#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9p s ASN 32 N 0.00 5.33 0.00 1.61 -0.87 -1.26 -4.47 114.94 115.28 2k9p s ASN 32 Ca 0.00 1.03 0.00 0.00 -1.57 0.00 0.00 52.86 52.32 2k9p s ASN 32 Cb 0.00 -2.52 0.00 0.00 -0.02 0.00 0.00 41.25 38.71 2k9p s ASN 32 CO 0.00 -2.20 0.00 0.61 -2.57 0.00 0.00 177.10 172.94 2k9p n GLY 33 N 5.68 -0.57 3.20 0.66 0.00 -1.26 -5.13 105.19 107.77 2k9p n GLY 33 Ca 0.26 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.25 2k9p n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k9p s SER 34 N -1.88 0.20 -0.54 1.61 0.15 -1.26 -4.92 113.70 107.05 2k9p s SER 34 Ca 0.00 -0.82 -0.04 0.00 0.70 0.00 0.00 55.95 55.79 2k9p s SER 34 Cb 0.00 0.33 0.04 0.00 -1.71 0.00 0.00 66.02 64.67 2k9p s SER 34 CO 0.00 -0.74 0.12 1.07 1.20 0.00 0.00 173.24 174.89 2k9p n THR 35 N -0.06 -0.20 -1.51 6.45 5.66 -1.26 -4.91 114.28 118.45 2k9p n THR 35 Ca -0.12 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.56 2k9p n THR 35 Cb 0.62 -0.55 0.07 0.00 -1.55 0.00 0.00 70.33 68.92 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 -2.35 3.38 0.98 1.09 1.09 -1.26 -5.02 121.20 119.12 2k9p s ILE 36 Ca 0.14 0.53 -0.13 0.00 -1.10 0.00 0.00 60.65 60.09 2k9p s ILE 36 Cb -0.08 -3.05 0.08 0.00 -1.06 0.00 0.00 42.46 38.35 2k9p s ILE 36 CO 0.17 -0.51 0.52 0.35 -0.10 0.00 0.00 174.94 175.37 2k9p n THR 37 N -3.01 0.00 0.17 2.92 -2.24 -1.26 -4.88 114.28 105.97 2k9p n THR 37 Ca 0.09 -0.18 0.11 0.00 -2.27 0.00 0.00 64.05 61.80 2k9p n THR 37 Cb 0.53 -0.71 0.58 0.00 -2.10 0.00 0.00 70.33 68.63 2k9p n THR 37 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 2k9p n PHE 38 N -3.92 0.73 -0.24 4.78 1.16 -1.26 -2.71 117.46 116.00 2k9p n PHE 38 Ca 0.07 0.38 0.13 0.00 -1.87 0.00 0.00 57.45 56.16 2k9p n PHE 38 Cb 0.55 -1.10 0.42 0.00 -1.61 0.00 0.00 39.48 37.74 2k9p n PHE 38 CO 0.00 0.00 0.00 0.22 -1.87 0.00 0.00 176.76 175.11 2k9p h ASP 39 N 0.00 0.57 0.45 5.98 3.58 -1.99 -0.02 116.42 125.00 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 0.03 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2k9p h ASP 39 CO 0.00 0.29 -0.22 -0.33 -2.88 0.00 0.00 179.24 176.10 2k9p h GLU 40 N 0.60 -0.59 -0.88 0.28 4.39 -1.87 -1.25 114.58 115.27 2k9p h GLU 40 Ca 0.42 0.04 0.03 0.00 0.34 0.00 0.00 59.36 60.19 2k9p h GLU 40 Cb 0.76 0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.50 2k9p h GLU 40 CO -0.18 -0.34 0.57 -0.07 -1.16 0.00 0.00 179.01 177.84 2k9p h LEU 41 N -0.71 0.96 0.11 1.33 -0.00 -1.64 -0.13 115.31 115.24 2k9p h LEU 41 Ca -0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2k9p h LEU 41 Cb 0.52 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.94 2k9p h LEU 41 CO 0.10 0.67 -0.22 1.56 -0.00 0.00 0.00 178.44 180.55 2k9p h GLN 42 N 