#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 0.84 -3.44 1.64 0.00 -1.26 -5.03 120.64 113.39 2k9l n GLU 61 Ca 0.00 0.06 -0.23 0.00 0.00 0.00 0.00 57.16 56.98 2k9l n GLU 61 Cb 0.00 -1.27 -0.01 0.00 0.00 0.00 0.00 31.44 30.16 2k9l n GLU 61 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 2k9l s THR 62 N -2.26 5.01 0.21 3.84 -4.23 -1.26 -5.12 115.64 111.83 2k9l s THR 62 Ca -0.15 -0.56 0.09 0.00 -1.18 0.00 0.00 61.69 59.90 2k9l s THR 62 Cb 0.04 -3.82 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 2k9l s THR 62 CO 0.34 -0.50 -0.10 0.68 -0.54 0.00 0.00 174.62 174.50 2k9l s VAL 63 N -2.28 3.11 0.00 2.29 -7.23 -1.26 -5.14 120.40 109.88 2k9l s VAL 63 Ca 0.40 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 2k9l s VAL 63 Cb -0.10 -2.57 0.00 0.00 0.56 0.00 0.00 36.38 34.28 2k9l s VAL 63 CO 0.35 -0.19 0.00 -0.81 -0.31 0.00 0.00 175.10 174.14 2k9l n PRO 64 N -0.18 -0.96 -0.03 4.82 -0.04 -1.26 -5.02 135.00 132.33 2k9l n PRO 64 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2k9l n PRO 64 Cb 0.57 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.93 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 -2.45 0.00 0.38 0.54 4.01 -1.26 -4.44 117.16 113.95 2k9l n TYR 65 Ca 0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.87 2k9l n TYR 65 Cb 0.00 -0.42 0.42 0.00 -0.31 0.00 0.00 39.34 39.03 2k9l n TYR 65 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 2k9l h GLN 66 N 0.00 0.00 -5.46 -0.72 3.07 -1.95 -3.40 115.11 106.65 2k9l h GLN 66 Ca -0.15 0.00 -0.61 0.00 0.09 0.00 0.00 58.65 57.98 2k9l h GLN 66 Cb 1.12 0.00 -0.10 0.00 0.08 0.00 0.00 27.48 28.58 2k9l h GLN 66 CO 0.01 0.00 -0.41 0.42 0.09 0.00 0.00 178.83 178.94 2k9l s ILE 67 N -3.31 5.37 -0.02 1.86 -1.09 -1.26 -1.23 121.20 121.51 2k9l s ILE 67 Ca 0.06 0.36 -0.26 0.00 -2.23 0.00 0.00 60.65 58.58 2k9l s ILE 67 Cb 0.09 -3.53 -0.20 0.00 -1.58 0.00 0.00 42.46 37.24 2k9l s ILE 67 CO 0.56 0.46 1.27 1.55 -1.23 0.00 0.00 174.94 177.55 2k9l h PRO 68 N 6.27 0.01 -4.18 2.79 0.13 -1.92 -3.46 132.00 131.63 2k9l h PRO 68 Ca -0.44 -0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.47 2k9l h PRO 68 Cb 1.17 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 2k9l h PRO 68 CO 0.72 0.49 -0.71 1.52 -0.23 0.00 0.00 178.00 179.79 2k9l s TYR 69 N -4.26 0.40 0.15 1.56 -0.85 -0.37 -5.07 117.35 108.91 2k9l s TYR 69 Ca -0.16 -0.48 0.05 0.00 -0.52 0.00 0.00 57.07 55.96 2k9l s TYR 69 Cb 0.02 -0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.06 2k9l s TYR 69 CO 0.68 -0.14 0.12 0.95 -1.52 0.00 0.00 175.55 175.64 2k9l s THR 70 N -1.32 4.46 0.14 -3.49 -4.23 -1.20 -4.84 115.64 105.17 2k9l s THR 70 Ca -0.13 -1.05 -0.12 0.00 -1.18 0.00 0.00 61.69 59.22 2k9l s THR 70 Cb -0.09 -3.26 -0.05 0.00 1.34 0.00 0.00 72.50 70.44 2k9l s THR 70 CO -0.00 -0.08 1.47 1.55 -0.54 0.00 0.00 174.62 177.02 2k9l h PRO 71 N 2.54 0.91 -0.87 3.99 0.13 -1.96 -3.06 132.00 133.68 2k9l h PRO 71 Ca -0.47 -0.47 0.06 