 0.00 0.00 176.54 176.44 2k9p h ALA 61 N 0.50 0.33 -0.91 3.60 0.00 -1.28 -1.27 119.26 120.23 2k9p h ALA 61 Ca -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2k9p h ALA 61 Cb 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2k9p h ALA 61 CO 0.01 -0.11 0.55 0.00 0.00 0.00 0.00 179.25 179.70 2k9p h ALA 62 N 0.98 1.25 0.15 0.00 0.00 -0.62 -1.81 119.26 119.21 2k9p h ALA 62 Ca 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2k9p h ALA 62 Cb 0.12 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2k9p h ALA 62 CO -0.01 0.64 -0.07 0.00 0.00 0.00 0.00 179.25 179.81 2k9p h ALA 63 N 1.35 -0.20 -0.13 0.00 0.00 -0.66 -1.80 119.26 117.82 2k9p h ALA 63 Ca 0.33 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.21 2k9p h ALA 63 Cb -0.05 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2k9p h ALA 63 CO -0.06 -0.58 -0.14 1.25 0.00 0.00 0.00 179.25 179.72 2k9p h LEU 64 N -0.27 -0.45 -0.82 0.00 6.46 -0.96 -1.20 115.31 118.07 2k9p h LEU 64 Ca -0.02 0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.85 2k9p h LEU 64 Cb 0.21 0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.31 2k9p h LEU 64 CO 0.03 -0.19 0.53 0.00 -0.62 0.00 0.00 178.44 178.20 2k9p h THR 65 N -0.17 1.15 -0.85 1.05 1.03 -1.34 -2.43 112.91 111.36 2k9p h THR 65 Ca 0.09 -0.36 -0.03 0.00 -0.01 0.00 0.00 66.41 66.11 2k9p h THR 65 Cb 0.31 0.01 -0.04 0.00 -1.07 0.00 0.00 68.15 67.36 2k9p h THR 65 CO -0.24 0.19 0.42 0.17 -0.01 0.00 0.00 175.52 176.05 2k9p h LEU 66 N 1.05 1.10 0.55 0.00 8.10 -0.90 -1.10 115.31 124.12 2k9p h LEU 66 Ca 0.32 -0.13 -0.02 0.00 0.11 0.00 0.00 57.88 58.16 2k9p h LEU 66 Cb -0.03 -0.28 -0.00 0.00 -0.44 0.00 0.00 40.66 39.91 2k9p h LEU 66 CO -0.10 0.92 -0.33 0.40 -4.11 0.00 0.00 178.44 175.22 2k9p h ILE 67 N 1.20 0.33 -0.75 0.15 2.04 -0.77 -0.49 117.51 119.22 2k9p h ILE 67 Ca 0.29 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.16 2k9p h ILE 67 Cb 0.10 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.48 2k9p h ILE 67 CO -0.04 0.00 0.50 -0.37 0.00 0.00 0.00 178.15 178.24 2k9p h VAL 68 N -0.83 1.19 -0.47 1.67 -1.51 -1.39 -0.16 116.25 114.76 2k9p h VAL 68 Ca -0.07 -0.36 0.08 0.00 -1.23 0.00 0.00 66.70 65.12 2k9p h VAL 68 Cb 0.67 0.09 -0.06 0.00 -2.13 0.00 0.00 31.29 29.85 2k9p h VAL 68 CO 0.08 0.19 0.10 0.58 -1.23 0.00 0.00 177.57 177.28 2k9p h VAL 69 N 1.02 0.75 -0.03 7.19 2.07 -0.93 -0.97 116.25 125.35 2k9p h VAL 69 Ca 0.28 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.61 2k9p h VAL 69 Cb -0.12 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2k9p h VAL 69 CO -0.06 0.04 -0.48 -0.25 0.02 0.00 0.00 177.57 176.84 2k9p h TRP 70 N 0.23 0.08 -0.26 1.57 7.01 -0.70 0.20 115.95 124.08 2k9p h TRP 70 Ca 0.23 -0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.13 2k9p h TRP 70 Cb 0.30 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.33 