#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9p h ASN 32 N 0.00 0.75 -4.67 1.61 4.21 -2.09 -3.49 115.58 111.90 2k9p h ASN 32 Ca 0.00 -0.89 -0.40 0.00 1.21 0.00 0.00 56.30 56.22 2k9p h ASN 32 Cb 0.00 -0.24 -0.14 0.00 -1.12 0.00 0.00 38.32 36.82 2k9p h ASN 32 CO 0.00 1.71 -0.57 -0.83 -1.29 0.00 0.00 177.43 176.45 2k9p s GLY 33 N -4.77 1.99 -0.53 2.83 0.00 -1.26 -5.13 107.32 100.45 2k9p s GLY 33 Ca -0.11 -1.77 0.04 0.00 0.00 0.00 0.00 44.72 42.89 2k9p s GLY 33 CO 0.91 -1.59 0.39 -0.56 0.00 0.00 0.00 173.10 172.26 2k9p s SER 34 N -3.36 2.92 -0.21 1.64 0.01 -1.26 -4.92 113.70 108.52 2k9p s SER 34 Ca 0.36 -3.35 0.16 0.00 1.31 0.00 0.00 55.95 54.43 2k9p s SER 34 Cb 0.06 -0.94 0.46 0.00 0.21 0.00 0.00 66.02 65.80 2k9p s SER 34 CO 0.17 -0.14 1.17 1.07 0.41 0.00 0.00 173.24 175.91 2k9p n THR 35 N 2.55 1.65 -4.22 1.44 5.66 -1.26 -5.06 114.28 115.04 2k9p n THR 35 Ca 0.24 -3.08 -0.15 0.00 -3.05 0.00 0.00 64.05 58.01 2k9p n THR 35 Cb 0.42 0.13 -0.11 0.00 -1.55 0.00 0.00 70.33 69.22 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 -3.29 1.13 1.01 1.09 1.09 -1.26 -5.16 121.20 115.82 2k9p s ILE 36 Ca 0.38 -1.78 -0.12 0.00 -1.10 0.00 0.00 60.65 58.04 2k9p s ILE 36 Cb 0.37 -1.55 0.16 0.00 -1.06 0.00 0.00 42.46 40.39 2k9p s ILE 36 CO -0.04 -0.56 0.89 0.35 -0.10 0.00 0.00 174.94 175.48 2k9p n THR 37 N 0.34 0.00 0.12 2.92 -2.24 -1.26 -4.90 114.28 109.26 2k9p n THR 37 Ca -0.14 -0.17 0.03 0.00 -2.27 0.00 0.00 64.05 61.49 2k9p n THR 37 Cb 0.58 -0.90 0.13 0.00 -2.10 0.00 0.00 70.33 68.04 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 -4.35 0.10 -0.21 4.78 3.72 -1.26 -2.85 117.46 117.39 2k9p n PHE 38 Ca 0.08 0.05 0.12 0.00 -0.05 0.00 0.00 57.45 57.65 2k9p n PHE 38 Cb 0.54 -0.58 0.42 0.00 -0.94 0.00 0.00 39.48 38.91 2k9p n PHE 38 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 2k9p h ASP 39 N 0.00 0.57 0.57 4.37 3.58 -1.99 -0.94 116.42 122.58 2k9p h ASP 39 Ca 0.00 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 2k9p h ASP 39 Cb 0.06 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 2k9p h ASP 39 CO 0.00 0.31 -0.37 -0.33 -2.88 0.00 0.00 179.24 175.97 2k9p h GLU 40 N 0.61 -0.87 -1.00 0.28 4.39 -1.89 -1.31 114.58 114.79 2k9p h GLU 40 Ca 0.39 0.06 0.03 0.00 0.34 0.00 0.00 59.36 60.18 2k9p h GLU 40 Cb 0.66 0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 29.45 2k9p h GLU 40 CO -0.15 -0.58 0.66 -0.07 -1.16 0.00 0.00 179.01 177.71 2k9p h LEU 41 N -0.90 1.12 0.05 1.33 -0.00 -1.66 -0.29 115.31 114.95 2k9p h LEU 41 Ca -0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.80 2k9p h LEU 41 Cb 0.74 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 41.12 2k9p h LEU 41 CO 0.06 0.78 -0.20 1.56 -0.00 0.00 0.00 178.44 180.64 2k9p h