#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 0.18 0.00 1.61 -0.87 -1.26 -5.17 114.94 109.43 2k9p s ASN 32 Ca 0.00 -1.12 0.00 0.00 -1.57 0.00 0.00 52.86 50.17 2k9p s ASN 32 Cb 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 41.25 41.60 2k9p s ASN 32 CO 0.00 -0.82 0.00 0.61 -2.57 0.00 0.00 177.10 174.32 2k9p n GLY 33 N -0.18 1.11 3.32 0.66 0.00 -1.26 -5.16 105.19 103.68 2k9p n GLY 33 Ca -0.05 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 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 2.00 -0.29 -1.00 1.61 0.01 -1.26 -4.96 113.70 109.81 2k9p s SER 34 Ca 0.00 0.01 -0.09 0.00 1.31 0.00 0.00 55.95 57.17 2k9p s SER 34 Cb 0.00 0.42 0.09 0.00 0.21 0.00 0.00 66.02 66.74 2k9p s SER 34 CO 0.00 -0.66 0.32 1.07 0.41 0.00 0.00 173.24 174.38 2k9p n THR 35 N 0.52 -0.38 -1.63 1.44 5.66 -1.26 -4.93 114.28 113.70 2k9p n THR 35 Ca -0.19 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.49 2k9p n THR 35 Cb 0.60 -0.88 0.06 0.00 -1.55 0.00 0.00 70.33 68.56 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 -2.69 3.40 0.96 1.09 1.09 -1.26 -5.02 121.20 118.77 2k9p s ILE 36 Ca 0.36 0.58 -0.12 0.00 -1.10 0.00 0.00 60.65 60.36 2k9p s ILE 36 Cb -0.20 -3.10 0.08 0.00 -1.06 0.00 0.00 42.46 38.18 2k9p s ILE 36 CO 0.44 -0.48 0.65 0.35 -0.10 0.00 0.00 174.94 175.80 2k9p n THR 37 N -2.75 0.00 0.23 2.92 -2.24 -1.26 -4.89 114.28 106.29 2k9p n THR 37 Ca 0.10 -0.14 0.15 0.00 -2.27 0.00 0.00 64.05 61.89 2k9p n THR 37 Cb 0.52 -0.76 0.80 0.00 -2.10 0.00 0.00 70.33 68.80 2k9p n THR 37 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2k9p h PHE 38 N -1.74 0.00 -1.06 4.78 -1.00 -2.02 -2.90 116.94 113.01 2k9p h PHE 38 Ca -0.44 0.00 0.30 0.00 2.81 0.00 0.00 57.97 60.64 2k9p h PHE 38 Cb 1.28 0.00 -0.12 0.00 3.61 0.00 0.00 35.95 40.72 2k9p h PHE 38 CO 0.41 0.00 0.65 -0.44 -1.61 0.00 0.00 178.31 177.32 2k9p h ASP 39 N 0.00 0.50 0.65 2.17 3.32 -1.99 -0.93 116.42 120.13 2k9p h ASP 39 Ca 0.00 0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2k9p h ASP 39 Cb 0.02 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2k9p h ASP 39 CO 0.00 -0.01 -0.39 -0.33 -1.72 0.00 0.00 179.24 176.80 2k9p h GLU 40 N 0.38 -0.94 -0.88 3.56 4.39 -1.87 -1.50 114.58 117.72 2k9p h GLU 40 Ca 0.68 0.06 0.06 0.00 0.34 0.00 0.00 59.36 60.50 2k9p h GLU 40 Cb 1.63 0.21 -0.06 0.00 -0.10 0.00 0.00 28.75 30.43 2k9p h GLU 40 CO -0.44 -0.63 0.57 -0.07 -1.16 0.00 0.00 179.01 177.29 2k9p h LEU 41 N -0.97 0.88 0.36 1.33 -0.00 -1.50 0.48 115.31 115.89 2k9p h LEU 41 Ca -0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 2k9p h LEU 41 Cb 0.78 -0.19 -0.01 0.00 -0.00 0.00 0.00 40.66 41.25 2k9p h LEU 41 CO 0.09 0.57 -0.27 1.56 -0.00 0.00 0.00 178.44 180.39 2k9p h GLN 42 N 