#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9l n GLU 61 N 0.00 0.29 -1.62 1.97 0.28 -1.26 -5.14 120.64 115.16 2k9l n GLU 61 Ca 0.00 -0.91 -0.44 0.00 -0.16 0.00 0.00 57.16 55.65 2k9l n GLU 61 Cb 0.00 1.39 -0.01 0.00 1.43 0.00 0.00 31.44 34.25 2k9l n GLU 61 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2k9l n THR 62 N -0.82 1.89 -1.49 3.84 -2.24 -1.26 -4.92 114.28 109.27 2k9l n THR 62 Ca 0.03 -0.47 -0.34 0.00 -2.27 0.00 0.00 64.05 61.00 2k9l n THR 62 Cb 0.55 -1.17 0.08 0.00 -2.10 0.00 0.00 70.33 67.69 2k9l n THR 62 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2k9l s VAL 63 N -0.97 2.63 0.04 2.28 -7.23 -1.26 -5.03 120.40 110.86 2k9l s VAL 63 Ca 0.59 0.29 -0.01 0.00 -1.81 0.00 0.00 61.98 61.05 2k9l s VAL 63 Cb -0.67 -2.81 0.01 0.00 0.56 0.00 0.00 36.38 33.47 2k9l s VAL 63 CO 0.60 -0.18 0.04 -0.81 -0.31 0.00 0.00 175.10 174.43 2k9l n PRO 64 N -2.72 -1.10 -0.05 4.82 -0.04 -1.26 -5.01 135.00 129.63 2k9l n PRO 64 Ca 0.12 -0.06 -0.02 0.00 -0.04 0.00 0.00 63.50 63.50 2k9l n PRO 64 Cb 0.51 -0.05 -0.12 0.00 -0.04 0.00 0.00 33.50 33.79 2k9l n PRO 64 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2k9l n TYR 65 N -2.59 0.00 0.33 0.54 4.02 -1.26 -4.37 117.16 113.83 2k9l n TYR 65 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.04 2k9l n TYR 65 Cb 0.02 -0.62 0.49 0.00 -0.02 0.00 0.00 39.34 39.21 2k9l n TYR 65 CO 0.00 0.00 0.00 -0.56 -1.01 0.00 0.00 176.86 175.29 2k9l h GLN 66 N 0.00 0.00 -5.39 -0.72 3.07 -1.95 -3.40 115.11 106.72 2k9l h GLN 66 Ca -0.27 0.00 -0.61 0.00 0.09 0.00 0.00 58.65 57.86 2k9l h GLN 66 Cb 1.53 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.99 2k9l h GLN 66 CO 0.01 0.00 -0.46 0.42 0.09 0.00 0.00 178.83 178.90 2k9l s ILE 67 N -3.42 5.41 -0.02 1.86 -1.09 -1.26 -1.32 121.20 121.35 2k9l s ILE 67 Ca 0.04 0.26 -0.26 0.00 -2.23 0.00 0.00 60.65 58.47 2k9l s ILE 67 Cb 0.08 -3.48 -0.20 0.00 -1.58 0.00 0.00 42.46 37.28 2k9l s ILE 67 CO 0.55 0.47 1.27 1.55 -1.23 0.00 0.00 174.94 177.55 2k9l h PRO 68 N 6.31 0.02 -4.14 2.79 0.13 -1.91 -3.45 132.00 131.75 2k9l h PRO 68 Ca -0.44 -0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 64.48 2k9l h PRO 68 Cb 1.17 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 2k9l h PRO 68 CO 0.72 0.51 -0.71 1.52 -0.23 0.00 0.00 178.00 179.81 2k9l s TYR 69 N -4.25 0.37 0.21 1.56 -0.85 -0.44 -5.03 117.35 108.92 2k9l s TYR 69 Ca -0.16 -0.51 0.06 0.00 -0.52 0.00 0.00 57.07 55.94 2k9l s TYR 69 Cb 0.02 -0.24 -0.04 0.00 0.38 0.00 0.00 41.96 42.08 2k9l s TYR 69 CO 0.68 -0.16 0.18 0.95 -1.52 0.00 0.00 175.55 175.68 2k9l s THR 70 N -1.40 4.52 0.20 -3.49 -4.23 -1.21 -4.83 115.64 105.21 2k9l s THR 70 Ca -0.14 -1.22 -0.03 0.00 -1.18 0.00 0.00 61.69 59.11 2k9l s THR 70 Cb -0.10 -3.38 -0.02 0.00 1.34 0.00 0.00 72.50 70.35 2k9l s THR 70 CO -0.01 -0.23 1.56 1.55 -0.54 0.00 0.00 174.62 176.95 2k9l h PRO 71 N 1.91 0.64 -0.87 3.99 0.13 -1.96 -3.02 132.00 132.82 2k9l h PRO 71 Ca -0.48 -0.34 0.02 0.00 -0.87 0.00 0.00 66.00 64.34 2k9l h PRO 71 Cb 1.22 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.31 2k9l h PRO 71 CO 0.62 0.94 0.57 1.03 -0.23 0.00 0.00 178.00 180.93 2k9l h SER 72 N 0.52 0.96 -0.02 1.44 0.87 -1.98 0.15 113.55 115.50 2k9l h SER 72 Ca 0.04 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2k9l h SER 72 Cb 0.94 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.67 2k9l h SER 72 CO 0.09 0.68 -0.01 -0.33 -0.53 0.00 0.00 176.83 176.73 2k9l h GLU 73 N 1.13 0.04 0.15 2.24 5.08 -1.97 -0.35 114.58 120.90 2k9l h GLU 73 Ca 0.33 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 2k9l h GLU 73 Cb -0.05 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2k9l h GLU 73 CO -0.09 0.40 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.18 2k9l h LEU 74 N -0.32 -0.17 -0.88 1.33 3.38 -1.36 0.44 115.31 117.72 2k9l h LEU 74 Ca 0.01 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.93 2k9l h LEU 74 Cb 0.39 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2k9l h LEU 74 CO 0.00 -0.02 0.57 -0.33 0.09 0.00 0.00 178.44 178.75 2k9l h GLU 75 N -0.30 1.08 -0.32 1.13 4.39 -0.76 -1.26 114.58 118.54 2k9l h GLU 75 Ca -0.02 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.52 2k9l h GLU 75 Cb 0.24 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2k9l h GLU 75 CO 0.03 0.71 -0.21 1.49 -1.16 0.00 0.00 179.01 179.88 2k9l h GLU 76 N 1.11 0.60 0.27 2.33 4.81 -0.87 -1.48 114.58 121.34 2k9l h GLU 76 Ca 0.35 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2k9l h GLU 76 Cb -0.00 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2k9l h GLU 76 CO -0.12 0.77 -0.13 1.25 -0.73 0.00 0.00 179.01 180.06 2k9l h LEU 77 N 0.54 -0.30 -0.39 1.64 7.12 -0.10 -1.18 115.31 122.63 2k9l h LEU 77 Ca 0.08 -0.17 0.01 0.00 0.13 0.00 0.00 57.88 57.94 2k9l h LEU 77 Cb 0.65 0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.83 2k9l h LEU 77 CO 0.05 0.01 0.25 0.06 -0.13 0.00 0.00 178.44 178.67 2k9l h GLN 78 N -0.63 0.49 -0.57 1.25 3.07 -1.25 -0.85 115.11 116.62 2k9l h GLN 78 Ca -0.04 -0.03 0.04 0.00 0.09 0.00 0.00 58.65 58.71 2k9l h GLN 78 Cb 0.45 -0.11 -0.04 0.00 0.08 0.00 0.00 27.48 27.86 2k9l h GLN 78 CO 0.06 0.32 0.33 1.96 0.09 0.00 0.00 178.83 181.59 2k9l h GLN 79 N 0.50 0.62 -0.10 0.06 1.08 -1.27 -1.44 115.11 114.56 2k9l h GLN 79 Ca 0.15 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.25 2k9l h GLN 79 Cb -0.03 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2k9l h GLN 79 CO -0.05 0.41 -0.23 -0.91 -0.95 0.00 0.00 178.83 177.10 2k9l h ASN 80 N 0.64 0.17 0.44 1.46 2.35 -0.85 0.01 115.58 119.81 2k9l h ASN 80 Ca 0.24 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 2k9l h ASN 80 Cb 0.07 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2k9l h ASN 80 CO -0.13 0.41 -0.21 0.40 -1.65 0.00 0.00 177.43 176.26 2k9l h ILE 81 N 0.16 0.48 0.00 2.81 2.04 -0.16 0.33 117.51 123.18 2k9l h ILE 81 Ca 0.03 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 2k9l h ILE 81 Cb 0.50 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2k9l h ILE 81 CO 0.03 0.07 -0.12 0.07 0.00 0.00 0.00 178.15 178.21 2k9l h LYS 82 N -0.89 0.00 0.00 2.37 2.10 -1.29 0.36 116.57 119.22 2k9l h LYS 82 Ca -0.06 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.40 2k9l h LYS 82 Cb 0.57 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.87 2k9l h LYS 82 CO 0.10 0.12 -1.09 -0.07 -2.00 0.00 0.00 179.45 176.51 2k9l h LEU 83 N 0.00 0.00 0.00 7.07 3.38 -0.88 -3.43 115.31 121.45 2k9l h LEU 83 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k9l h LEU 83 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2k9l h LEU 83 CO 0.02 0.78 0.00 -0.62 0.09 0.00 0.00 178.44 178.71 2k9l n GLU 84 N -3.16 0.00 -0.63 1.13 -0.58 0.12 -5.04 120.64 112.47 2k9l n GLU 84 Ca -0.05 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.39 2k9l n GLU 84 Cb 0.89 -0.16 0.18 0.00 -0.57 0.00 0.00 31.44 31.77 2k9l n GLU 84 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2k9l n LEU 85 N -1.90 -2.12 -3.71 -4.62 7.99 0.12 -5.04 117.00 107.72 2k9l n LEU 85 Ca 0.00 -0.21 -0.01 0.00 -0.01 0.00 0.00 56.01 55.78 2k9l n LEU 85 Cb 0.00 -0.92 -0.01 0.00 -0.11 0.00 0.00 43.42 42.38 2k9l n LEU 85 CO 0.00 -3.15 0.88 -1.83 -1.51 0.00 0.00 177.39 171.78 2k9l s GLU 86 N -3.52 0.84 7.01 3.23 -1.05 -1.26 -4.61 118.70 119.34 2k9l s GLU 86 Ca 0.53 -0.47 0.00 0.00 -0.15 0.00 0.00 54.97 54.88 2k9l s GLU 86 Cb -0.11 0.28 0.00 0.00 -0.44 0.00 0.00 34.13 33.86 2k9l s GLU 86 CO 0.61 -0.38 0.00 0.41 0.95 0.00 0.00 175.26 176.84 2k9l n GLY 87 N -0.51 3.88 2.60 -3.83 0.00 -1.26 -2.14 105.19 103.93 2k9l n GLY 87 Ca -0.07 0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2k9l n GLY 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k9l n LYS 88 N 14.00 2.50 0.00 1.61 0.00 -1.26 -4.07 118.16 130.94 2k9l n LYS 88 Ca 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 