#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 -0.39 0.00 1.61 2.47 -1.26 -5.15 114.94 112.22 2k9p s ASN 32 Ca 0.00 0.38 0.00 0.00 0.42 0.00 0.00 52.86 53.66 2k9p s ASN 32 Cb 0.00 0.44 0.00 0.00 -1.45 0.00 0.00 41.25 40.24 2k9p s ASN 32 CO 0.00 -0.49 0.00 0.61 -3.72 0.00 0.00 177.10 173.50 2k9p n GLY 33 N 1.24 -1.27 3.31 1.21 0.00 -1.26 -4.94 105.19 103.48 2k9p n GLY 33 Ca -0.20 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 43.96 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 -3.78 2.75 -0.93 1.61 0.01 -1.26 -4.77 113.70 107.33 2k9p s SER 34 Ca 0.00 -0.67 -0.05 0.00 1.31 0.00 0.00 55.95 56.54 2k9p s SER 34 Cb 0.00 -0.18 0.05 0.00 0.21 0.00 0.00 66.02 66.10 2k9p s SER 34 CO 0.00 0.12 0.23 1.07 0.41 0.00 0.00 173.24 175.06 2k9p n THR 35 N 1.21 -0.54 -2.62 1.44 5.66 -1.26 -4.94 114.28 113.23 2k9p n THR 35 Ca -0.19 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.46 2k9p n THR 35 Cb 0.53 -1.23 -0.05 0.00 -1.55 0.00 0.00 70.33 68.04 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 -2.62 3.91 0.96 1.09 -1.09 -1.26 -5.03 121.20 117.15 2k9p s ILE 36 Ca 0.21 1.41 -0.12 0.00 -2.23 0.00 0.00 60.65 59.92 2k9p s ILE 36 Cb -0.12 -3.70 0.11 0.00 -1.58 0.00 0.00 42.46 37.18 2k9p s ILE 36 CO 0.26 -0.05 0.79 0.35 -1.23 0.00 0.00 174.94 175.06 2k9p n THR 37 N -0.15 0.00 0.31 2.92 -2.24 -1.26 -4.92 114.28 108.93 2k9p n THR 37 Ca 0.05 -0.12 0.17 0.00 -2.27 0.00 0.00 64.05 61.88 2k9p n THR 37 Cb 0.51 -0.83 0.77 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.83 0.00 0.41 4.78 -1.00 -2.00 -3.22 116.94 114.09 2k9p h PHE 38 Ca -0.45 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.32 2k9p h PHE 38 Cb 1.28 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.82 2k9p h PHE 38 CO 0.42 0.00 -0.39 -0.44 -1.61 0.00 0.00 178.31 176.29 2k9p h ASP 39 N 0.00 -1.05 -0.46 2.17 3.32 -1.99 0.18 116.42 118.59 2k9p h ASP 39 Ca 0.00 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2k9p h ASP 39 Cb 0.32 0.35 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 2k9p h ASP 39 CO 0.00 -0.54 0.28 -0.33 -1.72 0.00 0.00 179.24 176.92 2k9p h GLU 40 N -0.81 0.65 0.82 3.56 4.39 -1.94 -0.37 114.58 120.88 2k9p h GLU 40 Ca -0.04 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 2k9p h GLU 40 Cb 0.72 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 29.24 2k9p h GLU 40 CO -0.05 0.47 -0.39 -0.07 -1.16 0.00 0.00 179.01 177.80 2k9p h LEU 41 N 0.66 -0.93 -0.97 1.33 4.07 -1.57 -0.65 115.31 117.25 2k9p h LEU 41 Ca 0.17 0.02 0.13 0.00 0.08 0.00 0.00 57.88 58.29 2k9p h LEU 41 Cb -0.00 0.24 -0.09 0.00 1.08 0.00 0.00 40.66 41.89 2k9p h LEU 41 CO -0.03 -0.61 0.59 1.56 -1.08 0.00 0.00 178.44 178.87 2k9p h GLN 42 N -1.21 0.87 -0.13 1.13 1.08 -0.30 -1.81 115.11 114.74 2k9p h GLN 42 Ca -0.11 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.03 2k9p h GLN 42 Cb 0.85 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 28.08 2k9p h GLN 42 CO 0.18 0.58 0.05 0.78 -0.95 0.00 0.00 178.83 179.47 2k9p h GLY 43 N 0.90 0.20 0.74 3.46 0.00 -1.05 0.06 103.07 107.39 2k9p h GLY 43 Ca 0.50 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.78 2k9p h GLY 43 CO -0.29 0.10 0.65 0.17 0.00 0.00 0.00 176.54 177.17 2k9p h LEU 44 N 0.06 1.05 0.00 3.11 8.10 -0.31 -2.29 115.31 125.03 2k9p h LEU 44 Ca 0.04 0.01 -0.14 0.00 0.11 0.00 0.00 57.88 57.90 2k9p h LEU 44 Cb 0.16 -0.22 -0.02 0.00 -0.44 0.00 0.00 40.66 40.14 2k9p h LEU 44 CO -0.00 0.67 -0.78 1.62 -4.11 0.00 0.00 178.44 175.84 2k9p h VAL 45 N 1.19 0.98 0.00 0.15 3.04 -1.34 0.12 116.25 120.38 2k9p h VAL 45 Ca 0.43 -2.44 0.02 0.00 -1.01 0.00 0.00 66.70 63.70 2k9p h VAL 45 Cb 0.16 2.45 -0.03 0.00 -2.01 0.00 0.00 31.29 31.86 2k9p h VAL 45 CO -0.17 0.56 -0.12 -1.13 -1.01 0.00 0.00 177.57 175.70 2k9p h ASN 46 N 0.00 -0.35 0.00 3.17 -1.24 -0.39 -3.42 115.58 113.35 2k9p h ASN 46 Ca -0.04 0.05 -0.16 0.00 0.71 0.00 0.00 56.30 56.86 2k9p h ASN 46 Cb 1.51 0.15 -0.12 0.00 0.73 0.00 0.00 38.32 40.59 2k9p h ASN 46 CO 0.08 -0.17 -0.15 -0.24 -1.29 0.00 0.00 177.43 175.65 2k9p n SER 47 N -5.25 -1.51 0.09 1.15 2.88 -1.14 -4.98 113.62 104.86 2k9p n SER 47 Ca -0.05 -2.10 0.00 0.00 -1.33 0.00 0.00 58.87 55.39 2k9p n SER 47 Cb 0.17 0.92 0.00 0.00 -0.75 0.00 0.00 64.21 64.55 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 -0.66 0.49 -0.03 2.46 -1.04 -0.74 -4.71 114.28 110.05 2k9p n THR 48 Ca -0.12 0.16 -0.15 0.00 -2.04 0.00 0.00 64.05 61.90 2k9p n THR 48 Cb 0.77 -0.98 -0.09 0.00 -1.82 0.00 0.00 70.33 68.21 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 1.40 -0.36 12.58 3.04 -1.11 -3.14 116.25 128.66 2k9p h VAL 49 Ca 0.00 -1.72 -0.04 0.00 -1.01 0.00 0.00 66.70 63.93 2k9p h VAL 49 Cb 0.06 2.25 -0.02 0.00 -2.01 0.00 0.00 31.29 31.56 2k9p h VAL 49 CO 0.00 0.50 0.05 0.00 -1.01 0.00 0.00 177.57 177.11 2k9p h THR 50 N -0.06 1.18 0.00 3.17 1.03 -1.82 -2.26 112.91 114.15 2k9p h THR 50 Ca -0.02 -0.69 -0.10 0.00 -0.01 0.00 0.00 66.41 65.59 2k9p h THR 50 Cb 0.99 0.86 -0.01 0.00 -1.07 0.00 0.00 68.15 68.91 2k9p h THR 50 CO 0.07 0.24 -0.49 -0.61 -0.01 0.00 0.00 175.52 174.73 2k9p h GLN 51 N 0.53 0.00 -0.40 0.00 4.15 -1.84 -3.23 115.11 114.32 2k9p h GLN 51 Ca 0.12 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.55 2k9p h GLN 51 Cb 0.26 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 2k9p h GLN 51 CO 0.00 0.49 0.25 0.00 -1.93 0.00 0.00 178.83 177.64 2k9p h ALA 52 N 1.51 0.50 -0.01 3.38 0.00 -1.35 0.10 119.26 123.40 2k9p h ALA 52 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k9p h ALA 52 Cb 1.