GLN 42 N 1.31 -0.27 -0.82 1.13 1.08 -1.03 -1.76 115.11 114.75 2k9p h GLN 42 Ca 0.39 0.02 0.08 0.00 -1.45 0.00 0.00 58.65 57.68 2k9p h GLN 42 Cb -0.06 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.37 2k9p h GLN 42 CO -0.11 -0.18 0.54 0.78 -0.95 0.00 0.00 178.83 178.91 2k9p h GLY 43 N -0.28 1.14 0.45 3.46 0.00 -0.98 -0.78 103.07 106.08 2k9p h GLY 43 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2k9p h GLY 43 CO -0.11 0.24 -0.44 1.41 0.00 0.00 0.00 176.54 177.64 2k9p h LEU 44 N 0.86 -1.24 -1.09 3.11 3.38 -0.94 -2.79 115.31 116.59 2k9p h LEU 44 Ca 0.36 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.39 2k9p h LEU 44 Cb 0.30 0.43 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 2k9p h LEU 44 CO -0.14 -0.56 -0.30 0.58 0.09 0.00 0.00 178.44 178.11 2k9p h VAL 45 N -0.82 0.74 0.32 1.22 2.07 -0.97 0.11 116.25 118.94 2k9p h VAL 45 Ca -0.02 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.22 2k9p h VAL 45 Cb 0.76 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 2k9p h VAL 45 CO -0.13 0.29 -0.35 -1.13 0.02 0.00 0.00 177.57 176.27 2k9p h ASN 46 N 0.00 -0.94 0.00 0.57 -1.24 -0.90 -3.42 115.58 109.65 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 0.79 0.32 -0.14 0.00 0.73 0.00 0.00 38.32 40.02 2k9p h ASN 46 CO 0.04 -0.48 -0.34 -0.24 -1.29 0.00 0.00 177.43 175.12 2k9p n SER 47 N -5.45 -2.17 0.18 1.15 2.88 -1.07 -4.99 113.62 104.14 2k9p n SER 47 Ca -0.09 -3.28 0.00 0.00 -1.33 0.00 0.00 58.87 54.17 2k9p n SER 47 Cb 0.36 1.75 0.00 0.00 -0.75 0.00 0.00 64.21 65.57 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 0.55 0.00 -0.32 2.46 -1.04 -0.59 -4.88 114.28 110.45 2k9p n THR 48 Ca 0.04 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.01 2k9p n THR 48 Cb 0.70 -0.26 0.08 0.00 -1.82 0.00 0.00 70.33 69.03 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 -0.58 12.58 3.04 -1.12 -2.59 116.25 128.82 2k9p h VAL 49 Ca 0.00 -0.52 -0.03 0.00 -1.01 0.00 0.00 66.70 65.15 2k9p h VAL 49 Cb 0.00 0.03 -0.03 0.00 -2.01 0.00 0.00 31.29 29.28 2k9p h VAL 49 CO 0.00 0.25 0.26 0.00 -1.01 0.00 0.00 177.57 177.06 2k9p h THR 50 N 1.18 1.20 -0.26 3.17 1.03 -1.82 -2.23 112.91 115.18 2k9p h THR 50 Ca 0.31 -0.60 -0.12 0.00 -0.01 0.00 0.00 66.41 65.99 2k9p h THR 50 Cb -0.05 0.48 -0.01 0.00 -1.07 0.00 0.00 68.15 67.50 2k9p h THR 50 CO -0.06 0.24 -0.33 -0.61 -0.01 0.00 0.00 175.52 174.76 2k9p h GLN 51 N 0.83 0.55 -0.73 0.00 4.15 -1.81 -3.06 115.11 115.05 2k9p h GLN 51 Ca 0.20 -0.25 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 2k9p h GLN 51 Cb 0.13 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 2k9p h GLN 51 CO -0.02 0.81 0.28 0.00 -1.93 0.00 0.00 178.83 177.97 2k9p h ALA 52 N 1.17 0.95 0.34 3.38 0.00 -1.13 -0.23 119.26 