58.31 55.57 2k9l n LYS 88 Cb 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 35.03 32.86 2k9l n LYS 88 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k9l n GLU 89 N 0.30 0.00 0.11 1.64 1.02 -0.91 -4.83 120.64 117.97 2k9l n GLU 89 Ca 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.61 2k9l n GLU 89 Cb 0.45 -0.01 0.13 0.00 -0.02 0.00 0.00 31.44 31.99 2k9l n GLU 89 CO 0.00 0.00 0.00 -0.56 1.18 0.00 0.00 177.13 177.75 2k9l h GLN 90 N 0.00 0.10 -0.44 3.49 3.07 -1.73 -2.95 115.11 116.65 2k9l h GLN 90 Ca 0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 58.65 58.65 2k9l h GLN 90 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.55 2k9l h GLN 90 CO 0.00 0.71 0.21 1.05 0.09 0.00 0.00 178.83 180.89 2k9l h GLU 91 N 0.07 0.64 0.18 0.06 4.11 -1.88 0.00 114.58 117.77 2k9l h GLU 91 Ca -0.01 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 2k9l h GLU 91 Cb 1.14 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.28 2k9l h GLU 91 CO 0.09 0.55 -0.09 -0.07 0.07 0.00 0.00 179.01 179.56 2k9l h LEU 92 N 0.58 -0.21 0.13 3.06 3.38 -1.87 0.25 115.31 120.63 2k9l h LEU 92 Ca 0.15 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2k9l h LEU 92 Cb 0.12 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2k9l h LEU 92 CO -0.02 0.05 -0.23 0.00 0.09 0.00 0.00 178.44 178.33 2k9l h ALA 93 N 0.31 -0.40 -0.40 1.53 0.00 -1.46 -1.78 119.26 117.05 2k9l h ALA 93 Ca -0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2k9l h ALA 93 Cb 0.36 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2k9l h ALA 93 CO 0.04 -0.76 0.09 -0.07 0.00 0.00 0.00 179.25 178.55 2k9l h LEU 94 N -0.43 0.54 0.55 0.00 3.38 -1.01 -1.17 115.31 117.17 2k9l h LEU 94 Ca 0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2k9l h LEU 94 Cb 0.44 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2k9l h LEU 94 CO -0.11 0.55 -0.38 -0.08 0.09 0.00 0.00 178.44 178.51 2k9l h GLU 95 N 0.58 -0.85 -0.91 1.13 4.81 0.12 0.21 114.58 119.66 2k9l h GLU 95 Ca 0.13 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2k9l h GLU 95 Cb 0.23 0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.76 2k9l h GLU 95 CO -0.00 -0.57 0.57 1.25 -0.73 0.00 0.00 179.01 179.53 2k9l h LEU 96 N -0.89 1.07 0.38 1.64 5.85 -1.30 0.29 115.31 122.36 2k9l h LEU 96 Ca -0.07 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 2k9l h LEU 96 Cb 0.72 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 2k9l h LEU 96 CO 0.05 0.80 -0.24 0.25 -0.34 0.00 0.00 178.44 178.96 2k9l h LEU 97 N 1.25 -0.59 -1.12 2.25 6.46 -1.02 -0.33 115.31 122.20 2k9l h LEU 97 Ca 0.33 0.04 -0.09 