1.13 -0.35 -0.53 1.13 1.08 -0.92 -1.45 115.11 115.20 2k9p h GLN 42 Ca 0.35 0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.67 2k9p h GLN 42 Cb -0.03 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 2k9p h GLN 42 CO -0.11 -0.23 0.36 0.78 -0.95 0.00 0.00 178.83 178.68 2k9p h GLY 43 N -0.36 0.40 0.43 3.46 0.00 -1.05 0.89 103.07 106.84 2k9p h GLY 43 Ca -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2k9p h GLY 43 CO -0.09 0.07 -0.48 1.41 0.00 0.00 0.00 176.54 177.45 2k9p h LEU 44 N 0.29 -1.35 0.00 3.11 3.38 -0.72 0.18 115.31 120.20 2k9p h LEU 44 Ca 0.25 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2k9p h LEU 44 Cb 0.59 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2k9p h LEU 44 CO -0.05 -0.62 0.00 0.52 0.09 0.00 0.00 178.44 178.37 2k9p n VAL 45 N -5.35 0.06 0.46 1.22 0.31 -0.57 -0.20 118.33 114.25 2k9p n VAL 45 Ca -0.11 0.01 0.06 0.00 -0.01 0.00 0.00 64.34 64.29 2k9p n VAL 45 Cb 0.43 -0.53 0.05 0.00 -0.91 0.00 0.00 33.84 32.88 2k9p n VAL 45 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2k9p n ASN 46 N -1.38 1.92 0.00 4.52 3.02 0.25 -2.71 115.26 120.88 2k9p n ASN 46 Ca 0.11 -1.46 0.00 0.00 -0.03 0.00 0.00 54.58 53.20 2k9p n ASN 46 Cb 0.27 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 2k9p n ASN 46 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2k9p n SER 47 N 0.62 0.00 0.00 6.41 7.64 0.62 -4.83 113.62 124.08 2k9p n SER 47 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2k9p n SER 47 Cb 0.28 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2k9p n SER 47 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2k9p n THR 48 N -1.59 0.00 0.07 0.44 -1.04 -0.12 -4.39 114.28 107.64 2k9p n THR 48 Ca 0.00 0.16 0.08 0.00 -2.04 0.00 0.00 64.05 62.25 2k9p n THR 48 Cb 0.00 -0.81 0.52 0.00 -1.82 0.00 0.00 70.33 68.23 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 0.00 1.01 -1.03 12.58 2.07 -0.85 -2.31 116.25 127.72 2k9p h VAL 49 Ca 0.00 -0.11 0.27 0.00 0.82 0.00 0.00 66.70 67.68 2k9p h VAL 49 Cb 0.00 0.67 -0.12 0.00 -1.52 0.00 0.00 31.29 30.32 2k9p h VAL 49 CO 0.00 0.06 0.62 0.00 0.02 0.00 0.00 177.57 178.27 2k9p h THR 50 N 0.32 0.50 -0.18 2.57 1.03 -1.63 0.12 112.91 115.63 2k9p h THR 50 Ca 0.13 -0.17 -0.10 0.00 -0.01 0.00 0.00 66.41 66.26 2k9p h THR 50 Cb 0.13 -0.03 -0.01 0.00 -1.07 0.00 0.00 68.15 67.16 2k9p h THR 50 CO -0.03 0.09 -0.33 1.56 -0.01 0.00 0.00 175.52 176.80 2k9p h GLN 51 N 0.49 0.37 -0.81 0.00 4.20 -1.62 -3.01 115.11 114.73 2k9p h GLN 51 Ca 0.65 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 59.20 2k9p h GLN 51 Cb 1.40 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 29.12 2k9p h GLN 51 CO -0.43 0.66 0.53 0.00 -0.67 0.00 0.00 178.83 178.92 2k9p h ALA 52 N 1.33 1.03 