123.74 2k9p h ALA 52 Ca 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2k9p h ALA 52 Cb 0.80 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2k9p h ALA 52 CO 0.07 0.58 -0.16 0.82 0.00 0.00 0.00 179.25 180.55 2k9p h ILE 53 N 1.05 0.00 -0.91 0.00 2.04 -1.52 -2.65 117.51 115.52 2k9p h ILE 53 Ca 0.24 -0.07 0.15 0.00 1.00 0.00 0.00 64.86 66.18 2k9p h ILE 53 Cb 0.23 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.23 2k9p h ILE 53 CO -0.02 0.00 0.58 0.17 0.00 0.00 0.00 178.15 178.89 2k9p h LEU 54 N -0.52 0.68 0.00 1.44 8.10 -1.56 -1.11 115.31 122.34 2k9p h LEU 54 Ca -0.05 0.05 0.03 0.00 0.11 0.00 0.00 57.88 58.02 2k9p h LEU 54 Cb 0.35 -0.09 -0.04 0.00 -0.44 0.00 0.00 40.66 40.45 2k9p h LEU 54 CO 0.08 0.33 -0.19 0.15 -4.11 0.00 0.00 178.44 174.70 2k9p h PHE 55 N 0.71 -0.49 -0.40 0.17 3.57 -1.07 -1.98 116.94 117.45 2k9p h PHE 55 Ca 0.46 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.94 2k9p h PHE 55 Cb 0.74 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 2k9p h PHE 55 CO -0.00 -0.27 0.06 0.78 -2.23 0.00 0.00 178.31 176.65 2k9p h GLY 56 N -0.31 0.66 0.46 2.40 0.00 -0.86 -1.66 103.07 103.76 2k9p h GLY 56 Ca 0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 2k9p h GLY 56 CO -0.17 0.35 -0.24 -2.08 0.00 0.00 0.00 176.54 174.40 2k9p h VAL 57 N 0.60 0.00 -0.83 4.60 2.07 -0.78 0.16 116.25 122.06 2k9p h VAL 57 Ca 0.13 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 2k9p h VAL 57 Cb 0.28 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 2k9p h VAL 57 CO 0.00 0.00 0.50 0.08 0.02 0.00 0.00 177.57 178.18 2k9p h ARG 58 N -0.64 1.13 -0.30 1.57 0.11 -1.43 -1.60 114.38 113.22 2k9p h ARG 58 Ca -0.06 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 59.91 2k9p h ARG 58 Cb 0.49 -0.24 -0.01 0.00 1.11 0.00 0.00 29.97 31.32 2k9p h ARG 58 CO 0.09 0.79 0.17 0.77 0.10 0.00 0.00 179.97 181.90 2k9p h SER 59 N 1.14 0.37 0.72 0.08 0.02 -1.31 -0.57 113.55 114.01 2k9p h SER 59 Ca 0.30 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2k9p h SER 59 Cb -0.05 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.40 2k9p h SER 59 CO -0.06 0.34 -0.36 1.23 -1.14 0.00 0.00 176.83 176.84 2k9p h GLY 60 N 0.38 -1.04 0.71 -3.77 0.00 -0.43 0.10 103.07 99.01 2k9p h GLY 60 Ca 0.11 0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.86 2k9p h GLY 60 CO -0.02 -0.38 -0.06 0.00 0.00 0.00 0.00 176.54 176.08 2k9p h ALA 61 N -0.71 0.02 -0.76 3.60 0.00 -1.26 -0.04 119.26 120.10 2k9p h ALA 61 Ca -0.10 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2k9p h ALA 61 Cb 0.77 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2k9p h ALA 61 CO 0.15 -0.53 0.44 0.00 0.00 0.00 0.00 179.25 179.32 2k9p h ALA 62 N 1.02 1.36 -0.06 0.00 0.00 -1.11 -2.42 119.26 118.05 2k9p h ALA 62 Ca 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2k9p h ALA 62 Cb 0.16 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2k9p h ALA 62 CO -0.14 0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.65 2k9p h ALA 63 N 1.44 0.08 -0.02 0.00 0.00 -0.37 -2.30 119.26 118.10 2k9p h ALA 63 Ca 0.27 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2k9p h ALA 63 Cb -0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 2k9p h ALA 63 CO -0.05 -0.22 -0.38 1.25 0.00 0.00 0.00 179.25 179.84 2k9p h LEU 64 N -0.21 -1.16 -0.91 0.00 6.46 -0.86 -1.87 115.31 116.76 2k9p h LEU 64 Ca 0.02 0.15 0.07 0.00 -0.12 0.00 0.00 57.88 57.99 2k9p h LEU 64 Cb 0.37 0.46 -0.07 0.00 -0.73 0.00 0.00 40.66 40.70 2k9p h LEU 64 CO 0.00 -0.43 0.56 0.00 -0.62 0.00 0.00 178.44 177.96 2k9p h THR 65 N -0.53 1.03 -0.70 1.05 1.03 -1.50 -1.58 112.91 111.72 2k9p h THR 65 Ca 0.06 -0.35 0.12 0.00 -0.01 0.00 0.00 66.41 66.23 2k9p h THR 65 Cb 0.62 -0.07 -0.08 0.00 -1.07 0.00 0.00 68.15 67.55 2k9p h THR 65 CO -0.31 0.18 0.27 0.17 -0.01 0.00 0.00 175.52 175.83 2k9p h LEU 66 N 1.01 0.26 -0.21 0.00 8.10 -0.82 -0.64 115.31 123.00 2k9p h LEU 66 Ca 0.40 0.09 -0.03 0.00 0.11 0.00 0.00 57.88 58.46 2k9p h LEU 66 Cb 0.22 0.07 -0.01 0.00 -0.44 0.00 0.00 40.66 40.50 2k9p h LEU 66 CO -0.19 0.13 0.01 0.40 -4.11 0.00 0.00 178.44 174.68 2k9p h ILE 67 N 0.44 1.24 -0.04 0.15 2.04 -0.52 0.20 117.51 121.02 2k9p h ILE 67 Ca 0.37 -0.83 0.02 0.00 1.00 0.00 0.00 64.86 65.42 2k9p h ILE 67 Cb 0.51 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2k9p h ILE 67 CO -0.36 0.25 -0.08 0.58 0.00 0.00 0.00 178.15 178.55 2k9p h VAL 68 N 0.13 0.78 -0.53 1.67 2.07 -0.84 -0.10 116.25 119.42 2k9p h VAL 68 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2k9p h VAL 68 Cb 0.37 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 2k9p h VAL 68 CO 0.01 0.00 0.34 1.62 0.02 0.00 0.00 177.57 179.55 2k9p h VAL 69 N -0.12 1.15 -0.51 2.57 3.04 -1.08 -1.48 116.25 119.82 2k9p h VAL 69 Ca 0.05 -0.32 -0.03 0.00 -1.01 0.00 0.00 66.70 65.40 2k9p h VAL 69 Cb 0.18 0.40 -0.02 0.00 -2.01 0.00 0.00 31.29 29.84 2k9p h VAL 69 CO -0.12 0.15 0.21 -0.50 -1.01 0.00 0.00 177.57 176.31 2k9p h TRP 70 N 0.72 0.73 0.12 3.17 -0.00 -0.56 0.15 115.95 120.27 2k9p h TRP 70 Ca 0.19 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 59.05 2k9p h TRP 70 Cb -0.04 -0.23 0.00 0.00 -0.00 0.00 0.00 29.16 28.89 2k9p h TRP 70 CO -0.03 0.56 -0.06 0.82 -0.00 0.00 0.00 178.44 179.74 2k9p h ILE 71 N 0.73 1.07 -0.16 1.49 5.03 -0.77 -1.48 117.51 123.42 2k9p h ILE 71 Ca 0.18 -1.01 -0.13 0.00 -0.12 0.00 0.00 64.86 63.78 2k9p h ILE 71 Cb 0.14 1.68 0.00 0.00 -3.03 0.00 0.00 36.82 35.61 2k9p h ILE 71 CO -0.02 0.23 -0.39 0.00 -0.68 0.00 0.00 178.15 177.29 2k9p h THR 72 N -0.66 1.35 0.00 -0.27 1.03 -1.18 -3.16 112.91 110.02 2k9p h THR 72 Ca -0.02 -1.65 0.00 0.00 -0.01 0.00 0.00 66.41 64.73 2k9p h THR 72 Cb 0.51 1.98 0.00 0.00 -1.07 0.00 0.00 68.15 69.56 2k9p h THR 72 CO 0.03 0.50 0.00 -1.28 -0.01 0.00 0.00 175.52 174.76 2k9p h SER 73 N 0.19 0.00 -6.32 0.00 0.87 -0.86 -3.48 113.55 103.96 2k9p h SER 73 Ca -0.00 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.19 2k9p h SER 73 Cb 1.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2k9p h SER 73 CO 0.09 0.00 -0.78 0.54 -0.53 0.00 0.00 176.83 176.14 2k9p n ARG 74 N -2.39 -1.33 0.00 2.24 5.12 -0.57 -4.95 116.66 114.78 2k9p n ARG 74 Ca 0.04 0.84 0.00 0.00 -1.93 0.00 0.00 57.85 56.81 2k9p n ARG 74 Cb 0.40 -3.52 0.00 0.00 -1.16 0.00 0.00 32.46 28.17 2k9p n ARG 74 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2k9p n SER 75 N -2.38 0.00 -3.35 0.55 2.88 -1.11 -4.95 113.62 105.26 2k9p n SER 75 Ca -0.18 0.76 -0.09 0.00 -1.33 0.00 0.00 58.87 58.03 2k9p n SER 75 Cb 0.62 -0.26 -0.01 0.00 -0.75 0.00 0.00 64.21 63.80 2k9p n SER 75 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2k9p s ARG 76 N -2.06 1.98 -1.13 -1.46 1.81 -1.26 -5.06 118.95 111.77 2k9p s ARG 76 Ca 0.00 -1.36 -0.10 0.00 -1.72 0.00 0.00 55.73 52.55 2k9p s ARG 76 Cb 0.00 0.57 -0.07 0.00 -0.45 0.00 0.00 34.95 35.00 2k9p s ARG 76 CO 0.00 -0.89 2.31 1.63 -0.68 0.00 0.00 175.30 177.67 2k9p n LYS 77 N -0.50 2.48 -1.55 3.54 4.01 -1.26 -4.97 118.16 119.92 2k9p n LYS 77 Ca -0.05 -1.82 -0.37 0.00 -0.51 0.00 0.00 58.31 55.57 2k9p n LYS 77 Cb 0.60 -2.70 0.07 0.00 -0.51 0.00 0.00 35.03 32.50 2k9p n LYS 77 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 2k9p n THR 78 N 4.41 3.74 -1.97 -0.18 -2.24 -1.26 -4.92 114.28 111.86 2k9p n THR 78 Ca 0.55 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 2k9p n THR 78 Cb 0.22 -1.22 -0.03 0.00 -2.10 0.00 0.00 70.33 67.20 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 -3.17 4.23 0.32 -0.78 0.04 -1.26 -4.90 135.00 129.48 2k9p s PRO 79 Ca 0.77 2.30 0.09 0.00 0.04 0.00 0.00 61.00 64.21 2k9p s PRO 79 Cb -0.38 -3.25 0.89 0.00 0.04 0.00 0.00 34.50 31.80 2k9p s PRO 79 CO 0.46 -0.60 1.72 -0.84 0.04 0.00 0.00 177.00 177.78 2k9p h ILE 80 N 4.20 0.50 -0.44 0.56 3.07 -2.00 -1.40 117.51 122.01 2k9p h ILE 80 Ca -0.42 -0.18 0.06 0.00 1.55 0.00 0.00 64.86 65.87 2k9p h ILE 80 Cb 1.20 -0.07 -0.05 0.00 -0.27 0.00 0.00 36.82 37.63 2k9p h ILE 80 CO 0.91 0.10 0.13 0.15 -1.05 0.00 0.00 178.15 178.38 2k9p h PHE 81 N 0.52 0.22 0.90 0.16 3.04 -1.98 0.15 116.94 119.95 2k9p h PHE 81 Ca 0.64 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.57 2k9p h PHE 81 Cb 1.25 -0.03 0.01 0.00 2.56 0.00 0.00 35.95 39.74 2k9p h PHE 81 CO -0.03 