0.00 -0.12 0.00 0.00 57.88 58.04 2k9l h LEU 97 Cb -0.09 0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 2k9l h LEU 97 CO -0.07 -0.38 -0.41 -1.13 -0.62 0.00 0.00 178.44 175.83 2k9l h ASN 98 N -0.60 0.00 -0.62 1.25 -1.24 -0.39 -2.98 115.58 111.00 2k9l h ASN 98 Ca -0.04 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 56.87 2k9l h ASN 98 Cb 0.49 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.52 2k9l h ASN 98 CO 0.04 0.41 0.02 1.88 -1.29 0.00 0.00 177.43 178.49 2k9l h TYR 99 N 0.00 1.18 -2.28 0.67 -1.99 -0.04 -3.42 116.97 111.09 2k9l h TYR 99 Ca -0.00 -0.20 -0.21 0.00 2.00 0.00 0.00 58.73 60.31 2k9l h TYR 99 Cb 0.79 -0.31 -0.32 0.00 2.00 0.00 0.00 36.73 38.89 2k9l h TYR 99 CO 0.00 1.03 -0.53 -1.17 -0.00 0.00 0.00 178.16 177.49 2k9l s LEU 100 N -9.36 -0.41 0.63 3.88 2.96 -0.17 -5.00 118.68 111.21 2k9l s LEU 100 Ca -0.12 0.17 0.42 0.00 -0.22 0.00 0.00 54.13 54.38 2k9l s LEU 100 Cb 0.14 0.82 2.15 0.00 0.50 0.00 0.00 46.19 49.80 2k9l s LEU 100 CO 0.86 -0.30 2.26 0.78 -1.32 0.00 0.00 176.35 178.64 2k9l h ASN 101 N 8.24 0.00 1.10 3.68 2.35 -1.81 0.22 115.58 129.36 2k9l h ASN 101 Ca -0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2k9l h ASN 101 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 2k9l h ASN 101 CO 0.25 0.00 -0.23 1.21 -1.65 0.00 0.00 177.43 177.01 2k9l n GLU 102 N -3.05 0.19 -3.78 0.81 2.13 -1.26 -4.57 120.64 111.10 2k9l n GLU 102 Ca -0.02 0.11 -0.36 0.00 0.66 0.00 0.00 57.16 57.55 2k9l n GLU 102 Cb 0.12 -1.68 -0.11 0.00 0.27 0.00 0.00 31.44 30.04 2k9l n GLU 102 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2k9l s LYS 103 N -3.09 2.06 0.00 5.31 -0.14 0.07 -4.41 119.74 119.54 2k9l s LYS 103 Ca 0.10 -1.94 0.00 0.00 -1.36 0.00 0.00 55.97 52.77 2k9l s LYS 103 Cb 0.15 -3.59 0.00 0.00 -1.68 0.00 0.00 37.83 32.71 2k9l s LYS 103 CO 0.63 -1.08 0.00 0.41 -0.76 0.00 0.00 175.35 174.54 2k9l n GLY 104 N 4.40 -1.72 0.20 -3.33 0.00 -1.26 -4.02 105.19 99.45 2k9l n GLY 104 Ca -0.00 0.63 -0.06 0.00 0.00 0.00 0.00 46.02 46.58 2k9l n GLY 104 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2k9l h PHE 105 N 0.00 -0.67 -0.73 1.61 3.57 -1.88 -2.59 116.94 116.25 2k9l h PHE 105 Ca 0.00 0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.28 2k9l h PHE 105 Cb 0.00 0.30 -0.14 0.00 2.79 0.00 0.00 35.95 38.89 2k9l h PHE 105 CO 0.00 -0.23 0.29 -0.11 -2.23 0.00 0.00 178.31 176.03 2k9l n LEU 106 N -3.75 5.96 -4.26 0.59 -0.00 -1.26 -5.01 117.00 109.27 2k9l n LEU 106 Ca -0.03 -3.30 -0.33 0.00 -0.00 0.00 0.00 56.01 52.35 2k9l n LEU 106 Cb 0.16 -0.74 0.15 0.00 -0.00 0.00 0.00 43.42 42.99 2k9l n LEU 