2k9p h TRP 70 CO -0.22 0.54 -0.17 0.82 -2.79 0.00 0.00 178.44 176.63 2k9p h ILE 71 N 0.06 1.23 0.00 2.65 2.04 0.22 -2.89 117.51 120.82 2k9p h ILE 71 Ca -0.00 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.80 2k9p h ILE 71 Cb 0.88 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 2k9p h ILE 71 CO 0.07 0.34 -0.60 1.07 0.00 0.00 0.00 178.15 179.03 2k9p n THR 72 N -4.19 1.36 0.25 -0.27 5.66 -0.57 -4.73 114.28 111.80 2k9p n THR 72 Ca 0.00 0.25 0.14 0.00 -3.05 0.00 0.00 64.05 61.38 2k9p n THR 72 Cb 0.34 -2.03 0.54 0.00 -1.55 0.00 0.00 70.33 67.62 2k9p n THR 72 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2k9p h SER 73 N -0.60 0.00 -6.57 1.09 0.87 -0.83 -3.48 113.55 104.04 2k9p h SER 73 Ca 0.00 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.05 2k9p h SER 73 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2k9p h SER 73 CO 0.00 0.10 -0.95 0.54 -0.53 0.00 0.00 176.83 175.98 2k9p n ARG 74 N -3.21 -1.33 0.00 2.24 3.00 -0.86 -4.93 116.66 111.57 2k9p n ARG 74 Ca 0.01 0.30 0.00 0.00 -0.01 0.00 0.00 57.85 58.15 2k9p n ARG 74 Cb 0.38 -3.68 0.00 0.00 0.00 0.00 0.00 32.46 29.17 2k9p n ARG 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2k9p n SER 75 N -2.60 0.00 -3.71 0.55 7.64 -1.26 -4.87 113.62 109.37 2k9p n SER 75 Ca -0.16 0.93 -0.12 0.00 1.01 0.00 0.00 58.87 60.53 2k9p n SER 75 Cb 0.61 -0.43 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 2k9p n SER 75 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2k9p s ARG 76 N -2.73 0.86 -0.90 1.43 1.81 -1.26 -5.10 118.95 113.07 2k9p s ARG 76 Ca 0.00 -0.45 -0.25 0.00 -1.72 0.00 0.00 55.73 53.31 2k9p s ARG 76 Cb 0.00 0.38 -0.06 0.00 -0.45 0.00 0.00 34.95 34.82 2k9p s ARG 76 CO 0.00 -0.29 1.98 0.15 -0.68 0.00 0.00 175.30 176.47 2k9p s LYS 77 N -2.55 2.48 0.63 3.54 1.02 -1.26 -4.97 119.74 118.63 2k9p s LYS 77 Ca -0.05 -0.24 -0.18 0.00 0.02 0.00 0.00 55.97 55.52 2k9p s LYS 77 Cb -0.01 -5.04 -0.03 0.00 -0.52 0.00 0.00 37.83 32.23 2k9p s LYS 77 CO -0.03 -3.47 1.02 0.25 -0.92 0.00 0.00 175.35 172.20 2k9p n THR 78 N 7.95 3.91 -2.00 2.17 -2.24 -1.26 -4.96 114.28 117.85 2k9p n THR 78 Ca 0.41 -0.49 -0.35 0.00 -2.27 0.00 0.00 64.05 61.35 2k9p n THR 78 Cb 0.47 -1.20 0.03 0.00 -2.10 0.00 0.00 70.33 67.53 2k9p n THR 78 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2k9p s PRO 79 N -2.96 2.98 0.28 -0.78 0.04 -1.26 -4.82 135.00 128.47 2k9p s PRO 79 Ca 0.77 1.72 0.01 0.00 0.04 0.00 0.00 61.00 63.55 2k9p s PRO 79 Cb -0.40 -1.94 0.66 0.00 0.04 0.00 0.00 34.50 32.86 2k9p s PRO 79 CO 0.46 -1.17 1.68 -0.84 0.04 0.00 0.00 177.00 177.16 2k9p h ILE 80 N 0.78 0.43 -0.57 0.56 3.07 -2.00 -0.80 117.51 118.97 2k9p h ILE 80 Ca -0.50 -0.10 0.05 0.00 1.55 0.00 0.00 64.86 65.86 2k9p h ILE 80 Cb 1.28 0.10 -0.05 0.00 -0.27 0.00 0.00 36.82 37.88 2k9p h