0.60 3.87 0.00 -0.89 0.14 119.26 125.35 2k9p h ALA 52 Ca 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2k9p h ALA 52 Cb 0.74 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2k9p h ALA 52 CO 0.06 0.46 -0.29 0.82 0.00 0.00 0.00 179.25 180.30 2k9p h ILE 53 N 1.11 0.40 -0.13 0.00 5.03 -1.49 -1.61 117.51 120.82 2k9p h ILE 53 Ca 0.30 -0.09 0.04 0.00 -0.12 0.00 0.00 64.86 64.99 2k9p h ILE 53 Cb -0.10 0.43 -0.04 0.00 -3.03 0.00 0.00 36.82 34.07 2k9p h ILE 53 CO -0.06 0.01 -0.13 -0.07 -0.68 0.00 0.00 178.15 177.22 2k9p h LEU 54 N -0.86 -0.41 -0.28 1.44 3.38 -1.35 -0.90 115.31 116.33 2k9p h LEU 54 Ca -0.08 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2k9p h LEU 54 Cb 0.64 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 2k9p h LEU 54 CO 0.13 -0.17 0.07 0.15 0.09 0.00 0.00 178.44 178.71 2k9p h PHE 55 N -0.16 0.12 -0.66 1.13 3.57 -0.78 -1.39 116.94 118.77 2k9p h PHE 55 Ca 0.09 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.64 2k9p h PHE 55 Cb 0.29 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 2k9p h PHE 55 CO -0.25 0.04 0.40 0.78 -2.23 0.00 0.00 178.31 177.05 2k9p h GLY 56 N 0.18 0.95 0.81 2.40 0.00 -0.91 -0.34 103.07 106.16 2k9p h GLY 56 Ca 0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 2k9p h GLY 56 CO -0.16 0.24 -0.39 -2.08 0.00 0.00 0.00 176.54 174.15 2k9p h VAL 57 N 0.78 0.00 -0.95 4.60 2.07 -0.72 -0.89 116.25 121.13 2k9p h VAL 57 Ca 0.27 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.83 2k9p h VAL 57 Cb 0.05 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.75 2k9p h VAL 57 CO -0.12 0.00 0.62 0.08 0.02 0.00 0.00 177.57 178.17 2k9p h ARG 58 N -1.11 1.04 0.56 1.57 0.11 -1.27 -1.81 114.38 113.46 2k9p h ARG 58 Ca -0.11 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 59.89 2k9p h ARG 58 Cb 0.83 -0.23 -0.01 0.00 1.11 0.00 0.00 29.97 31.66 2k9p h ARG 58 CO 0.18 0.69 -0.40 1.03 0.10 0.00 0.00 179.97 181.57 2k9p h SER 59 N 1.07 -1.04 -0.19 0.08 0.87 -0.98 0.10 113.55 113.46 2k9p h SER 59 Ca 0.42 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 61.06 2k9p h SER 59 Cb 0.24 0.32 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 2k9p h SER 59 CO -0.17 -0.60 0.08 1.23 -0.53 0.00 0.00 176.83 176.85 2k9p h GLY 60 N -0.93 0.25 0.94 5.77 0.00 -0.85 0.65 103.07 108.91 2k9p h GLY 60 Ca -0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 2k9p h GLY 60 CO 0.03 0.05 0.12 0.00 0.00 0.00 0.00 176.54 176.73 2k9p h ALA 61 N 1.11 0.28 -0.63 3.60 0.00 -1.34 -1.82 119.26 120.45 2k9p h ALA 61 Ca 0.08 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2k9p h ALA 61 Cb 0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2k9p h ALA 61 CO -0.07 -0.19 0.42 0.00 0.00 0.00 0.00 179.25 179.41 2k9p h ALA 