106 CO 0.04 0.86 -0.66 -0.24 -0.00 0.00 0.00 177.39 177.39 2k9l n SER 107 N -0.36 -2.46 -3.12 1.96 2.88 -0.98 -5.00 113.62 106.54 2k9l n SER 107 Ca 0.42 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 2k9l n SER 107 Cb 1.38 -0.93 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 2k9l n SER 107 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2k9l n LYS 108 N -1.53 0.54 -1.33 -1.46 3.00 -1.26 -4.90 118.16 111.22 2k9l n LYS 108 Ca 0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.99 2k9l n LYS 108 Cb 0.63 0.00 0.10 0.00 0.00 0.00 0.00 35.03 35.76 2k9l n LYS 108 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2k9l s SER 109 N -1.38 4.15 0.38 3.14 0.01 -1.26 -4.80 113.70 113.94 2k9l s SER 109 Ca 0.00 2.19 0.14 0.00 1.31 0.00 0.00 55.95 59.59 2k9l s SER 109 Cb 0.00 -2.57 0.99 0.00 0.21 0.00 0.00 66.02 64.65 2k9l s SER 109 CO 0.00 -2.28 1.81 -0.37 0.41 0.00 0.00 173.24 172.80 2k9l h VAL 110 N -0.65 0.64 -0.67 3.43 -1.51 -1.97 0.23 116.25 115.76 2k9l h VAL 110 Ca -0.46 -0.18 0.02 0.00 -1.23 0.00 0.00 66.70 64.86 2k9l h VAL 110 Cb 1.27 0.08 -0.04 0.00 -2.13 0.00 0.00 31.29 30.48 2k9l h VAL 110 CO 0.49 0.09 0.44 -0.33 -1.23 0.00 0.00 177.57 177.04 2k9l h GLU 111 N 0.51 0.82 0.71 5.19 5.08 -1.94 -0.63 114.58 124.33 2k9l h GLU 111 Ca 0.54 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.82 2k9l h GLU 111 Cb 1.19 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.27 2k9l h GLU 111 CO -0.27 0.55 -0.34 0.93 -1.00 0.00 0.00 179.01 178.87 2k9l h GLU 112 N 0.85 -0.92 -0.85 2.33 4.39 -0.87 -0.23 114.58 119.27 2k9l h GLU 112 Ca 0.26 0.06 0.12 0.00 0.34 0.00 0.00 59.36 60.14 2k9l h GLU 112 Cb -0.01 0.21 -0.08 0.00 -0.10 0.00 0.00 28.75 28.77 2k9l h GLU 112 CO -0.06 -0.62 0.47 0.82 -1.16 0.00 0.00 179.01 178.46 2k9l h ILE 113 N -1.16 0.84 -0.57 3.13 2.04 -1.41 0.50 117.51 120.87 2k9l h ILE 113 Ca -0.10 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2k9l h ILE 113 Cb 0.74 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 2k9l h ILE 113 CO 0.16 0.13 0.24 -1.28 0.00 0.00 0.00 178.15 177.40 2k9l h SER 114 N 0.74 0.78 0.01 1.72 0.87 -1.10 0.86 113.55 117.44 2k9l h SER 114 Ca 0.43 -0.16 -0.08 0.00 -1.23 0.00 0.00 61.79 60.74 2k9l h SER 114 Cb 0.49 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2k9l h SER 114 CO -0.30 0.73 -0.24 0.44 -0.53 0.00 0.00 176.83 176.94 2k9l h ASP 115 N 0.79 0.38 0.43 6.23 5.19 0.12 0.26 116.42 129.81 2k9l h ASP 115 Ca 0.19 -0.12 -0.21 0.00 -0.62 0.00 0.00 57.03 56.27 2k9l h ASP 115 Cb 0.19 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 39.59 2k9l h ASP 115 CO -0.02 0.63 -0.89 0.58 -3.12 0.00 0.00 179.24 176.42 2k9l h VAL 116 N 0.35 1.44 -0.01 -1.35 2.07 -0.54 -3.13 116.25 115.07 2k9l h VAL 116 Ca 0.05 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.09 2k9l h VAL 116 Cb 0.61 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 2k9l h VAL 116 CO 0.04 0.73 -0.22 -0.11 0.02 0.00 0.00 177.57 178.03 2k9l n LEU 117 N -3.72 1.11 -1.28 2.57 7.94 0.26 -4.92 117.00 118.96 2k9l n LEU 117 Ca -0.05 -0.30 -0.17 0.00 -1.11 0.00 0.00 56.01 54.38 2k9l n LEU 117 Cb 0.81 -0.10 -0.07 0.00 0.53 0.00 0.00 43.42 44.58 2k9l n LEU 117 CO 0.49 0.20 -0.16 0.54 -1.11 0.00 0.00 177.39 177.36 2k9l n ARG 118 N -0.53 -1.48 -3.89 1.96 1.74 0.80 -4.96 116.66 110.30 2k9l n ARG 118 Ca 0.13 1.09 -0.22 0.00 -0.77 0.00 0.00 57.85 58.08 2k9l n ARG 118 Cb 0.35 -5.45 -0.04 0.00 -1.02 0.00 0.00 32.46 26.30 2k9l n ARG 118 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k9l s SER 120 N -3.95 6.19 0.27 0.00 0.01 -1.26 -4.44 113.70 110.50 2k9l s SER 120 Ca 0.40 2.61 -0.01 0.00 1.31 0.00 0.00 55.95 60.25 2k9l s SER 120 Cb -0.05 -2.63 0.36 0.00 0.21 0.00 0.00 66.02 63.91 2k9l s SER 120 CO 0.25 -0.93 1.77 0.58 0.41 0.00 0.00 173.24 175.32 2k9l h VAL 121 N 2.27 1.24 -0.58 3.43 2.07 -1.91 -2.96 116.25 119.82 2k9l h VAL 121 Ca -0.50 -0.98 0.12 0.00 0.82 0.00 0.00 66.70 66.16 2k9l h VAL 121 Cb 1.25 0.88 -0.10 0.00 -1.52 0.00 0.00 31.29 31.80 2k9l h VAL 121 CO 0.62 0.35 0.02 1.05 0.02 0.00 0.00 177.57 179.62 2k9l h GLU 122 N 0.72 0.13 -0.31 1.57 4.11 -1.96 0.30 114.58 119.14 2k9l h GLU 122 Ca 0.14 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.54 2k9l h GLU 122 Cb 0.44 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2k9l h GLU 122 CO 0.02 0.09 0.09 1.49 0.07 0.00 0.00 179.01 180.77 2k9l h GLU 123 N 0.13 0.48 -0.03 1.06 4.22 -1.92 -1.09 114.58 117.43 2k9l h GLU 123 Ca 0.30 -0.11 -0.02 0.00 0.08 0.00 0.00 59.36 59.61 2k9l h GLU 123 Cb 0.47 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2k9l h GLU 123 CO -0.48 0.53 -0.07 1.25 -2.18 0.00 0.00 179.01 178.06 2k9l h LEU 124 N 0.34 0.04 -0.02 1.64 7.12 -1.13 -1.23 115.31 122.07 2k9l h LEU 124 Ca 0.10 -0.00 -0.14 0.00 0.13 0.00 0.00 57.88 57.97 2k9l h LEU 124 Cb 0.25 -0.01 0.01 0.00 -0.53 0.00 0.00 40.66 40.38 2k9l h LEU 124 CO -0.00 0.12 -0.51 -0.08 -0.13 0.00 0.00 178.44 177.84 2k9l h GLU 125 N 0.05 0.39 -0.79 1.25 4.81 -0.07 -1.57 114.58 118.64 2k9l h GLU 125 Ca 0.01 -0.39 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 2k9l h GLU 125 Cb 0.16 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 2k9l h GLU 125 CO 0.01 1.05 0.36 1.57 -0.73 0.00 