0.00 -0.87 0.00 0.00 66.00 64.24 2k9l h PRO 71 Cb 1.20 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2k9l h PRO 71 CO 0.63 1.13 0.57 1.03 -0.23 0.00 0.00 178.00 181.12 2k9l h SER 72 N 0.72 0.87 0.18 1.44 0.87 -1.98 -0.02 113.55 115.62 2k9l h SER 72 Ca 0.06 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2k9l h SER 72 Cb 0.95 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 2k9l h SER 72 CO 0.09 0.57 -0.08 -0.33 -0.53 0.00 0.00 176.83 176.54 2k9l h GLU 73 N 0.99 -0.23 0.11 2.24 4.39 -1.97 0.11 114.58 120.23 2k9l h GLU 73 Ca 0.37 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.09 2k9l h GLU 73 Cb 0.18 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2k9l h GLU 73 CO -0.13 0.04 -0.10 -0.07 -1.16 0.00 0.00 179.01 177.58 2k9l h LEU 74 N -0.48 -0.27 -0.81 1.33 3.38 -1.37 0.25 115.31 117.33 2k9l h LEU 74 Ca -0.02 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2k9l h LEU 74 Cb 0.37 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2k9l h LEU 74 CO 0.04 -0.16 0.54 -0.33 0.09 0.00 0.00 178.44 178.62 2k9l h GLU 75 N -0.23 1.06 -0.17 1.13 4.39 -1.03 -1.30 114.58 118.43 2k9l h GLU 75 Ca 0.00 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 2k9l h GLU 75 Cb 0.22 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2k9l h GLU 75 CO -0.02 0.70 -0.30 1.49 -1.16 0.00 0.00 179.01 179.72 2k9l h GLU 76 N 1.09 0.32 0.13 2.33 4.81 -0.44 -1.71 114.58 121.12 2k9l h GLU 76 Ca 0.30 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2k9l h GLU 76 Cb -0.12 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.25 2k9l h GLU 76 CO -0.07 0.59 -0.06 1.25 -0.73 0.00 0.00 179.01 179.99 2k9l h LEU 77 N 0.28 -0.15 -0.23 1.64 7.12 0.24 -1.15 115.31 123.06 2k9l h LEU 77 Ca 0.04 -0.30 0.00 0.00 0.13 0.00 0.00 57.88 57.75 2k9l h LEU 77 Cb 0.67 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.83 2k9l h LEU 77 CO 0.05 0.23 0.15 0.06 -0.13 0.00 0.00 178.44 178.80 2k9l h GLN 78 N -0.56 0.31 -0.62 1.25 3.07 -1.23 -0.70 115.11 116.62 2k9l h GLN 78 Ca -0.02 -0.02 0.03 0.00 0.09 0.00 0.00 58.65 58.73 2k9l h GLN 78 Cb 0.44 -0.07 -0.04 0.00 0.08 0.00 0.00 27.48 27.89 2k9l h GLN 78 CO 0.03 0.22 0.38 1.96 0.09 0.00 0.00 178.83 181.51 2k9l h GLN 79 N 0.31 0.73 -0.12 0.06 1.08 -1.35 -1.63 115.11 114.19 2k9l h GLN 79 Ca 0.08 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 2k9l h GLN 79 Cb -0.02 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.23 2k9l h GLN 79 CO -0.02 0.49 -0.20 -0.91 -0.95 0.00 0.00 178.83 177.24 2k9l h ASN 80 N 0.76 0.19 0.36 1.46 2.35 -0.91 0.29 115.58 120.08 2k9l h ASN 80 Ca 0.25 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 2k9l h ASN 80 Cb 0.01 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.33 2k9l h ASN 80 CO -0.10 0.40 -0.17 0.40 -1.65 0.00 0.00 177.43 176.31 2k9l h ILE 81 N 0.18 0.61 0.00 2.81 2.04 -0.23 0.37 117.51 123.29 2k9l h ILE 81 Ca 0.03 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 