62 N 1.00 1.59 0.13 0.00 0.00 -0.59 -2.05 119.26 119.34 2k9p h ALA 62 Ca 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2k9p h ALA 62 Cb 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2k9p h ALA 62 CO -0.01 0.36 -0.06 0.00 0.00 0.00 0.00 179.25 179.54 2k9p h ALA 63 N 1.62 -0.17 -0.17 0.00 0.00 -0.56 -2.17 119.26 117.81 2k9p h ALA 63 Ca 0.24 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2k9p h ALA 63 Cb -0.03 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2k9p h ALA 63 CO -0.06 -0.48 -0.13 1.25 0.00 0.00 0.00 179.25 179.83 2k9p h LEU 64 N -0.41 -0.42 -1.05 0.00 6.46 -1.06 -1.16 115.31 117.67 2k9p h LEU 64 Ca -0.02 0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.86 2k9p h LEU 64 Cb 0.33 0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.42 2k9p h LEU 64 CO 0.03 -0.17 0.64 0.00 -0.62 0.00 0.00 178.44 178.32 2k9p h THR 65 N -0.14 1.19 -0.68 1.05 1.03 -1.42 -2.16 112.91 111.78 2k9p h THR 65 Ca 0.11 -0.43 -0.03 0.00 -0.01 0.00 0.00 66.41 66.05 2k9p h THR 65 Cb 0.30 -0.17 -0.03 0.00 -1.07 0.00 0.00 68.15 67.18 2k9p h THR 65 CO -0.26 0.23 0.31 0.17 -0.01 0.00 0.00 175.52 175.97 2k9p h LEU 66 N 1.25 0.90 0.45 0.00 8.10 -0.84 -1.43 115.31 123.75 2k9p h LEU 66 Ca 0.38 -0.14 -0.01 0.00 0.11 0.00 0.00 57.88 58.21 2k9p h LEU 66 Cb -0.04 -0.23 -0.01 0.00 -0.44 0.00 0.00 40.66 39.94 2k9p h LEU 66 CO -0.11 0.79 -0.31 0.40 -4.11 0.00 0.00 178.44 175.10 2k9p h ILE 67 N 0.95 0.36 -0.64 0.15 2.04 -0.61 -0.54 117.51 119.21 2k9p h ILE 67 Ca 0.23 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.11 2k9p h ILE 67 Cb 0.14 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 2k9p h ILE 67 CO -0.03 0.00 0.42 -0.37 0.00 0.00 0.00 178.15 178.17 2k9p h VAL 68 N -0.74 1.13 -0.59 1.67 -1.51 -1.42 -0.64 116.25 114.16 2k9p h VAL 68 Ca -0.05 -0.29 0.10 0.00 -1.23 0.00 0.00 66.70 65.23 2k9p h VAL 68 Cb 0.62 0.22 -0.07 0.00 -2.13 0.00 0.00 31.29 29.93 2k9p h VAL 68 CO 0.03 0.15 0.19 0.58 -1.23 0.00 0.00 177.57 177.29 2k9p h VAL 69 N 0.84 0.74 0.00 7.19 2.07 -0.93 -0.67 116.25 125.49 2k9p h VAL 69 Ca 0.24 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.55 2k9p h VAL 69 Cb -0.06 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2k9p h VAL 69 CO -0.07 0.06 -0.43 -0.25 0.02 0.00 0.00 177.57 176.90 2k9p h TRP 70 N 0.35 0.00 -0.45 1.57 7.01 -0.70 0.23 115.95 123.97 2k9p h TRP 70 Ca 0.30 0.00 -0.11 0.00 2.11 0.00 0.00 58.89 61.19 2k9p h TRP 70 Cb 0.39 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 2k9p h TRP 70 CO -0.19 0.43 -0.17 0.82 -2.79 0.00 0.00 178.44 176.54 2k9p h ILE 71 N 0.00 1.27 0.00 2.65 2.04 0.32 -3.02 117.51 120.77 2k9p h ILE 71 Ca -0.00 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.56 2k9p h ILE 71 Cb 