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2k9p h ALA 52 CO 0.06 -0.07 -0.01 0.82 0.00 0.00 0.00 179.25 180.05 2k9p h ILE 53 N 0.51 0.96 0.41 0.00 5.03 -1.62 -0.17 117.51 122.63 2k9p h ILE 53 Ca 0.15 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.87 2k9p h ILE 53 Cb -0.03 0.96 0.00 0.00 -3.03 0.00 0.00 36.82 34.72 2k9p h ILE 53 CO -0.05 0.00 -0.19 -0.07 -0.68 0.00 0.00 178.15 177.16 2k9p h LEU 54 N -0.02 -0.46 -0.13 1.44 3.38 -1.54 0.07 115.31 118.05 2k9p h LEU 54 Ca 0.01 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2k9p h LEU 54 Cb 0.03 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2k9p h LEU 54 CO -0.02 -0.33 -0.10 0.15 0.09 0.00 0.00 178.44 178.23 2k9p h PHE 55 N -0.55 -0.24 -0.48 1.13 3.57 -0.76 -1.47 116.94 118.15 2k9p h PHE 55 Ca -0.06 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.46 2k9p h PHE 55 Cb 0.42 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2k9p h PHE 55 CO -0.05 -0.15 0.31 0.78 -2.23 0.00 0.00 178.31 176.97 2k9p h GLY 56 N -0.11 0.68 0.36 2.40 0.00 -0.94 0.48 103.07 105.94 2k9p h GLY 56 Ca 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 2k9p h GLY 56 CO -0.20 0.25 -0.45 -2.08 0.00 0.00 0.00 176.54 174.07 2k9p h VAL 57 N 0.65 0.00 -0.66 4.60 2.07 -0.68 0.02 116.25 122.24 2k9p h VAL 57 Ca 0.17 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.64 2k9p h VAL 57 Cb -0.06 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.68 2k9p h VAL 57 CO -0.04 0.00 0.20 0.03 0.02 0.00 0.00 177.57 177.78 2k9p h ARG 58 N -0.83 1.02 0.19 1.57 3.08 -1.23 -1.78 114.38 116.40 2k9p h ARG 58 Ca -0.04 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.81 2k9p h ARG 58 Cb 0.74 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 2k9p h ARG 58 CO -0.10 0.88 -0.33 1.03 -1.07 0.00 0.00 179.97 180.38 2k9p h SER 59 N 0.98 -0.93 -0.18 7.04 0.87 -0.78 0.87 113.55 121.42 2k9p h SER 59 Ca 0.22 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 2k9p h SER 59 Cb 0.29 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2k9p h SER 59 CO -0.01 -0.43 0.09 1.23 -0.53 0.00 0.00 176.83 177.18 2k9p h GLY 60 N -0.60 0.27 0.92 5.77 0.00 -0.77 0.57 103.07 109.22 2k9p h GLY 60 Ca 0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 2k9p h GLY 60 CO -0.15 0.13 0.08 0.00 0.00 0.00 0.00 176.54 176.59 2k9p h ALA 61 N 0.96 0.20 -0.82 3.60 0.00 -1.30 -0.26 119.26 121.64 2k9p h ALA 61 Ca 0.06 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2k9p h ALA 61 Cb 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2k9p h ALA 61 CO -0.01 -0.25 0.54 0.00 0.00 0.00 0.00 179.25 179.54 2k9p h ALA 62 N 0.96 1.04 0.06 0.00 