ILE 80 CO 0.55 0.05 0.29 -0.26 -1.05 0.00 0.00 178.15 177.74 2k9p h PHE 81 N 0.30 0.53 0.45 0.16 0.04 -1.99 0.12 116.94 116.56 2k9p h PHE 81 Ca 0.52 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.29 2k9p h PHE 81 Cb 0.99 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.99 2k9p h PHE 81 CO -0.21 0.25 -0.23 0.82 -0.60 0.00 0.00 178.31 178.33 2k9p h ILE 82 N 0.55 0.52 -0.46 -0.55 5.03 -1.52 -1.05 117.51 120.04 2k9p h ILE 82 Ca 0.26 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.99 2k9p h ILE 82 Cb 0.18 0.52 -0.02 0.00 -3.03 0.00 0.00 36.82 34.47 2k9p h ILE 82 CO -0.18 0.00 0.25 0.40 -0.68 0.00 0.00 178.15 177.93 2k9p h ILE 83 N -0.63 1.17 -0.17 -0.67 1.08 -0.98 0.02 117.51 117.33 2k9p h ILE 83 Ca -0.06 -0.44 0.04 0.00 -0.39 0.00 0.00 64.86 64.01 2k9p h ILE 83 Cb 0.49 0.62 -0.04 0.00 -3.07 0.00 0.00 36.82 34.82 2k9p h ILE 83 CO 0.09 0.18 -0.09 0.78 -0.69 0.00 0.00 178.15 178.42 2k9p h ASN 84 N 0.60 -0.29 -0.25 1.72 4.21 -0.79 -1.56 115.58 119.24 2k9p h ASN 84 Ca 0.16 0.07 0.04 0.00 1.21 0.00 0.00 56.30 57.78 2k9p h ASN 84 Cb 0.07 0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 37.39 2k9p h ASN 84 CO -0.02 -0.11 0.03 1.56 -1.29 0.00 0.00 177.43 177.59 2k9p h GLN 85 N -0.07 0.11 -0.01 0.81 4.20 -0.81 -1.90 115.11 117.44 2k9p h GLN 85 Ca 0.10 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.83 2k9p h GLN 85 Cb 0.21 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 2k9p h GLN 85 CO -0.22 0.07 -0.42 0.28 -0.67 0.00 0.00 178.83 177.88 2k9p h VAL 86 N 0.12 0.15 0.14 -0.54 2.07 -0.65 0.13 116.25 117.67 2k9p h VAL 86 Ca 0.11 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.65 2k9p h VAL 86 Cb 0.13 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.02 2k9p h VAL 86 CO -0.17 0.00 -0.30 -1.28 0.02 0.00 0.00 177.57 175.84 2k9p h SER 87 N -0.56 -0.85 0.17 0.57 0.87 -1.19 -0.46 113.55 112.09 2k9p h SER 87 Ca 0.05 0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2k9p h SER 87 Cb 0.65 0.32 -0.04 0.00 -0.44 0.00 0.00 62.40 62.89 2k9p h SER 87 CO -0.32 -0.39 -0.47 -0.07 -0.53 0.00 0.00 176.83 175.04 2k9p h LEU 88 N -0.53 -1.39 -0.47 2.23 3.38 -1.12 -2.22 115.31 115.18 2k9p h LEU 88 Ca 0.03 0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.23 2k9p h LEU 88 Cb 0.55 0.51 -0.08 0.00 0.09 0.00 0.00 40.66 41.72 2k9p h LEU 88 CO -0.16 -0.52 -0.07 -0.26 0.09 0.00 0.00 178.44 177.52 2k9p h PHE 89 N -0.72 -0.16 -0.08 1.13 0.04 -0.63 -0.28 116.94 116.25 2k9p h PHE 89 Ca -0.02 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.83 2k9p h PHE 89 Cb 0.70 0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.93 2k9p h PHE 89 CO -0.40 -0.16 -0.48 -0.07 -0.60 0.00 0.00 178.31 176.59 2k9p h LEU 90 N 0.04 -1.51 -0.28 1.54 4.07 -0.85 0.18 115.31 118.50 2k9p h LEU 90 Ca 0.23 0.18 -0.01 0.00 0.08 0.00 0.00 