1.01 -0.58 -0.51 1.13 4.20 -1.02 -1.92 115.11 117.41 2k9p h GLN 42 Ca 0.38 0.04 0.02 0.00 0.06 0.00 0.00 58.65 59.14 2k9p h GLN 42 Cb 0.18 0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 2k9p h GLN 42 CO -0.14 -0.39 0.34 0.78 -0.67 0.00 0.00 178.83 178.76 2k9p h GLY 43 N -0.60 0.69 0.11 3.46 0.00 -1.07 -0.89 103.07 104.77 2k9p h GLY 43 Ca -0.05 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 2k9p h GLY 43 CO 0.01 0.23 -0.13 1.41 0.00 0.00 0.00 176.54 178.06 2k9p h LEU 44 N 0.64 -0.37 -1.13 3.11 3.38 -0.82 -2.68 115.31 117.43 2k9p h LEU 44 Ca 0.20 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 2k9p h LEU 44 Cb 0.01 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2k9p h LEU 44 CO -0.05 -0.17 -0.26 1.62 0.09 0.00 0.00 178.44 179.67 2k9p h VAL 45 N -0.25 0.67 0.39 1.22 3.04 -1.28 0.15 116.25 120.19 2k9p h VAL 45 Ca -0.01 -1.20 -0.00 0.00 -1.01 0.00 0.00 66.70 64.48 2k9p h VAL 45 Cb 0.22 1.78 -0.02 0.00 -2.01 0.00 0.00 31.29 31.26 2k9p h VAL 45 CO -0.03 0.26 -0.38 -1.13 -1.01 0.00 0.00 177.57 175.28 2k9p h ASN 46 N 0.00 -1.04 -0.01 3.17 -0.73 -1.12 -3.43 115.58 112.43 2k9p h ASN 46 Ca -0.00 0.09 -0.15 0.00 1.87 0.00 0.00 56.30 58.10 2k9p h ASN 46 Cb 0.76 0.35 -0.15 0.00 0.27 0.00 0.00 38.32 39.55 2k9p h ASN 46 CO 0.03 -0.53 -0.30 -0.24 -0.37 0.00 0.00 177.43 176.02 2k9p n SER 47 N -5.48 -1.17 0.09 1.15 2.88 -1.02 -4.95 113.62 105.12 2k9p n SER 47 Ca -0.10 -2.11 0.00 0.00 -1.33 0.00 0.00 58.87 55.33 2k9p n SER 47 Cb 0.38 0.47 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 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 -0.75 0.73 -0.28 2.46 -1.04 -0.41 -4.71 114.28 110.28 2k9p n THR 48 Ca -0.22 0.24 -0.05 0.00 -2.04 0.00 0.00 64.05 61.98 2k9p n THR 48 Cb 0.79 -1.16 0.08 0.00 -1.82 0.00 0.00 70.33 68.23 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 1.26 -0.41 12.58 3.04 -1.06 -2.79 116.25 128.87 2k9p h VAL 49 Ca 0.00 -0.80 -0.04 0.00 -1.01 0.00 0.00 66.70 64.85 2k9p h VAL 49 Cb 0.01 0.30 -0.02 0.00 -2.01 0.00 0.00 31.29 29.57 2k9p h VAL 49 CO 0.00 0.33 0.07 0.00 -1.01 0.00 0.00 177.57 176.95 2k9p h THR 50 N 1.15 1.20 -0.12 3.17 1.03 -1.82 -2.44 112.91 115.08 2k9p h THR 50 Ca 0.27 -0.74 -0.06 0.00 -0.01 0.00 0.00 66.41 65.87 2k9p h THR 50 Cb 0.20 0.82 -0.01 0.00 -1.07 0.00 0.00 68.15 68.08 2k9p h THR 50 CO -0.02 0.27 -0.18 -0.61 -0.01 0.00 0.00 175.52 174.96 2k9p h GLN 51 N 0.60 0.20 -0.55 0.00 4.15 -1.78 -3.09 115.11 114.64 2k9p h GLN 51 Ca 0.13 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.48 2k9p h GLN 51 Cb 0.28 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 2k9p h GLN 51 CO 0.00 0.38 0.26 0.00 -1.93 0.00 0.00 178.83 177.54 2k9p h ALA 52 N 1.64 0.71 0.00 3.38 0.00 -1.42 