0.00 -0.75 -2.05 119.26 118.53 2k9p h ALA 62 Ca 0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k9p h ALA 62 Cb 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2k9p h ALA 62 CO -0.01 0.46 -0.03 0.00 0.00 0.00 0.00 179.25 179.67 2k9p h ALA 63 N 1.30 -0.08 -0.10 0.00 0.00 -0.72 -2.45 119.26 117.20 2k9p h ALA 63 Ca 0.30 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2k9p h ALA 63 Cb -0.12 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2k9p h ALA 63 CO -0.06 -0.50 -0.49 1.25 0.00 0.00 0.00 179.25 179.44 2k9p h LEU 64 N -0.17 -1.53 -0.45 0.00 6.46 -0.77 -1.59 115.31 117.26 2k9p h LEU 64 Ca -0.01 0.19 0.06 0.00 -0.12 0.00 0.00 57.88 58.00 2k9p h LEU 64 Cb 0.14 0.60 -0.05 0.00 -0.73 0.00 0.00 40.66 40.63 2k9p h LEU 64 CO 0.01 -0.47 0.16 0.00 -0.62 0.00 0.00 178.44 177.52 2k9p h THR 65 N -0.57 0.86 -0.74 1.05 1.03 -1.41 -2.18 112.91 110.95 2k9p h THR 65 Ca 0.05 -0.11 0.13 0.00 -0.01 0.00 0.00 66.41 66.46 2k9p h THR 65 Cb 0.67 0.50 -0.09 0.00 -1.07 0.00 0.00 68.15 68.16 2k9p h THR 65 CO -0.40 0.06 0.31 0.17 -0.01 0.00 0.00 175.52 175.64 2k9p h LEU 66 N 0.33 0.31 -0.05 0.00 8.10 -0.98 -1.46 115.31 121.56 2k9p h LEU 66 Ca 0.21 0.10 -0.00 0.00 0.11 0.00 0.00 57.88 58.29 2k9p h LEU 66 Cb 0.20 0.06 -0.00 0.00 -0.44 0.00 0.00 40.66 40.49 2k9p h LEU 66 CO -0.21 0.14 0.02 0.40 -4.11 0.00 0.00 178.44 174.68 2k9p h ILE 67 N 0.47 1.11 -0.64 0.15 2.04 -0.70 0.04 117.51 119.98 2k9p h ILE 67 Ca 0.40 -0.31 0.10 0.00 1.00 0.00 0.00 64.86 66.04 2k9p h ILE 67 Cb 0.56 1.23 -0.07 0.00 -0.74 0.00 0.00 36.82 37.80 2k9p h ILE 67 CO -0.37 0.09 0.26 0.58 0.00 0.00 0.00 178.15 178.71 2k9p h VAL 68 N -0.04 0.78 -0.14 1.67 2.07 -0.88 -0.87 116.25 118.84 2k9p h VAL 68 Ca 0.02 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2k9p h VAL 68 Cb 0.12 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2k9p h VAL 68 CO -0.00 0.08 0.08 0.58 0.02 0.00 0.00 177.57 178.33 2k9p h VAL 69 N 0.46 1.09 -0.96 2.57 2.07 -0.92 -1.34 116.25 119.22 2k9p h VAL 69 Ca 0.32 -0.25 0.12 0.00 0.82 0.00 0.00 66.70 67.71 2k9p h VAL 69 Cb 0.39 1.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.08 2k9p h VAL 69 CO -0.30 0.08 0.59 -0.25 0.02 0.00 0.00 177.57 177.71 2k9p h TRP 70 N 0.13 1.06 0.58 1.57 7.01 -0.27 0.16 115.95 126.19 2k9p h TRP 70 Ca 0.05 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 2k9p h TRP 70 Cb 0.07 -0.33 0.01 0.00 -2.10 0.00 0.00 29.16 26.80 2k9p h TRP 70 CO -0.04 0.41 -0.28 0.82 -2.79 0.00 0.00 178.44 176.55 2k9p h ILE 71 N 0.92 0.00 -0.20 2.65 5.03 -0.84 -1.11 117.51 123.97 2k9p h ILE 71 Ca 0.48 -0.26 -0.03 0.00 -0.12 0.00 0.00 64.86 64.93 2k9p h ILE 71 Cb 0.50 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.28 2k9p