57.88 58.37 2k9p h LEU 90 Cb 0.35 0.59 -0.01 0.00 1.08 0.00 0.00 40.66 42.67 2k9p h LEU 90 CO -0.45 -0.48 0.14 0.40 -1.08 0.00 0.00 178.44 176.98 2k9p h ILE 91 N -0.58 1.14 -0.58 1.22 2.04 -1.05 -0.88 117.51 118.82 2k9p h ILE 91 Ca 0.04 -0.37 0.08 0.00 1.00 0.00 0.00 64.86 65.61 2k9p h ILE 91 Cb 0.68 0.87 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 2k9p h ILE 91 CO -0.39 0.14 0.24 0.40 0.00 0.00 0.00 178.15 178.54 2k9p h ILE 92 N 0.33 0.84 0.58 -0.67 2.04 -0.78 0.08 117.51 119.92 2k9p h ILE 92 Ca 0.10 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 2k9p h ILE 92 Cb 0.09 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2k9p h ILE 92 CO -0.01 0.08 -0.35 -0.07 0.00 0.00 0.00 178.15 177.80 2k9p h LEU 93 N 0.45 -0.87 -0.47 1.44 4.07 -0.41 0.35 115.31 119.87 2k9p h LEU 93 Ca 0.28 0.05 0.05 0.00 0.08 0.00 0.00 57.88 58.34 2k9p h LEU 93 Cb 0.30 0.25 -0.05 0.00 1.08 0.00 0.00 40.66 42.24 2k9p h LEU 93 CO -0.26 -0.55 0.20 -0.74 -1.08 0.00 0.00 178.44 176.02 2k9p h HIS 94 N -0.87 0.36 0.20 1.13 2.76 -0.71 0.18 115.15 118.19 2k9p h HIS 94 Ca -0.07 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.11 2k9p h HIS 94 Cb 0.71 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.58 2k9p h HIS 94 CO -0.09 0.15 -0.09 1.03 -1.30 0.00 0.00 177.93 177.63 2k9p h SER 95 N 0.40 -0.22 -0.59 3.26 0.87 -0.99 -1.76 113.55 114.51 2k9p h SER 95 Ca 0.22 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.81 2k9p h SER 95 Cb 0.18 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.16 2k9p h SER 95 CO -0.19 -0.15 0.35 0.00 -0.53 0.00 0.00 176.83 176.31 2k9p h ALA 96 N 0.54 0.77 0.50 6.23 0.00 -0.53 0.66 119.26 127.43 2k9p h ALA 96 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2k9p h ALA 96 Cb 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2k9p h ALA 96 CO 0.04 0.07 -0.40 -0.07 0.00 0.00 0.00 179.25 178.90 2k9p h LEU 97 N 0.69 -1.06 -0.36 0.00 3.38 -0.58 -0.22 115.31 117.16 2k9p h LEU 97 Ca 0.24 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2k9p h LEU 97 Cb 0.05 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2k9p h LEU 97 CO -0.12 -0.58 0.24 0.22 0.09 0.00 0.00 178.44 178.29 2k9p h TYR 98 N -0.89 0.45 0.03 1.13 5.03 -1.20 -1.05 116.97 120.47 2k9p h TYR 98 Ca -0.05 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.29 2k9p h TYR 98 Cb 0.76 -0.15 -0.04 0.00 1.55 0.00 0.00 36.73 38.85 2k9p h TYR 98 CO -0.17 0.28 -0.24 0.35 -1.32 0.00 0.00 178.16 177.05 2k9p h PHE 99 N 0.48 -0.65 -0.61 -3.82 3.57 -0.79 0.83 116.94 115.95 2k9p h PHE 99 Ca 0.13 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.69 2k9p h PHE 99 Cb -0.05 0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 2k9p h PHE 99 CO -0.05 -0.34 0.36 0.87 -2.23 0.00 0.00 178.31 176.92 2k9p h LYS 100 N -0.40 0.67 -0.87 1.11 1.57 -0.90 0.13 116.57 