0.61 119.26 124.18 2k9p h ALA 52 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2k9p h ALA 52 Cb 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2k9p h ALA 52 CO 0.03 0.28 -0.00 0.82 0.00 0.00 0.00 179.25 180.37 2k9p h ILE 53 N 0.74 1.02 0.29 0.00 5.03 -1.62 -0.15 117.51 122.82 2k9p h ILE 53 Ca 0.19 -0.07 -0.01 0.00 -0.12 0.00 0.00 64.86 64.85 2k9p h ILE 53 Cb 0.13 1.07 -0.00 0.00 -3.03 0.00 0.00 36.82 34.98 2k9p h ILE 53 CO -0.02 0.02 -0.17 -0.07 -0.68 0.00 0.00 178.15 177.22 2k9p h LEU 54 N -0.03 -0.43 0.03 1.44 3.38 -1.49 0.30 115.31 118.51 2k9p h LEU 54 Ca -0.00 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2k9p h LEU 54 Cb 0.03 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2k9p h LEU 54 CO 0.00 -0.28 -0.16 0.15 0.09 0.00 0.00 178.44 178.23 2k9p h PHE 55 N -0.44 -0.43 -0.52 1.13 3.04 -0.87 -1.80 116.94 117.05 2k9p h PHE 55 Ca -0.03 0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.96 2k9p h PHE 55 Cb 0.37 0.19 -0.04 0.00 2.56 0.00 0.00 35.95 39.03 2k9p h PHE 55 CO -0.09 -0.24 0.30 0.78 -2.02 0.00 0.00 178.31 177.04 2k9p h GLY 56 N -0.29 0.73 0.45 2.40 0.00 -0.91 0.70 103.07 106.16 2k9p h GLY 56 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 2k9p h GLY 56 CO -0.14 0.17 -0.50 -2.08 0.00 0.00 0.00 176.54 174.00 2k9p h VAL 57 N 0.59 0.00 -0.77 4.60 2.07 -0.73 0.57 116.25 122.57 2k9p h VAL 57 Ca 0.21 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.68 2k9p h VAL 57 Cb 0.05 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.79 2k9p h VAL 57 CO -0.11 0.00 0.28 0.03 0.02 0.00 0.00 177.57 177.79 2k9p h ARG 58 N -0.96 1.17 0.14 1.57 3.08 -1.22 -1.86 114.38 116.30 2k9p h ARG 58 Ca -0.06 -0.23 0.02 0.00 0.07 0.00 0.00 59.98 59.78 2k9p h ARG 58 Cb 0.84 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 2k9p h ARG 58 CO -0.08 0.97 -0.28 1.03 -1.07 0.00 0.00 179.97 180.53 2k9p h SER 59 N 1.13 -0.81 -0.33 7.04 0.87 -0.76 0.38 113.55 121.07 2k9p h SER 59 Ca 0.25 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2k9p h SER 59 Cb 0.25 0.30 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 2k9p h SER 59 CO -0.02 -0.38 0.21 1.23 -0.53 0.00 0.00 176.83 177.35 2k9p h GLY 60 N -0.51 0.48 0.83 5.77 0.00 -0.63 0.18 103.07 109.18 2k9p h GLY 60 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2k9p h GLY 60 CO -0.15 0.18 -0.07 0.00 0.00 0.00 0.00 176.54 176.50 2k9p h ALA 61 N 1.11 -0.18 -0.96 3.60 0.00 -1.29 -0.79 119.26 120.74 2k9p h ALA 61 Ca 0.12 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2k9p h ALA 61 Cb -0.03 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2k9p h ALA 61 CO -0.03 -0.51 0.64 0.00 0.00 0.00 0.00 179.25 179.35 2k9p h ALA 62 N 0.48 1.22 0.36 0.00 0.00 -0.84 -2.00 