h ILE 71 CO -0.27 0.00 0.02 0.00 -0.68 0.00 0.00 178.15 177.21 2k9p h THR 72 N -1.04 1.24 0.00 -0.27 1.03 -1.14 -2.80 112.91 109.93 2k9p h THR 72 Ca -0.08 -0.79 0.00 0.00 -0.01 0.00 0.00 66.41 65.53 2k9p h THR 72 Cb 0.60 1.37 0.00 0.00 -1.07 0.00 0.00 68.15 69.05 2k9p h THR 72 CO 0.13 0.24 0.00 -0.24 -0.01 0.00 0.00 175.52 175.64 2k9p n SER 73 N -4.72 0.00 -4.22 0.00 2.88 0.56 -4.93 113.62 103.19 2k9p n SER 73 Ca -0.04 -0.86 -0.31 0.00 -1.33 0.00 0.00 58.87 56.33 2k9p n SER 73 Cb 0.21 -0.05 -0.06 0.00 -0.75 0.00 0.00 64.21 63.56 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 -1.05 -1.99 -0.57 -1.46 5.12 -0.67 -4.93 116.66 111.11 2k9p n ARG 74 Ca 0.22 0.24 -0.30 0.00 -1.93 0.00 0.00 57.85 56.08 2k9p n ARG 74 Cb 0.13 -4.24 0.22 0.00 -1.16 0.00 0.00 32.46 27.40 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 -2.84 -1.12 -2.79 0.55 2.88 -0.51 -5.02 113.62 104.78 2k9p n SER 75 Ca -0.21 0.06 -0.02 0.00 -1.33 0.00 0.00 58.87 57.36 2k9p n SER 75 Cb 0.64 -1.31 0.02 0.00 -0.75 0.00 0.00 64.21 62.80 2k9p n SER 75 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2k9p n ARG 76 N -4.38 0.48 -1.68 -1.46 0.63 -1.26 -4.96 116.66 104.03 2k9p n ARG 76 Ca 0.06 -1.11 -0.19 0.00 -0.92 0.00 0.00 57.85 55.68 2k9p n ARG 76 Cb 0.54 1.52 -0.07 0.00 0.45 0.00 0.00 32.46 34.89 2k9p n ARG 76 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2k9p n LYS 77 N -0.56 -1.47 -1.94 -0.14 5.02 -1.26 -4.96 118.16 112.85 2k9p n LYS 77 Ca -0.01 1.11 -0.34 0.00 -2.02 0.00 0.00 58.31 57.05 2k9p n LYS 77 Cb 0.45 -5.51 0.03 0.00 -0.02 0.00 0.00 35.03 29.97 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 -2.69 3.26 0.44 -0.18 -4.23 -1.26 -5.00 115.64 105.98 2k9p s THR 78 Ca 0.00 0.65 -0.24 0.00 -1.18 0.00 0.00 61.69 60.92 2k9p s THR 78 Cb 0.00 -3.18 -0.08 0.00 1.34 0.00 0.00 72.50 70.58 2k9p s THR 78 CO 0.00 -0.30 1.20 -2.16 -0.54 0.00 0.00 174.62 172.81 2k9p s PRO 79 N -3.84 3.82 0.31 3.99 0.04 -1.26 -4.90 135.00 133.16 2k9p s PRO 79 Ca 0.69 1.87 0.08 0.00 0.04 0.00 0.00 61.00 63.68 2k9p s PRO 79 Cb -0.21 -2.51 0.86 0.00 0.04 0.00 0.00 34.50 32.68 2k9p s PRO 79 CO 0.36 -0.53 1.72 -0.84 0.04 0.00 0.00 177.00 177.75 2k9p h ILE 80 N 2.03 0.50 -0.41 0.56 3.07 -1.99 -1.36 117.51 119.91 2k9p h ILE 80 Ca -0.49 -0.18 0.01 0.00 1.55 0.00 0.00 64.86 65.75 2k9p h ILE 80 Cb 1.25 -0.06 -0.03 0.00 -0.27 0.00 0.00 36.82 37.71 2k9p h ILE 80 CO 0.61 0.09 0.25 0.15 -1.05 0.00 0.00 178.15 178.20 2k9p h PHE 81 N 0.52 0.47 0.26 0.16 3.04 -1.99 0.97 116.94 120.37 2k9p h PHE 81 Ca 0.63 0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.60 2k9p h PHE 81 Cb 1.22 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 2k9p h PHE 81 CO -0.04 0.28 -0.32 0.82 -2.02 