0.96 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 2k9p h ILE 71 CO 0.06 0.44 -0.47 1.07 0.00 0.00 0.00 178.15 179.25 2k9p n THR 72 N -4.13 0.80 0.23 -0.27 5.66 -0.56 -4.72 114.28 111.29 2k9p n THR 72 Ca 0.01 0.29 0.11 0.00 -3.05 0.00 0.00 64.05 61.41 2k9p n THR 72 Cb 0.42 -1.88 0.47 0.00 -1.55 0.00 0.00 70.33 67.79 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 -0.47 0.00 -6.36 1.09 0.87 -0.80 -3.47 113.55 104.40 2k9p h SER 73 Ca 0.00 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 60.08 2k9p h SER 73 Cb 0.47 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.38 2k9p h SER 73 CO 0.00 0.20 -0.80 0.54 -0.53 0.00 0.00 176.83 176.24 2k9p n ARG 74 N -3.35 -4.79 -0.10 2.24 5.12 -0.37 -4.91 116.66 110.49 2k9p n ARG 74 Ca 0.00 0.54 -0.06 0.00 -1.93 0.00 0.00 57.85 56.41 2k9p n ARG 74 Cb 0.42 -5.26 -0.05 0.00 -1.16 0.00 0.00 32.46 26.41 2k9p n ARG 74 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2k9p h SER 75 N -1.93 -0.90 -3.42 0.55 0.87 -1.82 -3.40 113.55 103.51 2k9p h SER 75 Ca -0.59 0.12 -0.63 0.00 -1.23 0.00 0.00 61.79 59.46 2k9p h SER 75 Cb 1.37 0.37 -0.33 0.00 -0.44 0.00 0.00 62.40 63.38 2k9p h SER 75 CO 0.67 -0.17 -0.86 -0.13 -0.53 0.00 0.00 176.83 175.81 2k9p s ARG 76 N -4.20 2.63 -1.34 2.24 0.52 -1.26 -5.05 118.95 112.49 2k9p s ARG 76 Ca -0.06 -0.75 -0.10 0.00 -0.52 0.00 0.00 55.73 54.29 2k9p s ARG 76 Cb 0.04 -2.04 -0.06 0.00 0.52 0.00 0.00 34.95 33.41 2k9p s ARG 76 CO 0.28 0.16 2.53 1.63 0.02 0.00 0.00 175.30 179.92 2k9p n LYS 77 N 3.55 2.95 -1.55 3.54 4.76 -1.26 -4.97 118.16 125.18 2k9p n LYS 77 Ca -0.20 -2.04 -0.39 0.00 -2.87 0.00 0.00 58.31 52.82 2k9p n LYS 77 Cb 0.53 -2.80 0.04 0.00 -1.84 0.00 0.00 35.03 30.96 2k9p n LYS 77 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2k9p n THR 78 N 4.19 2.91 -1.94 -0.18 -2.24 -1.26 -4.94 114.28 110.82 2k9p n THR 78 Ca 0.63 -0.50 -0.35 0.00 -2.27 0.00 0.00 64.05 61.56 2k9p n THR 78 Cb 0.24 -0.95 0.04 0.00 -2.10 0.00 0.00 70.33 67.56 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 -2.35 2.90 0.26 -0.78 0.04 -1.26 -4.81 135.00 129.01 2k9p s PRO 79 Ca 0.71 1.73 -0.02 0.00 0.04 0.00 0.00 61.00 63.46 2k9p s PRO 79 Cb -0.46 -1.93 0.57 0.00 0.04 0.00 0.00 34.50 32.73 2k9p s PRO 79 CO 0.52 -1.24 1.67 -0.84 0.04 0.00 0.00 177.00 177.15 2k9p h ILE 80 N 0.67 0.43 -0.57 0.56 3.07 -2.00 -0.93 117.51 118.75 2k9p h ILE 80 Ca -0.50 -0.09 0.07 0.00 1.55 0.00 0.00 64.86 65.90 2k9p h ILE 80 Cb 1.29 0.15 -0.06 0.00 -0.27 0.00 0.00 36.82 37.93 2k9p h ILE 80 CO 0.55 0.05 0.26 -0.26 -1.05 0.00 0.00 178.15 177.69 2k9p h PHE 81 N 0.26 0.46 0.37 0.16 0.04 -1.98 0.10 116.94 116.34 2k9p h PHE 81 Ca 0.48 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.26 2k9p h PHE 81 Cb 0.88 