119.26 118.47 2k9p h ALA 62 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2k9p h ALA 62 Cb 0.29 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2k9p h ALA 62 CO 0.03 0.62 -0.30 0.00 0.00 0.00 0.00 179.25 179.59 2k9p h ALA 63 N 1.35 -0.68 -0.27 0.00 0.00 -0.59 -1.54 119.26 117.54 2k9p h ALA 63 Ca 0.35 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.21 2k9p h ALA 63 Cb -0.15 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2k9p h ALA 63 CO -0.08 -0.91 -0.24 1.25 0.00 0.00 0.00 179.25 179.28 2k9p h LEU 64 N -0.67 -0.77 -0.81 0.00 6.46 -0.81 -0.63 115.31 118.08 2k9p h LEU 64 Ca -0.03 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.88 2k9p h LEU 64 Cb 0.59 0.37 -0.04 0.00 -0.73 0.00 0.00 40.66 40.85 2k9p h LEU 64 CO -0.03 -0.27 0.52 0.00 -0.62 0.00 0.00 178.44 178.04 2k9p h THR 65 N -0.23 1.21 -0.92 1.05 1.03 -1.36 -2.10 112.91 111.60 2k9p h THR 65 Ca 0.15 -0.41 -0.00 0.00 -0.01 0.00 0.00 66.41 66.13 2k9p h THR 65 Cb 0.46 0.05 -0.04 0.00 -1.07 0.00 0.00 68.15 67.54 2k9p h THR 65 CO -0.40 0.21 0.56 0.17 -0.01 0.00 0.00 175.52 176.05 2k9p h LEU 66 N 1.10 1.09 0.57 0.00 8.10 -0.45 -0.89 115.31 124.84 2k9p h LEU 66 Ca 0.29 -0.06 -0.03 0.00 0.11 0.00 0.00 57.88 58.20 2k9p h LEU 66 Cb -0.10 -0.28 0.01 0.00 -0.44 0.00 0.00 40.66 39.85 2k9p h LEU 66 CO -0.06 0.83 -0.27 0.40 -4.11 0.00 0.00 178.44 175.23 2k9p h ILE 67 N 1.26 0.36 -0.51 0.15 2.04 -0.73 0.46 117.51 120.55 2k9p h ILE 67 Ca 0.33 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2k9p h ILE 67 Cb -0.07 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 2k9p h ILE 67 CO -0.06 0.03 0.24 -0.37 0.00 0.00 0.00 178.15 177.99 2k9p h VAL 68 N -0.95 1.18 0.59 1.67 -1.51 -1.32 -1.38 116.25 114.52 2k9p h VAL 68 Ca -0.08 -0.50 -0.03 0.00 -1.23 0.00 0.00 66.70 64.86 2k9p h VAL 68 Cb 0.65 0.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.35 2k9p h VAL 68 CO 0.13 0.21 -0.29 0.58 -1.23 0.00 0.00 177.57 176.97 2k9p h VAL 69 N 0.71 0.41 -0.68 7.19 2.07 -1.06 -0.88 116.25 124.02 2k9p h VAL 69 Ca 0.18 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.72 2k9p h VAL 69 Cb 0.09 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 2k9p h VAL 69 CO -0.02 0.00 0.45 -0.25 0.02 0.00 0.00 177.57 177.77 2k9p h TRP 70 N -0.80 0.83 0.33 1.57 7.01 -0.55 0.23 115.95 124.57 2k9p h TRP 70 Ca -0.08 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.92 2k9p h TRP 70 Cb 0.61 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.40 2k9p h TRP 70 CO -0.04 0.51 -0.16 0.82 -2.79 0.00 0.00 178.44 176.78 2k9p h ILE 71 N 0.88 0.69 0.03 2.65 5.03 -1.14 -1.28 117.51 124.38 2k9p h ILE 71 Ca 0.26 -0.36 -0.09 0.00 -0.12 0.00 0.00 64.86 64.54 2k9p h ILE 71 Cb -0.03 0.88 0.01 0.00 -3.03 