2k9l h ILE 81 Cb 0.46 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2k9l h ILE 81 CO 0.03 0.09 -0.21 0.07 0.00 0.00 0.00 178.15 178.13 2k9l h LYS 82 N -0.79 0.00 0.00 2.37 2.10 -1.30 0.28 116.57 119.23 2k9l h LYS 82 Ca -0.05 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.39 2k9l h LYS 82 Cb 0.52 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.82 2k9l h LYS 82 CO 0.08 0.21 -1.08 -0.07 -2.00 0.00 0.00 179.45 176.59 2k9l h LEU 83 N 0.00 0.00 0.00 7.07 3.38 -0.84 -3.43 115.31 121.49 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 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2k9l h LEU 83 CO 0.03 0.90 0.00 -0.62 0.09 0.00 0.00 178.44 178.84 2k9l n GLU 84 N -3.25 0.00 -0.55 1.13 1.02 0.13 -5.04 120.64 114.08 2k9l n GLU 84 Ca -0.03 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.82 2k9l n GLU 84 Cb 0.92 -0.15 0.20 0.00 -0.02 0.00 0.00 31.44 32.39 2k9l n GLU 84 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2k9l n LEU 85 N -1.79 -1.82 -3.62 -4.62 7.99 0.97 -5.04 117.00 109.06 2k9l n LEU 85 Ca 0.00 -0.30 0.01 0.00 -0.01 0.00 0.00 56.01 55.71 2k9l n LEU 85 Cb 0.00 -0.95 -0.01 0.00 -0.11 0.00 0.00 43.42 42.36 2k9l n LEU 85 CO 0.00 -3.34 1.04 -1.83 -1.51 0.00 0.00 177.39 171.75 2k9l s GLU 86 N -3.76 0.44 7.94 3.23 -1.05 -1.26 -4.61 118.70 119.62 2k9l s GLU 86 Ca 0.54 -0.24 0.00 0.00 -0.15 0.00 0.00 54.97 55.13 2k9l s GLU 86 Cb -0.12 0.15 0.00 0.00 -0.44 0.00 0.00 34.13 33.72 2k9l s GLU 86 CO 0.57 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.99 2k9l n GLY 87 N -0.46 3.76 2.51 -3.83 0.00 -1.26 -2.56 105.19 103.34 2k9l n GLY 87 Ca -0.08 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 13.50 2.63 0.10 1.61 0.00 -1.26 -4.31 118.16 130.43 2k9l n LYS 88 Ca 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 58.31 55.12 2k9l n LYS 88 Cb 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 35.03 32.81 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 -0.59 0.00 0.08 1.64 1.02 -1.06 -4.79 120.64 116.94 2k9l n GLU 89 Ca 0.57 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.85 2k9l n GLU 89 Cb 0.50 -0.11 0.64 0.00 -0.02 0.00 0.00 31.44 32.45 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 0.08 0.17 3.49 3.07 -1.78 -2.12 115.11 118.02 2k9l h GLN 90 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 2k9l h GLN 90 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.54 2k9l h GLN 90 CO 0.00 0.05 -0.08 0.93 0.09 0.00 0.00 178.83 179.82 2k9l h GLU 91 N 0.08 -0.22 0.26 0.06 4.39 -1.89 0.46 114.58 117.72 2k9l h GLU 91 Ca 0.16 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 2k9l h GLU 91 Cb 0.54 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2k9l h GLU 91 CO -0.01 -0.11 -0.12 -0.07 -1.16 0.00 0.00 179.01 177.53 2k9l h LEU 92 N -0.28 -0.30 0.23 1.33 -0.00 -1.71 0.46 115.31 115.04 2k9l h LEU 92 Ca -0.02 -0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.86 2k9l h LEU 92 