0.00 179.01 181.27 2k9l h LYS 126 N -0.12 1.15 -0.20 1.92 2.10 -0.84 0.28 116.57 120.85 2k9l h LYS 126 Ca -0.06 -0.18 -0.20 0.00 -2.00 0.00 0.00 60.65 58.21 2k9l h LYS 126 Cb 1.21 -0.20 0.01 0.00 -0.90 0.00 0.00 32.23 32.35 2k9l h LYS 126 CO 0.10 0.90 -0.66 -0.39 -2.00 0.00 0.00 179.45 177.40 2k9l h VAL 127 N 1.13 1.28 -0.37 0.07 -1.51 -1.29 -1.30 116.25 114.27 2k9l h VAL 127 Ca 0.27 -1.86 -0.05 0.00 -1.23 0.00 0.00 66.70 63.84 2k9l h VAL 127 Cb 0.15 1.86 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 2k9l h VAL 127 CO -0.03 0.59 0.04 0.03 -1.23 0.00 0.00 177.57 176.98 2k9l h ARG 128 N 0.55 0.62 -0.17 5.19 2.47 -1.04 -1.48 114.38 120.51 2k9l h ARG 128 Ca -0.03 -0.17 -0.13 0.00 -1.26 0.00 0.00 59.98 58.39 2k9l h ARG 128 Cb 1.28 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 2k9l h ARG 128 CO 0.14 0.70 -0.45 -0.56 0.56 0.00 0.00 179.97 180.36 2k9l h GLN 129 N 0.45 0.42 -0.44 0.04 3.07 -0.99 0.23 115.11 117.90 2k9l h GLN 129 Ca 0.11 -0.22 -0.11 0.00 0.09 0.00 0.00 58.65 58.52 2k9l h GLN 129 Cb 0.39 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.94 2k9l h GLN 129 CO 0.01 0.79 -0.15 0.87 0.09 0.00 0.00 178.83 180.44 2k9l h LYS 130 N 0.34 0.83 0.00 0.06 1.57 -1.07 0.88 116.57 119.18 2k9l h LYS 130 Ca 0.02 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2k9l h LYS 130 Cb 0.92 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 2k9l h LYS 130 CO 0.08 0.93 -0.77 -0.39 -0.57 0.00 0.00 179.45 178.73 2k9l h VAL 131 N 0.74 0.05 0.00 0.50 -1.51 -1.15 -3.33 116.25 111.55 2k9l h VAL 131 Ca 0.11 -1.09 -0.22 0.00 -1.23 0.00 0.00 66.70 64.27 2k9l h VAL 131 Cb 0.66 1.68 -0.04 0.00 -2.13 0.00 0.00 31.29 31.47 2k9l h VAL 131 CO 0.05 0.03 -1.22 0.25 -1.23 0.00 0.00 177.57 175.45 2k9l h LEU 132 N 0.00 0.00 -1.95 4.19 6.46 -0.35 -3.31 115.31 120.35 2k9l h LEU 132 Ca -0.01 0.00 0.25 0.00 -0.12 0.00 0.00 57.88 58.00 2k9l h LEU 132 Cb 1.05 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.94 2k9l h LEU 132 CO 0.00 0.92 0.62 0.08 -0.62 0.00 0.00 178.44 179.44 2k9l h ARG 133 N 0.00 0.04 -0.71 1.25 0.11 -0.93 0.02 114.38 114.16 2k9l h ARG 133 Ca -0.11 -0.00 0.11 0.00 0.10 0.00 0.00 59.98 60.07 2k9l h ARG 133 Cb 1.80 -0.01 -0.08 0.00 1.11 0.00 0.00 29.97 32.79 2k9l h ARG 133 CO 0.10 0.03 0.32 -0.07 0.10 0.00 0.00 179.97 180.45 2k9l h LEU 134 N 0.04 0.37 -1.01 0.08 -0.00 -1.77 -3.52 115.31 109.51 2k9l h LEU 134 Ca 0.42 0.08 0.00 0.00 -0.00 0.00 0.00 57.88 58.38 2k9l h LEU 134 Cb 1.61 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 42.29 2k9l h LEU 134 CO -0.02 0.20 0.00 -1.84 -0.00 0.00 0.00 178.44 176.77