0.00 0.00 36.82 34.65 2k9p h ILE 71 CO -0.06 0.07 -0.39 0.00 -0.68 0.00 0.00 178.15 177.09 2k9p h THR 72 N -0.64 1.57 0.00 -0.27 1.03 -0.93 -3.27 112.91 110.40 2k9p h THR 72 Ca -0.05 -2.19 0.00 0.00 -0.01 0.00 0.00 66.41 64.17 2k9p h THR 72 Cb 0.46 2.97 0.00 0.00 -1.07 0.00 0.00 68.15 70.51 2k9p h THR 72 CO 0.07 0.60 0.00 -0.24 -0.01 0.00 0.00 175.52 175.95 2k9p n SER 73 N -4.39 0.21 -3.96 0.00 2.88 0.78 -4.92 113.62 104.23 2k9p n SER 73 Ca -0.11 0.54 -0.29 0.00 -1.33 0.00 0.00 58.87 57.68 2k9p n SER 73 Cb 0.60 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2k9p n SER 73 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k9p n ARG 74 N -1.72 -4.24 -0.57 -1.46 1.74 -0.51 -4.95 116.66 104.94 2k9p n ARG 74 Ca 0.05 0.50 -0.30 0.00 -0.77 0.00 0.00 57.85 57.32 2k9p n ARG 74 Cb 0.27 -5.07 0.22 0.00 -1.02 0.00 0.00 32.46 26.85 2k9p n ARG 74 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2k9p n SER 75 N -2.88 -1.84 -4.59 0.55 2.88 -1.06 -4.96 113.62 101.73 2k9p n SER 75 Ca -0.11 -0.08 -0.34 0.00 -1.33 0.00 0.00 58.87 57.01 2k9p n SER 75 Cb 0.59 -1.17 0.12 0.00 -0.75 0.00 0.00 64.21 63.00 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 -3.74 0.02 -1.40 -1.46 5.12 -1.26 -4.95 116.66 108.99 2k9p n ARG 76 Ca 0.03 0.07 -0.37 0.00 -1.93 0.00 0.00 57.85 55.66 2k9p n ARG 76 Cb 0.57 -2.19 0.07 0.00 -1.16 0.00 0.00 32.46 29.74 2k9p n ARG 76 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2k9p n LYS 77 N -2.58 0.52 -4.36 5.56 5.02 -1.26 -5.04 118.16 116.04 2k9p n LYS 77 Ca 0.11 0.22 -0.25 0.00 -2.02 0.00 0.00 58.31 56.37 2k9p n LYS 77 Cb 0.51 -2.02 -0.09 0.00 -0.02 0.00 0.00 35.03 33.40 2k9p n LYS 77 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k9p s THR 78 N -1.77 2.93 0.63 -0.18 -4.23 -1.26 -5.13 115.64 106.64 2k9p s THR 78 Ca 0.71 -1.94 -0.16 0.00 -1.18 0.00 0.00 61.69 59.11 2k9p s THR 78 Cb -0.37 -2.49 -0.01 0.00 1.34 0.00 0.00 72.50 70.96 2k9p s THR 78 CO 0.52 -0.23 1.12 -2.16 -0.54 0.00 0.00 174.62 173.33 2k9p s PRO 79 N -3.12 2.92 0.32 3.99 0.04 -1.26 -4.85 135.00 133.04 2k9p s PRO 79 Ca 0.27 1.46 0.08 0.00 0.04 0.00 0.00 61.00 62.85 2k9p s PRO 79 Cb -0.07 -1.96 0.82 0.00 0.04 0.00 0.00 34.50 33.33 2k9p s PRO 79 CO 0.15 -1.17 1.78 -0.84 0.04 0.00 0.00 177.00 176.97 2k9p h ILE 80 N 0.32 0.68 -0.45 0.56 3.07 -2.00 -0.90 117.51 118.79 2k9p h ILE 80 Ca -0.48 -0.23 -0.07 0.00 1.55 0.00 0.00 64.86 65.63 2k9p h ILE 80 Cb 1.25 -0.07 -0.02 0.00 -0.27 0.00 0.00 36.82 37.71 2k9p h ILE 80 CO 0.55 0.12 0.00 0.15 -1.05 0.00 0.00 178.15 177.92 2k9p h PHE 81 N 0.68 0.78 0.35 0.16 3.57 -1.98 0.15 116.94 120.65 2k9p h PHE 81 Ca 0.57 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.96 2k9p h PHE 81 Cb 1.00 