Cb 0.22 0.08 -0.04 0.00 -0.00 0.00 0.00 40.66 40.92 2k9l h LEU 92 CO 0.04 -0.19 -0.39 0.00 -0.00 0.00 0.00 178.44 177.90 2k9l h ALA 93 N 0.37 -0.74 -0.82 1.53 0.00 -1.41 -1.77 119.26 116.41 2k9l h ALA 93 Ca -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2k9l h ALA 93 Cb 0.28 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 2k9l h ALA 93 CO 0.06 -0.97 0.49 -0.07 0.00 0.00 0.00 179.25 178.76 2k9l h LEU 94 N -0.69 0.99 0.11 0.00 3.38 -0.87 -1.74 115.31 116.49 2k9l h LEU 94 Ca 0.00 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2k9l h LEU 94 Cb 0.67 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2k9l h LEU 94 CO -0.16 0.76 -0.43 -0.08 0.09 0.00 0.00 178.44 178.62 2k9l h GLU 95 N 1.14 -0.64 -0.63 1.13 4.81 0.49 0.97 114.58 121.84 2k9l h GLU 95 Ca 0.30 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.56 2k9l h GLU 95 Cb -0.04 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 2k9l h GLU 95 CO -0.05 -0.43 0.35 1.25 -0.73 0.00 0.00 179.01 179.40 2k9l h LEU 96 N -0.66 0.79 -0.55 1.64 5.85 -1.19 0.12 115.31 121.31 2k9l h LEU 96 Ca 0.02 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2k9l h LEU 96 Cb 0.69 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 2k9l h LEU 96 CO -0.26 0.66 0.20 0.25 -0.34 0.00 0.00 178.44 178.95 2k9l h LEU 97 N 0.86 0.19 -0.44 2.25 6.46 -0.81 0.60 115.31 124.43 2k9l h LEU 97 Ca 0.22 0.07 -0.17 0.00 -0.12 0.00 0.00 57.88 57.88 2k9l h LEU 97 Cb 0.04 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 2k9l h LEU 97 CO -0.04 0.13 -0.78 0.78 -0.62 0.00 0.00 178.44 177.91 2k9l h ASN 98 N 0.38 0.11 0.51 1.25 4.21 -0.52 -3.10 115.58 118.42 2k9l h ASN 98 Ca 0.27 -0.08 -0.06 0.00 1.21 0.00 0.00 56.30 57.64 2k9l h ASN 98 Cb 0.31 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 2k9l h ASN 98 CO -0.28 0.84 -0.28 1.88 -1.29 0.00 0.00 177.43 178.30 2k9l h TYR 99 N 0.05 0.00 -1.99 1.19 0.05 0.31 -3.44 116.97 113.15 2k9l h TYR 99 Ca -0.02 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 2k9l h TYR 99 Cb 1.37 0.00 -0.21 0.00 1.01 0.00 0.00 36.73 38.89 2k9l h TYR 99 CO 0.01 0.28 0.13 -1.17 -1.05 0.00 0.00 178.16 176.37 2k9l s LEU 100 N -7.57 -0.76 -0.12 3.88 2.96 0.10 -5.06 118.68 112.11 2k9l s LEU 100 Ca -0.02 1.44 -0.12 0.00 -0.22 0.00 0.00 54.13 55.20 2k9l s LEU 100 Cb 0.13 2.44 -0.11 0.00 0.50 0.00 0.00 46.19 49.15 2k9l s LEU 100 CO 0.67 -0.25 0.33 -0.55 -1.32 0.00 0.00 176.35 175.23 2k9l h ASN 101 N 5.14 0.00 -0.75 3.68 -1.07 -1.84 -3.36 115.58 117.39 2k9l h ASN 101 Ca -0.29 -0.43 0.16 0.00 0.07 0.00 0.00 56.30 55.81 2k9l h ASN 101 Cb 1.17 0.00 -0.11 0.00 -2.07 0.00 0.00 38.32 37.31 2k9l h ASN 101 CO 0.06 0.72 0.23 1.05 0.07 0.00 0.00 177.43 179.55 2k9l h GLU 102 N -1.00 0.32 -5.79 4.14 4.11 -1.97 -3.32 114.58 111.07 2k9l h GLU 102 Ca -0.00 -0.02 -0.61 0.00 0.07 0.00 0.00 59.36 58.80 2k9l h GLU 102 Cb 0.43 -0.07 -0.12 0.00 0.50 0.00 0.00 28.75 29.49 2k9l h GLU 102 CO -0.00 0.21 0.93 0.15 