0.06 -0.43 0.82 -2.02 0.00 0.00 178.31 176.72 2k9p h ILE 82 N 0.28 0.11 -0.85 1.41 1.08 -1.65 -0.51 117.51 117.38 2k9p h ILE 82 Ca 0.21 -0.02 0.06 0.00 -0.39 0.00 0.00 64.86 64.72 2k9p h ILE 82 Cb 0.23 0.11 -0.06 0.00 -3.07 0.00 0.00 36.82 34.03 2k9p h ILE 82 CO -0.24 0.00 0.53 0.40 -0.69 0.00 0.00 178.15 178.16 2k9p h ILE 83 N -1.22 1.06 0.50 -0.67 1.08 -1.18 0.17 117.51 117.24 2k9p h ILE 83 Ca -0.12 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 63.99 2k9p h ILE 83 Cb 0.93 -0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 2k9p h ILE 83 CO 0.20 0.18 -0.33 0.78 -0.69 0.00 0.00 178.15 178.29 2k9p h ASN 84 N 0.98 -0.83 -0.80 1.72 -0.26 -0.70 -1.68 115.58 114.01 2k9p h ASN 84 Ca 0.37 0.05 0.16 0.00 -0.56 0.00 0.00 56.30 56.32 2k9p h ASN 84 Cb 0.14 0.25 -0.10 0.00 -1.06 0.00 0.00 38.32 37.55 2k9p h ASN 84 CO -0.16 -0.51 0.33 1.56 -1.06 0.00 0.00 177.43 177.59 2k9p h GLN 85 N -0.79 0.43 0.84 0.81 4.20 -0.22 0.97 115.11 121.34 2k9p h GLN 85 Ca -0.06 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 2k9p h GLN 85 Cb 0.66 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2k9p h GLN 85 CO 0.04 0.28 -0.44 0.28 -0.67 0.00 0.00 178.83 178.33 2k9p h VAL 86 N 0.44 0.00 -0.14 -0.54 2.07 -0.76 0.62 116.25 117.95 2k9p h VAL 86 Ca 0.46 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.01 2k9p h VAL 86 Cb 0.74 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2k9p h VAL 86 CO -0.44 0.00 -0.08 0.28 0.02 0.00 0.00 177.57 177.35 2k9p h SER 87 N -1.17 -0.27 -0.05 0.57 0.02 -0.98 -2.55 113.55 109.13 2k9p h SER 87 Ca -0.11 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2k9p h SER 87 Cb 0.91 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.55 2k9p h SER 87 CO 0.16 -0.11 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.46 2k9p h LEU 88 N -0.08 -0.63 -0.75 5.07 4.07 -0.83 -2.43 115.31 119.74 2k9p h LEU 88 Ca 0.08 0.10 0.16 0.00 0.08 0.00 0.00 57.88 58.30 2k9p h LEU 88 Cb 0.20 0.27 -0.11 0.00 1.08 0.00 0.00 40.66 42.10 2k9p h LEU 88 CO -0.19 -0.27 0.19 0.15 -1.08 0.00 0.00 178.44 177.24 2k9p h PHE 89 N -0.31 0.29 0.52 1.13 3.57 -0.63 0.13 116.94 121.65 2k9p h PHE 89 Ca 0.07 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2k9p h PHE 89 Cb 0.41 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 2k9p h PHE 89 CO -0.28 -0.09 -0.40 -0.07 -2.23 0.00 0.00 178.31 175.24 2k9p h LEU 90 N 0.27 -1.05 -0.28 0.59 3.38 -1.03 0.48 115.31 117.66 2k9p h LEU 90 Ca 0.43 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.45 2k9p h LEU 90 Cb 0.74 0.33 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2k9p h LEU 90 CO -0.52 -0.59 0.10 0.40 0.09 0.00 0.00 178.44 177.93 2k9p h ILE 91 N -0.90 1.19 -0.54 1.22 2.04 -1.07 -0.54 117.51 