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2k9p h PHE 81 CO -0.26 0.18 -0.18 0.82 -0.60 0.00 0.00 178.31 178.27 2k9p h ILE 82 N 0.48 0.64 -0.22 -0.55 5.03 -1.55 -0.98 117.51 120.37 2k9p h ILE 82 Ca 0.27 -0.08 0.00 0.00 -0.12 0.00 0.00 64.86 64.94 2k9p h ILE 82 Cb 0.26 0.69 -0.01 0.00 -3.03 0.00 0.00 36.82 34.72 2k9p h ILE 82 CO -0.23 0.02 0.14 0.40 -0.68 0.00 0.00 178.15 177.80 2k9p h ILE 83 N -0.54 1.06 -0.56 -0.67 1.08 -0.92 -0.41 117.51 116.55 2k9p h ILE 83 Ca -0.05 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 64.35 2k9p h ILE 83 Cb 0.40 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 34.85 2k9p h ILE 83 CO 0.08 0.06 0.31 0.78 -0.69 0.00 0.00 178.15 178.69 2k9p h ASN 84 N 0.29 0.47 -0.05 1.72 -0.26 -0.82 -1.60 115.58 115.33 2k9p h ASN 84 Ca 0.08 0.02 0.03 0.00 -0.56 0.00 0.00 56.30 55.87 2k9p h ASN 84 Cb -0.03 -0.08 -0.04 0.00 -1.06 0.00 0.00 38.32 37.12 2k9p h ASN 84 CO -0.02 0.33 -0.14 1.56 -1.06 0.00 0.00 177.43 178.10 2k9p h GLN 85 N 0.60 -0.21 -0.20 0.81 4.20 -0.73 -2.26 115.11 117.33 2k9p h GLN 85 Ca 0.24 0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.02 2k9p h GLN 85 Cb 0.10 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.85 2k9p h GLN 85 CO -0.14 -0.14 -0.32 0.28 -0.67 0.00 0.00 178.83 177.85 2k9p h VAL 86 N -0.21 0.28 0.44 -0.54 2.07 -0.55 0.12 116.25 117.86 2k9p h VAL 86 Ca 0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 2k9p h VAL 86 Cb 0.30 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2k9p h VAL 86 CO -0.18 0.00 -0.44 -1.28 0.02 0.00 0.00 177.57 175.69 2k9p h SER 87 N -0.35 -1.21 -0.26 0.57 0.87 -1.20 -0.67 113.55 111.30 2k9p h SER 87 Ca 0.11 0.10 0.06 0.00 -1.23 0.00 0.00 61.79 60.83 2k9p h SER 87 Cb 0.54 0.40 -0.06 0.00 -0.44 0.00 0.00 62.40 62.84 2k9p h SER 87 CO -0.40 -0.58 -0.12 -0.07 -0.53 0.00 0.00 176.83 175.13 2k9p h LEU 88 N -0.88 -0.41 -0.85 2.23 3.38 -1.29 -2.77 115.31 114.72 2k9p h LEU 88 Ca -0.06 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.04 2k9p h LEU 88 Cb 0.76 0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 2k9p h LEU 88 CO -0.05 -0.15 0.55 0.15 0.09 0.00 0.00 178.44 179.02 2k9p h PHE 89 N -0.08 1.03 -0.80 1.13 3.57 -0.67 -1.78 116.94 119.35 2k9p h PHE 89 Ca 0.14 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.74 2k9p h PHE 89 Cb 0.29 -0.34 -0.07 0.00 2.79 0.00 0.00 35.95 38.62 2k9p h PHE 89 CO -0.30 0.60 0.46 -0.07 -2.23 0.00 0.00 178.31 176.77 2k9p h LEU 90 N 1.08 0.68 -0.28 0.59 4.07 -0.85 -0.92 115.31 119.67 2k9p h LEU 90 Ca 0.33 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.30 2k9p h LEU 90 Cb -0.02 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 2k9p h LEU 90 CO -0.11 0.41 0.06 0.40 -1.08 0.00 0.00 178.44 178.12 