0.00 0.00 178.31 177.02 2k9p h ILE 82 N 0.50 0.32 -0.79 1.41 2.04 -1.64 -1.94 117.51 117.42 2k9p h ILE 82 Ca 0.16 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.00 2k9p h ILE 82 Cb -0.01 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 2k9p h ILE 82 CO -0.07 0.00 0.41 0.40 0.00 0.00 0.00 178.15 178.89 2k9p h ILE 83 N -0.64 1.24 0.57 -0.67 1.08 -1.10 -0.27 117.51 117.72 2k9p h ILE 83 Ca -0.00 -0.63 -0.02 0.00 -0.39 0.00 0.00 64.86 63.82 2k9p h ILE 83 Cb 0.61 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 2k9p h ILE 83 CO -0.10 0.28 -0.38 -1.13 -0.69 0.00 0.00 178.15 176.12 2k9p h ASN 84 N 1.11 -0.98 -0.84 1.72 -1.24 -0.71 -0.47 115.58 114.17 2k9p h ASN 84 Ca 0.28 0.06 0.09 0.00 0.71 0.00 0.00 56.30 57.43 2k9p h ASN 84 Cb 0.06 0.30 -0.07 0.00 0.73 0.00 0.00 38.32 39.34 2k9p h ASN 84 CO -0.04 -0.58 0.49 1.56 -1.29 0.00 0.00 177.43 177.57 2k9p h GLN 85 N -0.91 0.82 0.03 6.67 1.08 -1.02 -0.92 115.11 120.85 2k9p h GLN 85 Ca -0.07 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.08 2k9p h GLN 85 Cb 0.75 -0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 28.00 2k9p h GLN 85 CO 0.05 0.54 -0.02 0.28 -0.95 0.00 0.00 178.83 178.73 2k9p h VAL 86 N 0.84 0.00 -0.39 -0.54 2.07 -0.86 -0.26 116.25 117.12 2k9p h VAL 86 Ca 0.39 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.98 2k9p h VAL 86 Cb 0.31 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.02 2k9p h VAL 86 CO -0.23 0.00 0.03 -1.28 0.02 0.00 0.00 177.57 176.11 2k9p h SER 87 N -0.05 -0.10 -0.38 0.57 0.87 -0.97 -0.97 113.55 112.53 2k9p h SER 87 Ca -0.00 0.08 0.08 0.00 -1.23 0.00 0.00 61.79 60.72 2k9p h SER 87 Cb 0.04 0.14 -0.09 0.00 -0.44 0.00 0.00 62.40 62.05 2k9p h SER 87 CO 0.00 -0.02 -0.22 -0.07 -0.53 0.00 0.00 176.83 176.00 2k9p h LEU 88 N 0.14 -0.73 -0.50 2.23 3.38 -1.23 -2.04 115.31 116.55 2k9p h LEU 88 Ca 0.19 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.40 2k9p h LEU 88 Cb 0.26 0.38 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 2k9p h LEU 88 CO -0.30 -0.25 0.14 0.15 0.09 0.00 0.00 178.44 178.27 2k9p h PHE 89 N -0.16 0.23 0.10 1.13 3.57 0.26 0.55 116.94 122.63 2k9p h PHE 89 Ca 0.19 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.73 2k9p h PHE 89 Cb 0.44 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 2k9p h PHE 89 CO -0.44 0.04 -0.21 -0.07 -2.23 0.00 0.00 178.31 175.40 2k9p h LEU 90 N 0.29 -0.58 0.07 0.59 -0.00 -0.65 0.14 115.31 115.18 2k9p h LEU 90 Ca 0.25 0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 58.19 2k9p h LEU 90 Cb 0.31 0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.19 2k9p h LEU 90 CO -0.29 -0.29 -0.04 0.40 -0.00 0.00 0.00 178.44 178.22 2k9p h ILE 91 N -0.38 1.06 -0.78 1.22 5.03 -1.20 -2.03 117.51 120.42 2k9p h ILE 91 Ca 0.03 -0.45 0.08 0.00 -0.12 0.00 0.00 64.86 64.40 2k9p h ILE 91 Cb 0.41 1.35 -0.07 0.00 -3.03 0.00 0.00 36.82 35.48 2k9p h ILE 91 CO -0.12 0.11 0.45 0.40 -0.68 0.00 0.00 178.15 178.30 2k9p h ILE 92 N -0.30 0.95 0.37 -0.67 2.04 -0.80 0.11 117.51 119.21 2k9p h ILE 92 Ca -0.01 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 2k9p h ILE 92 Cb 0.26 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 2k9p h ILE 92 CO 0.02 0.14 -0.47 0.25 0.00 0.00 0.00 178.15 178.09 2k9p h LEU 93 N 0.78 -1.32 -0.57 1.44 5.85 -0.68 0.66 115.31 121.48 2k9p h LEU 93 Ca 0.36 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 59.19 2k9p h LEU 93 Cb 0.28 0.45 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 2k9p h LEU 93 CO -0.22 -0.60 0.32 -0.74 -0.34 0.00 0.00 178.44 176.87 2k9p h HIS 94 N -0.87 0.77 0.13 1.25 2.76 -0.62 0.47 115.15 119.04 2k9p h HIS 94 Ca -0.03 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.12 2k9p h HIS 94 Cb 0.80 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.51 2k9p h HIS 94 CO -0.29 0.55 -0.06 0.77 -1.30 0.00 0.00 177.93 177.59 2k9p h SER 95 N 0.77 -0.15 -0.46 3.26 0.02 -0.75 0.33 113.55 116.57 2k9p h SER 95 Ca 0.20 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2k9p h SER 95 Cb 0.02 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 2k9p h SER 95 CO -0.03 -0.08 0.28 0.00 -1.14 0.00 0.00 176.83 175.85 2k9p h ALA 96 N 0.67 0.58 -0.23 3.77 0.00 -0.70 -0.53 119.26 122.83 2k9p h ALA 96 Ca -0.02 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2k9p h ALA 96 Cb 0.15 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2k9p h ALA 96 CO 0.03 0.06 -0.05 -0.07 0.00 0.00 0.00 179.25 179.22 2k9p h LEU 97 N 0.61 -0.20 -0.69 0.00 3.38 -0.81 -0.77 115.31 116.83 2k9p h LEU 97 Ca 0.16 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.22 2k9p h LEU 97 Cb -0.02 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 2k9p h LEU 97 CO -0.03 -0.07 0.44 0.22 0.09 0.00 0.00 178.44 179.09 2k9p h TYR 98 N 0.01 0.84 -0.20 1.13 3.20 -0.56 0.66 116.97 122.05 2k9p h TYR 98 Ca 0.11 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 2k9p h TYR 98 Cb 0.16 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2k9p h TYR 98 CO -0.23 0.50 0.12 0.35 -1.64 0.00 0.00 178.16 177.26 2k9p h PHE 99 N 0.88 0.27 -0.14 -3.82 3.57 -0.77 -0.27 116.94 116.67 2k9p h PHE 99 Ca 0.27 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.69 2k9p h PHE 99 Cb -0.03 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2k9p h PHE 99 CO -0.04 0.22 -0.29 1.57 -2.23 0.00 0.00 178.31 177.54 2k9p h LYS 100 N 0.24 0.26 -0.41 1.11 2.10 -0.89 -1.76 116.57 117.22 2k9p h LYS 100 Ca 0.07 -0.09 -0.14 0.00 -2.00 0.00 0.00 60.65 58.49 2k9p h LYS 100 Cb 0.03 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.33 2k9p h LYS 100 CO -0.01 0.53 -0.29 -0.92 -2.00 0.00 0.00 179.45 176.75 2k9p h TYR 101 N 0.23 1.04 -0.02 0.07 3.20 -0.49 0.51 116.97 121.52 2k9p h TYR 101 Ca 0.03 -0.28 -0.25 0.00 3.14 0.00 0.00 58.73 61.38 2k9p h TYR 101 Cb 0.63 -0.23 0.02 0.00 1.54 0.00 0.00 36.73 38.69 2k9p h TYR 101 CO 0.01 1.07 -0.98 1.37 -1.64 0.00 0.00 178.16 178.00 2k9p h LEU 102 N 0.76 0.89 -0.63 2.82 8.10 -1.03 -3.34 115.31 122.88 2k9p h LEU 102 Ca 0.08 -0.73 -0.15 0.00 0.11 0.00 0.00 57.88 57.20 2k9p h LEU 102 Cb 0.86 -0.27 -0.01 0.00 -0.44 0.00 0.00 40.66 40.79 2k9p h LEU 102 CO 0.08 1.50 -0.65 0.17 -4.11 0.00 0.00 178.44 175.42 2k9p h LEU 103 N 0.37 0.19 -0.99 0.17 8.10 -1.28 -3.03 115.31 118.84 2k9p h LEU 103 Ca -0.12 -0.11 0.05 0.00 0.11 0.00 0.00 57.88 57.81 2k9p h LEU 103 Cb 1.63 -0.05 -0.06 0.00 -0.44 0.00 0.00 40.66 41.74 2k9p h LEU 103 CO 0.19 0.78 0.65 0.77 -4.11 0.00 0.00 178.44 176.72 2k9p h SER 104 N 0.11 1.06 0.70 0.17 4.64 -1.00 -1.95 113.55 117.28 2k9p h SER 104 Ca -0.01 -0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.09 2k9p h SER 104 Cb 1.16 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 2k9p h SER 104 CO 0.10 0.70 -1.00 -1.13 -0.87 0.00 0.00 176.83 174.62 2k9p h ASN 105 N 1.21 0.23 0.26 4.97 -0.73 -1.69 -3.27 115.58 116.57 2k9p h ASN 105 Ca 0.41 -0.22 -0.01 0.00 1.87 0.00 0.00 56.30 58.35 2k9p h ASN 105 Cb 0.08 -0.07 -0.00 0.00 0.27 0.00 0.00 38.32 38.59 2k9p h ASN 105 CO -0.15 1.10 -0.05 1.88 -0.37 0.00 0.00 177.43 179.84 2k9p h TYR 106 N 0.07 0.00 -0.45 0.67 0.05 -1.24 -3.44 116.97 112.63 2k9p h TYR 106 Ca -0.06 0.00 -0.65 0.00 0.05 0.00 0.00 58.73 58.07 2k9p h TYR 106 Cb 1.69 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 39.33 2k9p h TYR 106 CO 0.03 0.05 -0.46 0.45 -1.05 0.00 0.00 178.16 177.18 2k9p s SER 107 N -5.82 4.27 -0.87 3.88 0.15 -0.90 -5.08 113.70 109.33 2k9p s SER 107 Ca -0.03 -1.53 -0.24 0.00 0.70 0.00 0.00 55.95 54.85 2k9p s SER 107 Cb 0.13 0.47 0.05 0.00 -1.71 0.00 0.00 66.02 64.96 2k9p s SER 107 CO 0.52 -0.91 1.31 -0.44 1.20 0.00 0.00 173.24 174.92 2k9p s SER 108 N -3.99 6.36 -0.41 5.45 0.01 -1.26 -4.90 113.70 114.96 2k9p s SER 108 Ca 0.14 -1.10 0.01 0.00 1.31 0.00 0.00 55.95 56.32 2k9p s SER 108 Cb 0.01 -2.53 0.13 0.00 0.21 0.00 0.00 66.02 63.84 2k9p s SER 108 CO 0.08 -1.58 0.22 -0.69 0.41 0.00 0.00 173.24 171.69 2k9p s VAL 109 N 4.94 1.08 -2.00 3.43 1.01 -1.25 -5.12 120.40 122.49 2k9p s VAL 109 Ca 0.38 -2.27 0.28 0.00 0.00 0.00 0.00 61.98 60.37 2k9p s VAL 109 Cb -0.05 -1.77 0.80 0.00 0.00 0.00 0.00 36.38 35.37 2k9p s VAL 109 CO 0.01 -0.90 2.03 0.41 0.00 0.00 0.00 175.10 176.65