118.91 2k9p h ILE 91 Ca -0.06 -0.59 0.03 0.00 1.00 0.00 0.00 64.86 65.24 2k9p h ILE 91 Cb 0.77 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 2k9p h ILE 91 CO 0.01 0.20 0.31 0.40 0.00 0.00 0.00 178.15 179.07 2k9p h ILE 92 N 0.30 1.03 0.44 -0.67 2.04 -0.72 0.12 117.51 120.04 2k9p h ILE 92 Ca 0.09 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 2k9p h ILE 92 Cb 0.21 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 2k9p h ILE 92 CO -0.01 0.11 -0.44 0.25 0.00 0.00 0.00 178.15 178.06 2k9p h LEU 93 N 0.61 -1.21 -0.52 1.44 5.85 -0.77 0.38 115.31 121.09 2k9p h LEU 93 Ca 0.22 0.10 0.03 0.00 0.84 0.00 0.00 57.88 59.07 2k9p h LEU 93 Cb 0.05 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2k9p h LEU 93 CO -0.11 -0.60 0.31 -0.74 -0.34 0.00 0.00 178.44 176.96 2k9p h HIS 94 N -0.89 0.58 0.51 1.25 2.76 -0.65 0.86 115.15 119.56 2k9p h HIS 94 Ca -0.04 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 2k9p h HIS 94 Cb 0.79 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.56 2k9p h HIS 94 CO -0.24 0.32 -0.32 0.77 -1.30 0.00 0.00 177.93 177.17 2k9p h SER 95 N 0.61 -0.79 -0.56 3.26 0.02 -0.79 -0.45 113.55 114.85 2k9p h SER 95 Ca 0.21 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.26 2k9p h SER 95 Cb 0.03 0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 2k9p h SER 95 CO -0.10 -0.50 0.28 0.00 -1.14 0.00 0.00 176.83 175.37 2k9p h ALA 96 N -0.36 0.73 0.48 3.77 0.00 -0.59 1.00 119.26 124.29 2k9p h ALA 96 Ca -0.06 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2k9p h ALA 96 Cb 0.64 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2k9p h ALA 96 CO 0.06 -0.07 -0.34 -0.07 0.00 0.00 0.00 179.25 178.83 2k9p h LEU 97 N 0.53 -0.88 -0.38 0.00 3.38 -0.77 0.30 115.31 117.49 2k9p h LEU 97 Ca 0.25 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.31 2k9p h LEU 97 Cb 0.18 0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2k9p h LEU 97 CO -0.19 -0.50 0.18 0.22 0.09 0.00 0.00 178.44 178.25 2k9p h TYR 98 N -0.79 0.33 0.27 1.13 5.03 -0.95 0.28 116.97 122.28 2k9p h TYR 98 Ca -0.06 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.26 2k9p h TYR 98 Cb 0.64 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.81 2k9p h TYR 98 CO -0.09 0.17 -0.25 0.35 -1.32 0.00 0.00 178.16 177.03 2k9p h PHE 99 N 0.37 -0.66 -0.87 -3.82 3.57 -0.82 -0.65 116.94 114.06 2k9p h PHE 99 Ca 0.16 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.72 2k9p h PHE 99 Cb 0.08 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 2k9p h PHE 99 CO -0.10 -0.37 0.57 0.87 -2.23 0.00 0.00 178.31 177.05 2k9p h LYS 100 N -0.55 0.96 -0.84 1.11 1.57 -0.68 0.14 116.57 118.28 2k9p h LYS 100 Ca -0.01 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2k9p h