2k9p h ILE 91 N 0.80 1.22 -0.37 1.22 1.08 -1.08 0.12 117.51 120.50 2k9p h ILE 91 Ca 0.37 -0.75 0.02 0.00 -0.39 0.00 0.00 64.86 64.12 2k9p h ILE 91 Cb 0.29 1.17 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 2k9p h ILE 91 CO -0.22 0.24 0.20 0.40 -0.69 0.00 0.00 178.15 178.09 2k9p h ILE 92 N 0.29 1.01 0.08 -0.67 2.04 -1.05 0.12 117.51 119.34 2k9p h ILE 92 Ca 0.09 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2k9p h ILE 92 Cb 0.31 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2k9p h ILE 92 CO 0.00 0.08 -0.16 0.25 0.00 0.00 0.00 178.15 178.32 2k9p h LEU 93 N 0.41 -0.45 -0.14 1.44 5.85 -1.07 -0.48 115.31 120.87 2k9p h LEU 93 Ca 0.15 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2k9p h LEU 93 Cb 0.03 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2k9p h LEU 93 CO -0.09 -0.23 0.08 -0.74 -0.34 0.00 0.00 178.44 177.12 2k9p h HIS 94 N -0.31 0.15 -0.04 1.25 2.76 -0.29 0.15 115.15 118.82 2k9p h HIS 94 Ca 0.03 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2k9p h HIS 94 Cb 0.33 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.24 2k9p h HIS 94 CO -0.18 0.09 0.02 0.77 -1.30 0.00 0.00 177.93 177.34 2k9p h SER 95 N 0.17 0.05 -0.65 3.26 0.02 -0.78 -0.34 113.55 115.29 2k9p h SER 95 Ca 0.05 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2k9p h SER 95 Cb -0.01 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 2k9p h SER 95 CO -0.02 0.11 0.39 0.00 -1.14 0.00 0.00 176.83 176.17 2k9p h ALA 96 N 0.94 0.83 0.15 3.77 0.00 -0.93 -0.09 119.26 123.93 2k9p h ALA 96 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k9p h ALA 96 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2k9p h ALA 96 CO -0.00 0.31 -0.14 -0.07 0.00 0.00 0.00 179.25 179.34 2k9p h LEU 97 N 0.89 -0.38 -0.12 0.00 3.38 -0.57 0.27 115.31 118.78 2k9p h LEU 97 Ca 0.23 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 2k9p h LEU 97 Cb -0.02 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2k9p h LEU 97 CO -0.04 -0.22 0.06 0.22 0.09 0.00 0.00 178.44 178.54 2k9p h TYR 98 N -0.32 0.16 0.31 1.13 5.03 -0.82 0.01 116.97 122.48 2k9p h TYR 98 Ca 0.00 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 2k9p h TYR 98 Cb 0.30 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.52 2k9p h TYR 98 CO -0.13 0.21 -0.22 0.35 -1.32 0.00 0.00 178.16 177.05 2k9p h PHE 99 N 0.07 -0.57 -0.64 -3.82 3.57 -1.00 -1.26 116.94 113.29 2k9p h PHE 99 Ca 0.04 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2k9p h PHE 99 Cb 0.10 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 2k9p h PHE 99 CO -0.03 -0.33 0.35 1.57 -2.23 0.00 0.00 178.31 177.63 2k9p h LYS 100 N -0.52 0.88 -0.55 1.11 2.10 -0.91 -0.80 116.57 117.87 2k9p h LYS 100 Ca -0.03 -0.09 -0.04 0.00 -2.00 