0.07 0.00 0.00 179.01 180.37 2k9l s LYS 103 N -6.03 3.30 0.00 1.06 1.02 -1.26 -3.83 119.74 114.01 2k9l s LYS 103 Ca -0.13 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.02 2k9l s LYS 103 Cb 0.21 -4.54 0.00 0.00 -0.52 0.00 0.00 37.83 32.98 2k9l s LYS 103 CO 0.76 -1.99 0.00 0.41 -0.92 0.00 0.00 175.35 173.61 2k9l n GLY 104 N 5.67 -1.73 0.24 -3.33 0.00 -1.25 -4.33 105.19 100.46 2k9l n GLY 104 Ca 0.10 0.64 -0.04 0.00 0.00 0.00 0.00 46.02 46.72 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 -0.44 -0.43 1.61 3.57 -1.79 -2.94 116.94 116.52 2k9l h PHE 105 Ca 0.00 0.05 -0.32 0.00 3.53 0.00 0.00 57.97 61.23 2k9l h PHE 105 Cb 0.00 0.26 -0.31 0.00 2.79 0.00 0.00 35.95 38.69 2k9l h PHE 105 CO 0.00 -0.26 -0.81 -0.11 -2.23 0.00 0.00 178.31 174.90 2k9l n LEU 106 N -5.38 3.40 0.00 0.59 -0.00 -1.26 -5.08 117.00 109.27 2k9l n LEU 106 Ca 0.03 -3.97 -0.23 0.00 -0.00 0.00 0.00 56.01 51.85 2k9l n LEU 106 Cb 0.29 -0.22 0.22 0.00 -0.00 0.00 0.00 43.42 43.71 2k9l n LEU 106 CO 0.10 1.59 0.26 -1.54 -0.00 0.00 0.00 177.39 177.80 2k9l n SER 107 N -0.68 -3.60 -3.20 1.96 3.41 -1.11 -4.95 113.62 105.44 2k9l n SER 107 Ca 0.28 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 2k9l n SER 107 Cb 0.88 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2k9l n SER 107 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2k9l n LYS 108 N -4.00 1.09 -1.10 4.33 4.76 -1.26 -4.89 118.16 117.09 2k9l n LYS 108 Ca 0.10 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.22 2k9l n LYS 108 Cb 0.45 0.00 0.12 0.00 -1.84 0.00 0.00 35.03 33.76 2k9l n LYS 108 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2k9l s SER 109 N -1.20 3.80 0.38 4.39 0.01 -1.26 -4.80 113.70 115.02 2k9l s SER 109 Ca 0.00 2.13 0.14 0.00 1.31 0.00 0.00 55.95 59.53 2k9l s SER 109 Cb 0.00 -2.56 0.98 0.00 0.21 0.00 0.00 66.02 64.65 2k9l s SER 109 CO 0.00 -2.51 1.82 -0.37 0.41 0.00 0.00 173.24 172.58 2k9l h VAL 110 N -1.14 0.66 -0.23 3.43 -1.51 -1.96 -0.68 116.25 114.81 2k9l h VAL 110 Ca -0.45 -0.18 0.03 0.00 -1.23 0.00 0.00 66.70 64.87 2k9l h VAL 110 Cb 1.26 0.10 -0.03 0.00 -2.13 0.00 0.00 31.29 30.50 2k9l h VAL 110 CO 0.47 0.09 0.06 -0.33 -1.23 0.00 0.00 177.57 176.64 2k9l h GLU 111 N 0.52 0.16 0.28 5.19 5.08 -1.93 -0.30 114.58 123.57 2k9l h GLU 111 Ca 0.52 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 2k9l h GLU 111 Cb 1.15 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 2k9l h GLU 111 CO -0.25 0.10 -0.47 0.93 -1.00 0.00 0.00 179.01 178.32 2k9l h GLU 112 N 0.16 -0.78 -0.34 2.33 3.07 -1.46 0.26 114.58 117.83 2k9l h GLU 112 Ca 0.10 0.05 0.06 0.00 -0.50 0.00 0.00 59.36 59.08 2k9l h GLU 112 Cb 0.09 0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 28.12 2k9l h GLU 112 CO -0.12 -0.52 -0.04 0.82 -1.40 0.00 0.00 179.01 177.74 2k9l h ILE 113 N -0.81 0.71 -0.52 3.13 2.04 -1.39 0.79 117.51 121.46 2k9l h ILE 113 Ca -0.02 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.87 2k9l h