LYS 100 Cb 0.50 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 2k9p h LYS 100 CO -0.04 0.64 0.48 -0.92 -0.57 0.00 0.00 179.45 179.03 2k9p h TYR 101 N 0.99 1.14 0.00 -1.35 3.20 -0.47 0.47 116.97 120.96 2k9p h TYR 101 Ca 0.37 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.22 2k9p h TYR 101 Cb 0.19 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.09 2k9p h TYR 101 CO -0.00 0.79 -0.54 1.37 -1.64 0.00 0.00 178.16 178.13 2k9p h LEU 102 N 1.17 0.00 0.05 2.82 8.10 -0.39 -3.36 115.31 123.70 2k9p h LEU 102 Ca 0.30 -0.13 -0.37 0.00 0.11 0.00 0.00 57.88 57.79 2k9p h LEU 102 Cb 0.01 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.18 2k9p h LEU 102 CO -0.05 0.06 -2.25 0.00 -4.11 0.00 0.00 178.44 172.09 2k9p n LEU 103 N -2.32 2.50 0.03 0.17 -0.00 0.44 -4.12 117.00 113.70 2k9p n LEU 103 Ca 0.03 0.03 0.02 0.00 -0.00 0.00 0.00 56.01 56.09 2k9p n LEU 103 Cb 0.46 -0.82 0.38 0.00 -0.00 0.00 0.00 43.42 43.44 2k9p n LEU 103 CO 0.36 0.84 1.02 -1.28 -0.00 0.00 0.00 177.39 178.34 2k9p h SER 104 N 0.03 0.42 -0.11 1.45 0.87 -1.08 -2.19 113.55 112.94 2k9p h SER 104 Ca -0.50 -0.05 -0.15 0.00 -1.23 0.00 0.00 61.79 59.86 2k9p h SER 104 Cb 1.98 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.83 2k9p h SER 104 CO -0.01 0.42 -0.46 0.78 -0.53 0.00 0.00 176.83 177.04 2k9p h ASN 105 N 0.46 0.71 0.85 6.23 2.35 -1.77 -3.36 115.58 121.05 2k9p h ASN 105 Ca 0.11 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.48 2k9p h ASN 105 Cb 0.17 -0.20 0.01 0.00 0.05 0.00 0.00 38.32 38.34 2k9p h ASN 105 CO -0.01 1.06 -0.41 1.88 -1.65 0.00 0.00 177.43 178.31 2k9p h TYR 106 N 0.53 -1.06 -3.50 1.19 0.05 -1.55 -3.44 116.97 109.19 2k9p h TYR 106 Ca 0.03 -0.02 -0.32 0.00 0.05 0.00 0.00 58.73 58.47 2k9p h TYR 106 Cb 1.00 0.35 -0.34 0.00 1.01 0.00 0.00 36.73 38.74 2k9p h TYR 106 CO 0.05 -0.65 -0.74 0.45 -1.05 0.00 0.00 178.16 176.22 2k9p s SER 107 N -4.24 0.23 0.36 3.88 0.15 -1.14 -5.15 113.70 107.79 2k9p s SER 107 Ca -0.17 0.02 0.07 0.00 0.70 0.00 0.00 55.95 56.57 2k9p s SER 107 Cb 0.02 -0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.20 2k9p s SER 107 CO 0.52 -0.13 0.46 -0.55 1.20 0.00 0.00 173.24 174.74 2k9p s SER 108 N 1.12 5.75 -0.30 5.45 0.15 -1.26 -4.54 113.70 120.07 2k9p s SER 108 Ca -0.08 -0.32 -0.15 0.00 0.70 0.00 0.00 55.95 56.10 2k9p s SER 108 Cb -0.13 -1.03 0.15 0.00 -1.71 0.00 0.00 66.02 63.30 2k9p s SER 108 CO -0.03 -0.50 0.92 0.54 1.20 0.00 0.00 173.24 175.37 2k9p s VAL 109 N -2.25 -0.40 -1.95 4.45 0.11 -1.26 -5.19 120.40 113.92 2k9p s VAL 109 Ca 0.47 0.00 0.16 0.00 -2.93 0.00 0.00 61.98 59.67 2k9p s VAL 109 Cb -0.09 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.89 2k9p s VAL 109 CO 0.31 0.00 0.99 0.41 -3.33 0.00 0.00 175.10 173.48