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2k9p h PHE 81 CO -0.00 0.73 -0.17 0.82 -2.23 0.00 0.00 178.31 177.46 2k9p h ILE 82 N 0.69 0.64 -0.70 1.41 5.03 -1.56 -0.50 117.51 122.52 2k9p h ILE 82 Ca 0.14 -0.50 0.01 0.00 -0.12 0.00 0.00 64.86 64.39 2k9p h ILE 82 Cb 0.42 0.88 -0.04 0.00 -3.03 0.00 0.00 36.82 35.06 2k9p h ILE 82 CO 0.02 0.09 0.46 0.40 -0.68 0.00 0.00 178.15 178.44 2k9p h ILE 83 N -0.77 1.16 -0.43 -0.67 1.08 -1.17 -0.33 117.51 116.38 2k9p h ILE 83 Ca -0.05 -0.32 -0.03 0.00 -0.39 0.00 0.00 64.86 64.08 2k9p h ILE 83 Cb 0.51 0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 2k9p h ILE 83 CO 0.08 0.17 0.16 -1.13 -0.69 0.00 0.00 178.15 176.74 2k9p h ASN 84 N 0.93 0.61 0.77 1.72 -0.73 -0.77 0.00 115.58 118.12 2k9p h ASN 84 Ca 0.26 -0.18 -0.04 0.00 1.87 0.00 0.00 56.30 58.21 2k9p h ASN 84 Cb -0.08 -0.16 0.01 0.00 0.27 0.00 0.00 38.32 38.36 2k9p h ASN 84 CO -0.07 0.62 -0.37 1.56 -0.37 0.00 0.00 177.43 178.80 2k9p h GLN 85 N 0.56 -1.00 -0.44 6.67 4.20 -0.59 -2.49 115.11 122.02 2k9p h GLN 85 Ca 0.14 0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.93 2k9p h GLN 85 Cb 0.21 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 2k9p h GLN 85 CO -0.01 -0.67 0.27 -0.39 -0.67 0.00 0.00 178.83 177.37 2k9p h VAL 86 N -1.04 1.08 0.47 -0.54 -1.51 -1.10 -2.07 116.25 111.54 2k9p h VAL 86 Ca -0.11 -0.19 -0.01 0.00 -1.23 0.00 0.00 66.70 65.16 2k9p h VAL 86 Cb 0.80 0.47 -0.02 0.00 -2.13 0.00 0.00 31.29 30.41 2k9p h VAL 86 CO 0.17 0.10 -0.43 0.77 -1.23 0.00 0.00 177.57 176.96 2k9p h SER 87 N 0.56 -1.15 -0.39 4.19 4.64 -0.99 0.38 113.55 120.77 2k9p h SER 87 Ca 0.17 0.09 0.08 0.00 -0.47 0.00 0.00 61.79 61.66 2k9p h SER 87 Cb -0.03 0.38 -0.09 0.00 -0.31 0.00 0.00 62.40 62.35 2k9p h SER 87 CO -0.06 -0.59 -0.30 -0.07 -0.87 0.00 0.00 176.83 174.94 2k9p h LEU 88 N -0.90 -1.00 -0.55 5.97 3.38 -1.43 -2.33 115.31 118.45 2k9p h LEU 88 Ca -0.05 0.18 0.07 0.00 0.09 0.00 0.00 57.88 58.18 2k9p h LEU 88 Cb 0.78 0.48 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 2k9p h LEU 88 CO -0.04 -0.31 0.22 -0.26 0.09 0.00 0.00 178.44 178.14 2k9p h PHE 89 N -0.23 0.39 -0.66 1.13 -1.00 -1.01 -1.65 116.94 113.90 2k9p h PHE 89 Ca 0.18 0.03 0.09 0.00 2.81 0.00 0.00 57.97 61.08 2k9p h PHE 89 Cb 0.52 -0.09 -0.07 0.00 3.61 0.00 0.00 35.95 39.92 2k9p h PHE 89 CO -0.52 0.13 0.30 -0.07 -1.61 0.00 0.00 178.31 176.54 2k9p h LEU 90 N 0.42 0.35 -0.01 1.54 3.38 -0.42 -1.25 115.31 119.32 2k9p h LEU 90 Ca 0.26 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 2k9p h LEU 90 Cb 0.28 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2k9p h LEU 90 CO -0.25 0.20 0.00 0.40 0.09 0.00 0.00 178.44 178.89 2k9p h ILE 91 N 0.51 1.14 -0.63 1.22 2.04 -0.94 -1.34 117.51 119.51 2k9p