ILE 113 Cb 0.77 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.46 2k9l h ILE 113 CO -0.17 0.01 0.26 0.77 0.00 0.00 0.00 178.15 179.02 2k9l h SER 114 N 0.05 0.37 0.06 1.72 4.64 -0.71 0.16 113.55 119.84 2k9l h SER 114 Ca 0.16 0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.46 2k9l h SER 114 Cb 0.24 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2k9l h SER 114 CO -0.31 0.25 -0.16 -0.78 -0.87 0.00 0.00 176.83 174.96 2k9l h ASP 115 N 0.50 0.20 0.41 4.97 3.58 0.25 0.27 116.42 126.60 2k9l h ASP 115 Ca 0.23 -0.05 -0.21 0.00 0.42 0.00 0.00 57.03 57.42 2k9l h ASP 115 Cb 0.15 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.14 2k9l h ASP 115 CO -0.17 0.39 -0.91 0.58 -2.88 0.00 0.00 179.24 176.25 2k9l h VAL 116 N 0.20 1.43 -0.01 2.25 2.07 0.31 -3.13 116.25 119.37 2k9l h VAL 116 Ca 0.04 -2.48 0.00 0.00 0.82 0.00 0.00 66.70 65.08 2k9l h VAL 116 Cb 0.42 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 2k9l h VAL 116 CO 0.03 0.74 -0.12 -0.11 0.02 0.00 0.00 177.57 178.12 2k9l n LEU 117 N -3.72 1.49 -1.61 2.57 7.94 0.46 -4.92 117.00 119.21 2k9l n LEU 117 Ca -0.06 -0.47 -0.19 0.00 -1.11 0.00 0.00 56.01 54.18 2k9l n LEU 117 Cb 0.82 -0.04 -0.08 0.00 0.53 0.00 0.00 43.42 44.65 2k9l n LEU 117 CO 0.50 0.26 -0.19 0.54 -1.11 0.00 0.00 177.39 177.39 2k9l n ARG 118 N -0.03 -1.44 -4.02 1.96 1.74 0.87 -4.95 116.66 110.78 2k9l n ARG 118 Ca 0.16 1.11 -0.23 0.00 -0.77 0.00 0.00 57.85 58.12 2k9l n ARG 118 Cb 0.38 -5.48 -0.06 0.00 -1.02 0.00 0.00 32.46 26.28 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 -3.89 5.80 0.16 0.00 0.01 -1.26 -4.46 113.70 110.06 2k9l s SER 120 Ca 0.39 2.89 -0.11 0.00 1.31 0.00 0.00 55.95 60.44 2k9l s SER 120 Cb -0.03 -2.65 0.04 0.00 0.21 0.00 0.00 66.02 63.59 2k9l s SER 120 CO 0.24 -1.23 1.62 0.58 0.41 0.00 0.00 173.24 174.86 2k9l h VAL 121 N 2.18 1.26 -0.53 3.43 2.07 -1.90 -3.11 116.25 119.66 2k9l h VAL 121 Ca -0.51 -1.11 0.11 0.00 0.82 0.00 0.00 66.70 66.00 2k9l h VAL 121 Cb 1.27 0.89 -0.10 0.00 -1.52 0.00 0.00 31.29 31.83 2k9l h VAL 121 CO 0.61 0.40 -0.17 1.05 0.02 0.00 0.00 177.57 179.47 2k9l h GLU 122 N 0.85 -0.05 -0.66 1.57 4.11 -1.95 0.60 114.58 119.04 2k9l h GLU 122 Ca 0.16 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.65 2k9l h GLU 122 Cb 0.54 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 2k9l h GLU 122 CO 0.03 -0.03 0.37 1.49 0.07 0.00 0.00 179.01 180.93 2k9l h GLU 123 N -0.05 0.66 -0.83 1.06 4.57 -1.93 -1.20 114.58 116.85 2k9l h GLU 123 Ca 0.25 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2k9l h GLU 123 Cb 0.44 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.84 2k9l h GLU 123 CO -0.57 0.43 0.43 1.25 -1.18 0.00 0.00 179.01 179.37 2k9l h LEU 124 N 0.68 1.06 -0.69 1.64 7.12 -0.99 -1.50 115.31 122.62 2k9l h LEU 124 Ca 0.30 -0.11 -0.08 0.00 0.13 0.00 0.00 57.88 58.13 2k9l h LEU 124 Cb 0.19 -0.27 -0.03 0.00 -0.53 0.00 0.00 40.66 40.02 2k9l h LEU 124 CO -0.18 0.87 0.13 -0.33 -0.13 0.00 0.00 178.44 178.79 2k9l h GLU 125 N 1.17 1.12 0.52 1.25 5.08 -0.07 -0.84 114.58 122.82 2k9l h GLU 125 Ca 0.29 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2k9l h GLU 125 Cb 0.07 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.18 2k9l h GLU 125 CO -0.04 1.02 -0.25 0.87 -1.00 0.00 0.00 179.01 179.60 2k9l h LYS 126 N 1.05 -0.68 -0.70 2.33 1.57 -0.83 -1.24 116.57 118.07 2k9l h LYS 126 Ca 0.21 0.05 0.08 0.00 -1.87 0.00 0.00 60.65 59.11 2k9l h LYS 126 Cb 0.42 0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 2k9l h LYS 126 CO 0.01 -0.37 0.37 -0.39 -0.57 0.00 0.00 179.45 178.50 2k9l h VAL 127 N -0.95 0.90 0.40 0.50 -1.51 -1.29 0.33 116.25 114.62 2k9l h VAL 127 Ca -0.07 -0.22 -0.02 0.00 -1.23 0.00 0.00 66.70 65.16 2k9l h VAL 127 Cb 0.62 0.20 -0.00 0.00 -2.13 0.00 0.00 31.29 29.97 2k9l h VAL 127 CO 0.12 0.12 -0.22 0.03 -1.23 0.00 0.00 177.57 176.39 2k9l h ARG 128 N 0.65 -0.56 -0.91 5.19 2.47 -1.13 -1.60 114.38 118.49 2k9l h ARG 128 Ca 0.33 0.04 0.05 0.00 -1.26 0.00 0.00 59.98 59.14 2k9l h ARG 128 Cb 0.29 0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 28.68 2k9l h ARG 128 CO -0.23 -0.37 0.58 1.96 0.56 0.00 0.00 179.97 182.47 2k9l h GLN 129 N -0.58 1.06 -0.54 0.04 1.08 -0.86 0.43 115.11 115.75 2k9l h GLN 129 Ca -0.05 -0.06 0.03 0.00 -1.45 0.00 0.00 58.65 57.12 2k9l h GLN 129 Cb 0.46 -0.24 -0.04 0.00 -0.05 0.00 0.00 27.48 27.61 2k9l h GLN 129 CO 0.07 0.70 0.30 0.87 -0.95 0.00 0.00 178.83 179.82 2k9l h LYS 130 N 1.09 0.58 0.00 1.46 1.57 -0.66 0.10 116.57 120.72 2k9l h LYS 130 Ca 0.38 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2k9l h LYS 130 Cb 0.10 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2k9l h LYS 130 CO -0.15 0.38 -0.16 -0.39 -0.57 0.00 0.00 179.45 178.56 2k9l h VAL 131 N 0.60 0.00 0.00 0.50 -1.51 -0.65 -3.24 116.25 111.94 2k9l h VAL 131 Ca 0.22 -0.51 -0.21 0.00 -1.23 0.00 0.00 66.70 64.97 2k9l h VAL 131 Cb 0.07 1.40 -0.03 0.00 -2.13 0.00 0.00 31.29 30.60 2k9l h VAL 131 CO -0.12 0.00 -1.13 0.25 -1.23 0.00 0.00 177.57 175.34 2k9l h LEU 132 N 0.00 0.00 -0.28 4.19 6.46 0.89 -3.37 115.31 123.21 2k9l h LEU 132 Ca 0.00 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.79 2k9l h LEU 132 Cb 0.75 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.64 2k9l h LEU 132 CO 0.00 0.90 -0.30 0.03 -0.62 0.00 0.00 178.44 178.45 2k9l h ARG 133 N 0.00 -0.17 -0.88 1.25 3.08 -0.87 0.09 114.38 116.89 2k9l h ARG 133 Ca -0.09 0.01 0.20 0.00 0.07 0.00 0.00 59.98 60.17 2k9l h ARG 133 Cb 1.76 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 31.74 2k9l h ARG 133 CO 0.10 -0.11 0.40 -0.07 -1.07 0.00 0.00 179.97 179.22 2k9l h LEU 134 N -0.18 0.39 -1.92 3.04 -0.00 -1.78 -3.52 115.31 111.35 2k9l h LEU 134 Ca 0.05 0.13 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 2k9l h LEU 134 Cb 0.30 0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 2k9l h LEU 134 CO -0.35 0.07 0.00 -1.84 -0.00 0.00 0.00 178.44 176.32