0.00 0.00 60.65 58.50 2k9p h LYS 100 Cb 0.45 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 31.57 2k9p h LYS 100 CO 0.01 0.64 0.20 -0.92 -2.00 0.00 0.00 179.45 177.39 2k9p h TYR 101 N 0.89 0.86 0.01 0.07 5.03 -0.76 0.78 116.97 123.85 2k9p h TYR 101 Ca 0.23 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.46 2k9p h TYR 101 Cb 0.02 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 38.05 2k9p h TYR 101 CO 0.01 0.71 -0.00 -0.07 -1.32 0.00 0.00 178.16 177.48 2k9p h LEU 102 N 0.76 -0.01 -1.22 2.82 3.38 -0.83 -3.19 115.31 117.02 2k9p h LEU 102 Ca 0.18 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2k9p h LEU 102 Cb 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2k9p h LEU 102 CO -0.01 0.23 0.15 0.17 0.09 0.00 0.00 178.44 179.07 2k9p h LEU 103 N -0.25 0.64 -1.52 1.67 8.10 -1.05 -2.91 115.31 119.99 2k9p h LEU 103 Ca -0.00 -0.09 0.20 0.00 0.11 0.00 0.00 57.88 58.11 2k9p h LEU 103 Cb 0.24 -0.16 -0.07 0.00 -0.44 0.00 0.00 40.66 40.23 2k9p h LEU 103 CO 0.00 0.61 0.59 -1.28 -4.11 0.00 0.00 178.44 174.25 2k9p h SER 104 N 0.68 0.40 0.19 0.17 0.87 -0.82 -0.51 113.55 114.53 2k9p h SER 104 Ca 0.16 0.04 -0.32 0.00 -1.23 0.00 0.00 61.79 60.44 2k9p h SER 104 Cb 0.20 -0.03 0.02 0.00 -0.44 0.00 0.00 62.40 62.14 2k9p h SER 104 CO -0.01 0.16 -1.53 -1.13 -0.53 0.00 0.00 176.83 173.79 2k9p h ASN 105 N 0.40 0.62 0.19 6.23 -1.24 -1.59 -3.39 115.58 116.80 2k9p h ASN 105 Ca 0.47 -0.92 -0.01 0.00 0.71 0.00 0.00 56.30 56.55 2k9p h ASN 105 Cb 1.17 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 40.01 2k9p h ASN 105 CO -0.17 1.70 -0.12 1.88 -1.29 0.00 0.00 177.43 179.43 2k9p h TYR 106 N -0.01 -0.31 -1.71 0.67 0.05 -1.09 -3.47 116.97 111.11 2k9p h TYR 106 Ca -0.30 -0.00 0.09 0.00 0.05 0.00 0.00 58.73 58.57 2k9p h TYR 106 Cb 2.01 0.11 -0.21 0.00 1.01 0.00 0.00 36.73 39.65 2k9p h TYR 106 CO 0.12 -0.19 0.54 0.45 -1.05 0.00 0.00 178.16 178.04 2k9p s SER 107 N -4.93 -0.36 0.03 3.88 0.15 -0.33 -5.11 113.70 107.03 2k9p s SER 107 Ca -0.15 0.31 -0.06 0.00 0.70 0.00 0.00 55.95 56.75 2k9p s SER 107 Cb 0.06 0.32 -0.05 0.00 -1.71 0.00 0.00 66.02 64.63 2k9p s SER 107 CO 0.65 -0.40 0.29 -0.94 1.20 0.00 0.00 173.24 174.04 2k9p s SER 108 N -1.43 6.50 -0.23 5.45 1.04 -1.26 -4.38 113.70 119.40 2k9p s SER 108 Ca -0.00 0.57 -0.04 0.00 0.48 0.00 0.00 55.95 56.96 2k9p s SER 108 Cb -0.01 -2.09 0.08 0.00 0.10 0.00 0.00 66.02 64.10 2k9p s SER 108 CO -0.01 0.22 0.12 0.68 0.98 0.00 0.00 173.24 175.24 2k9p s VAL 109 N -1.35 -0.10 -2.00 5.02 -7.23 -1.26 -5.17 120.40 108.31 2k9p s VAL 109 Ca 0.30 -0.46 0.29 0.00 -1.81 0.00 0.00 61.98 60.30 2k9p s VAL 109 Cb -0.13 -0.78 0.81 0.00 0.56 0.00 0.00 36.38 36.84 2k9p s VAL 109 CO 0.18 -0.50 2.05 0.41 -0.31 0.00 0.00 175.10 176.92