h ILE 91 Ca 0.33 -0.40 0.10 0.00 1.00 0.00 0.00 64.86 65.89 2k9p h ILE 91 Cb 0.38 1.39 -0.08 0.00 -0.74 0.00 0.00 36.82 37.77 2k9p h ILE 91 CO -0.29 0.11 0.22 0.40 0.00 0.00 0.00 178.15 178.59 2k9p h ILE 92 N -0.15 0.74 0.37 -0.67 1.08 -0.84 0.14 117.51 118.18 2k9p h ILE 92 Ca 0.00 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 2k9p h ILE 92 Cb 0.17 0.31 -0.02 0.00 -3.07 0.00 0.00 36.82 34.21 2k9p h ILE 92 CO -0.00 0.07 -0.37 0.25 -0.69 0.00 0.00 178.15 177.42 2k9p h LEU 93 N 0.40 -1.00 -0.21 1.44 5.85 -1.18 -0.91 115.31 119.69 2k9p h LEU 93 Ca 0.32 0.08 0.05 0.00 0.84 0.00 0.00 57.88 59.17 2k9p h LEU 93 Cb 0.42 0.33 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 2k9p h LEU 93 CO -0.33 -0.48 -0.10 -0.74 -0.34 0.00 0.00 178.44 176.44 2k9p h HIS 94 N -0.73 -0.24 -0.15 1.25 2.76 -0.55 0.69 115.15 118.18 2k9p h HIS 94 Ca -0.05 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.18 2k9p h HIS 94 Cb 0.63 0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.70 2k9p h HIS 94 CO -0.20 -0.16 -0.09 0.77 -1.30 0.00 0.00 177.93 176.95 2k9p h SER 95 N -0.08 -0.29 0.02 3.26 0.02 -0.79 -0.46 113.55 115.24 2k9p h SER 95 Ca 0.11 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2k9p h SER 95 Cb 0.25 0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 2k9p h SER 95 CO -0.26 -0.12 -0.07 0.00 -1.14 0.00 0.00 176.83 175.23 2k9p h ALA 96 N 1.04 -0.09 -0.80 3.77 0.00 -0.72 -1.80 119.26 120.65 2k9p h ALA 96 Ca 0.09 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.14 2k9p h ALA 96 Cb 0.21 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 2k9p h ALA 96 CO -0.20 -0.57 0.38 1.37 0.00 0.00 0.00 179.25 180.23 2k9p h LEU 97 N -0.14 0.44 0.52 0.00 8.10 -0.66 -1.36 115.31 122.21 2k9p h LEU 97 Ca 0.02 0.09 -0.03 0.00 0.11 0.00 0.00 57.88 58.08 2k9p h LEU 97 Cb 0.16 0.03 0.01 0.00 -0.44 0.00 0.00 40.66 40.42 2k9p h LEU 97 CO -0.06 0.19 -0.25 0.22 -4.11 0.00 0.00 178.44 174.43 2k9p h TYR 98 N 0.56 -0.64 -0.83 0.17 3.20 -0.68 0.34 116.97 119.09 2k9p h TYR 98 Ca 0.43 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.37 2k9p h TYR 98 Cb 0.61 0.21 -0.07 0.00 1.54 0.00 0.00 36.73 39.03 2k9p h TYR 98 CO -0.12 -0.36 0.49 0.74 -1.64 0.00 0.00 178.16 177.27 2k9p h PHE 99 N -0.78 0.89 -0.09 -3.82 0.04 -1.03 -0.95 116.94 111.19 2k9p h PHE 99 Ca -0.07 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 2k9p h PHE 99 Cb 0.57 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 38.44 2k9p h PHE 99 CO -0.02 0.39 0.04 0.87 -0.60 0.00 0.00 178.31 178.99 2k9p h LYS 100 N 0.84 0.14 -0.86 1.51 1.57 -1.11 0.42 116.57 119.08 2k9p h LYS 100 Ca 0.39 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.17 2k9p h LYS 100 Cb 0.30 