117.88 2k9p h LYS 100 Ca 0.05 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2k9p h LYS 100 Cb 0.46 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 2k9p h LYS 100 CO -0.20 0.45 0.56 -0.92 -0.57 0.00 0.00 179.45 178.77 2k9p h TYR 101 N 0.69 1.11 -0.22 -1.35 5.03 -0.80 0.67 116.97 122.09 2k9p h TYR 101 Ca 0.25 0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.52 2k9p h TYR 101 Cb 0.07 -0.37 -0.01 0.00 1.55 0.00 0.00 36.73 37.97 2k9p h TYR 101 CO -0.06 0.71 -0.10 -0.07 -1.32 0.00 0.00 178.16 177.31 2k9p h LEU 102 N 1.18 0.48 -1.30 2.82 3.38 -0.34 -3.18 115.31 118.36 2k9p h LEU 102 Ca 0.32 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 2k9p h LEU 102 Cb -0.12 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2k9p h LEU 102 CO -0.07 0.78 -0.34 0.17 0.09 0.00 0.00 178.44 179.07 2k9p h LEU 103 N 0.17 0.00 0.76 1.67 8.10 -0.57 -3.16 115.31 122.29 2k9p h LEU 103 Ca 0.05 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 58.00 2k9p h LEU 103 Cb 0.59 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.82 2k9p h LEU 103 CO 0.03 0.34 -0.37 -1.28 -4.11 0.00 0.00 178.44 173.05 2k9p h SER 104 N 0.00 -0.88 0.46 0.17 0.87 -0.84 -2.65 113.55 110.68 2k9p h SER 104 Ca -0.00 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2k9p h SER 104 Cb 0.66 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 2k9p h SER 104 CO 0.04 -0.62 0.00 -3.20 -0.53 0.00 0.00 176.83 172.52 2k9p n ASN 105 N -5.53 0.00 -2.94 6.23 5.15 -1.24 -4.71 115.26 112.21 2k9p n ASN 105 Ca -0.14 0.03 -0.13 0.00 -0.60 0.00 0.00 54.58 53.74 2k9p n ASN 105 Cb 0.41 -0.31 0.11 0.00 -0.53 0.00 0.00 39.78 39.46 2k9p n ASN 105 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2k9p n TYR 106 N -1.31 -3.42 -1.53 1.20 4.02 -1.00 -4.86 117.16 110.26 2k9p n TYR 106 Ca 0.10 -0.43 -0.27 0.00 -0.01 0.00 0.00 57.90 57.29 2k9p n TYR 106 Cb 0.19 -0.48 -0.13 0.00 -0.02 0.00 0.00 39.34 38.90 2k9p n TYR 106 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2k9p n SER 107 N -3.77 0.63 -1.20 7.72 2.88 -1.26 -4.77 113.62 113.85 2k9p n SER 107 Ca 0.07 -0.65 0.12 0.00 -1.33 0.00 0.00 58.87 57.07 2k9p n SER 107 Cb 0.25 -1.16 0.26 0.00 -0.75 0.00 0.00 64.21 62.81 2k9p n SER 107 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2k9p n SER 108 N 12.55 3.53 -3.61 -3.46 7.64 -1.26 -4.87 113.62 124.14 2k9p n SER 108 Ca 0.55 -1.99 -0.03 0.00 1.01 0.00 0.00 58.87 58.41 2k9p n SER 108 Cb 0.28 -0.33 -0.06 0.00 -1.01 0.00 0.00 64.21 63.10 2k9p n SER 108 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2k9p s VAL 109 N -1.34 -0.36 -2.00 0.44 0.11 -1.26 -5.22 120.40 110.77 2k9p s VAL 109 Ca 0.42 0.00 0.17 0.00 -2.93 0.00 0.00 61.98 59.64 2k9p s VAL 109 Cb 0.23 -1.00 0.49 0.00 -1.53 0.00 0.00 36.38 34.57 2k9p s VAL 109 CO 0.32 0.00 1.43 1.07 -3.33 0.00 0.00 175.10 174.58