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 2k9p h LYS 100 CO -0.22 0.25 0.57 -0.92 -0.57 0.00 0.00 179.45 178.56 2k9p h TYR 101 N -0.00 1.05 0.27 -1.35 3.20 -0.43 0.68 116.97 120.39 2k9p h TYR 101 Ca 0.03 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2k9p h TYR 101 Cb 0.16 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.09 2k9p h TYR 101 CO -0.02 0.62 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.92 2k9p h LEU 102 N 1.09 -0.31 -1.55 2.82 3.38 -1.08 -3.19 115.31 116.47 2k9p h LEU 102 Ca 0.34 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2k9p h LEU 102 Cb -0.00 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2k9p h LEU 102 CO -0.10 0.12 0.35 0.17 0.09 0.00 0.00 178.44 179.07 2k9p h LEU 103 N -0.82 0.50 -0.24 1.67 8.10 -0.73 -2.29 115.31 121.50 2k9p h LEU 103 Ca -0.04 -0.00 0.06 0.00 0.11 0.00 0.00 57.88 58.01 2k9p h LEU 103 Cb 0.51 -0.11 -0.06 0.00 -0.44 0.00 0.00 40.66 40.56 2k9p h LEU 103 CO 0.06 0.34 -0.14 -1.28 -4.11 0.00 0.00 178.44 173.31 2k9p h SER 104 N 0.58 -0.48 0.59 0.17 0.87 -0.93 -2.48 113.55 111.88 2k9p h SER 104 Ca 0.22 0.11 -0.09 0.00 -1.23 0.00 0.00 61.79 60.79 2k9p h SER 104 Cb 0.15 0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2k9p h SER 104 CO -0.06 -0.18 -0.45 0.78 -0.53 0.00 0.00 176.83 176.39 2k9p h ASN 105 N -0.13 0.00 0.15 6.23 2.35 -1.41 -2.91 115.58 119.87 2k9p h ASN 105 Ca 0.13 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 2k9p h ASN 105 Cb 0.33 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 2k9p h ASN 105 CO -0.32 0.45 -0.08 1.88 -1.65 0.00 0.00 177.43 177.71 2k9p h TYR 106 N 0.00 0.00 -3.74 1.19 0.05 -1.07 -3.45 116.97 109.95 2k9p h TYR 106 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2k9p h TYR 106 Cb 0.86 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.60 2k9p h TYR 106 CO 0.00 0.08 0.00 0.45 -1.05 0.00 0.00 178.16 177.64 2k9p n SER 107 N -3.99 1.89 -4.56 3.88 2.88 -1.10 -5.11 113.62 107.51 2k9p n SER 107 Ca -0.02 -0.74 -0.38 0.00 -1.33 0.00 0.00 58.87 56.40 2k9p n SER 107 Cb 0.17 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.52 2k9p n SER 107 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2k9p s SER 108 N -0.50 5.88 -0.29 -3.46 0.15 -1.26 -4.96 113.70 109.26 2k9p s SER 108 Ca 0.00 -0.06 -0.15 0.00 0.70 0.00 0.00 55.95 56.43 2k9p s SER 108 Cb 0.00 -2.09 0.11 0.00 -1.71 0.00 0.00 66.02 62.33 2k9p s SER 108 CO 0.00 -0.06 0.79 0.54 1.20 0.00 0.00 173.24 175.72 2k9p s VAL 109 N 1.73 -0.11 -2.66 4.45 0.11 -1.26 -5.12 120.40 117.54 2k9p s VAL 109 Ca 0.07 0.00 0.27 0.00 -2.93 0.00 0.00 61.98 59.39 2k9p s VAL 109 Cb -0.16 -1.00 0.43 0.00 -1.53 0.00 0.00 36.38 34.12 2k9p s VAL 109 CO 0.10 0.00 1.59 0.41 -3.33 0.00 0.00 175.10 173.87