#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 0.00 -1.17 1.64 -0.58 -1.26 -4.90 120.64 114.37 2k9l n GLU 61 Ca 0.00 0.28 -0.30 0.00 -0.42 0.00 0.00 57.16 56.72 2k9l n GLU 61 Cb 0.00 -1.01 0.24 0.00 -0.57 0.00 0.00 31.44 30.10 2k9l n GLU 61 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2k9l s THR 62 N -1.28 1.59 0.20 2.62 -4.23 -1.26 -5.07 115.64 108.20 2k9l s THR 62 Ca 0.00 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.59 2k9l s THR 62 Cb 0.00 -2.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.25 2k9l s THR 62 CO 0.00 0.00 -0.02 0.68 -0.54 0.00 0.00 174.62 174.74 2k9l s VAL 63 N -3.13 3.54 0.02 2.29 -7.23 -1.26 -5.14 120.40 109.49 2k9l s VAL 63 Ca 0.72 -1.60 -0.00 0.00 -1.81 0.00 0.00 61.98 59.29 2k9l s VAL 63 Cb -0.07 -2.80 0.00 0.00 0.56 0.00 0.00 36.38 34.07 2k9l s VAL 63 CO 0.55 -0.18 0.01 -0.81 -0.31 0.00 0.00 175.10 174.37 2k9l n PRO 64 N -0.28 -1.05 -0.00 4.82 -0.04 -1.26 -5.02 135.00 132.17 2k9l n PRO 64 Ca -0.09 -0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.36 2k9l n PRO 64 Cb 0.56 -0.02 -0.02 0.00 -0.04 0.00 0.00 33.50 33.98 2k9l n PRO 64 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2k9l n TYR 65 N -2.54 0.00 -0.54 0.54 9.36 -1.26 -4.61 117.16 118.11 2k9l n TYR 65 Ca 0.00 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.09 2k9l n TYR 65 Cb 0.01 -0.07 0.15 0.00 -0.63 0.00 0.00 39.34 38.80 2k9l n TYR 65 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2k9l n GLN 66 N -1.65 2.18 -4.60 2.98 10.64 -1.26 -4.63 117.38 121.04 2k9l n GLN 66 Ca -0.01 -2.15 -0.25 0.00 -1.83 0.00 0.00 57.00 52.77 2k9l n GLN 66 Cb 0.12 -1.87 -0.17 0.00 -0.86 0.00 0.00 30.24 27.47 2k9l n GLN 66 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2k9l s ILE 67 N -2.32 1.16 -0.02 -0.39 -1.09 -1.26 -3.69 121.20 113.59 2k9l s ILE 67 Ca 0.40 -0.49 -0.26 0.00 -2.23 0.00 0.00 60.65 58.07 2k9l s ILE 67 Cb 0.33 -1.06 -0.20 0.00 -1.58 0.00 0.00 42.46 39.95 2k9l s ILE 67 CO 0.08 0.36 1.26 1.55 -1.23 0.00 0.00 174.94 176.97 2k9l h PRO 68 N 6.97 -0.01 -3.89 2.79 0.13 -1.97 -3.48 132.00 132.55 2k9l h PRO 68 Ca -0.30 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.57 2k9l h PRO 68 Cb 1.19 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.04 2k9l h PRO 68 CO 0.47 0.48 -0.73 1.52 -0.23 0.00 0.00 178.00 179.51 2k9l s TYR 69 N -4.25 0.13 0.20 1.56 1.13 -1.24 -5.03 117.35 109.85 2k9l s TYR 69 Ca -0.16 -0.02 0.06 0.00 -1.41 0.00 0.00 57.07 55.53 2k9l s TYR 69 Cb 0.02 -0.09 -0.04 0.00 -1.10 0.00 0.00 41.96 40.75 2k9l s TYR 69 CO 0.67 -0.00 0.17 0.95 -2.51 0.00 0.00 175.55 174.83 2k9l s THR 70 N -0.01 4.54 0.23 -3.49 -4.23 -1.26 -4.97 115.64 106.45 2k9l s THR 70 Ca 0.00 -1.17 0.22 0.00 -1.18 0.00 0.00 61.69 59.56 2k9l s THR 70 Cb -0.01 -3.37 0.20 0.00 1.34 0.00 0.00 72.50 70.66 2k9l s THR 70 CO -0.00 -0.20 1.85 1.55 -0.54 0.00 0.00 174.62 177.28 2k9l h PRO 71 N 2.02 0.00 -0.02 3.99 0.13 -2.00 -2.93 132.00 133.20 2k9l h PRO 71 Ca -0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.48 2k9l h PRO 71 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k9l h PRO 71 CO 0.62 0.27 -0.74 0.77 -0.23 0.00 0.00 178.00 178.69 2k9l h SER 72 N 0.00 0.17 -0.43 1.44 0.02 -2.00 -3.23 113.55 109.52 2k9l h SER 72 Ca -0.00 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2k9l h SER 72 Cb 0.70 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.14 2k9l h SER 72 CO 0.03 0.85 0.19 -0.33 -1.14 0.00 0.00 176.83 176.43 2k9l h GLU 73 N 0.09 0.37 0.02 3.45 4.39 -1.93 0.13 114.58 121.10 2k9l h GLU 73 Ca -0.02 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.67 2k9l h GLU 73 Cb 1.30 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 2k9l h GLU 73 CO 0.11 0.25 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.03 2k9l h LEU 74 N 0.38 -0.30 -0.66 1.33 -0.00 -1.65 0.28 115.31 114.69 2k9l h LEU 74 Ca 0.19 0.04 0.03 0.00 -0.00 0.00 0.00 57.88 58.14 2k9l h LEU 74 Cb 0.14 0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 40.88 2k9l h LEU 74 CO -0.16 -0.15 0.41 -0.33 -0.00 0.00 0.00 178.44 178.20 2k9l h GLU 75 N -0.19 0.79 -0.19 1.13 4.39 -1.52 -1.12 114.58 117.87 2k9l h GLU 75 Ca 0.03 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 2k9l h GLU 75 Cb 0.23 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2k9l h GLU 75 CO -0.09 0.52 -0.25 1.49 -1.16 0.00 0.00 179.01 179.52 2k9l h GLU 76 N 0.81 0.34 0.20 2.33 4.57 -0.59 -1.46 114.58 120.79 2k9l h GLU 76 Ca 0.26 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 2k9l h GLU 76 Cb 0.01 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 2k9l h GLU 76 CO -0.10 0.57 -0.10 1.25 -1.18 0.00 0.00 179.01 179.46 2k9l h LEU 77 N 0.31 -0.23 -0.47 1.64 7.12 0.37 -1.22 115.31 122.83 2k9l h LEU 77 Ca 0.05 -0.23 -0.00 0.00 0.13 0.00 0.00 57.88 57.82 2k9l h LEU 77 Cb 0.61 0.06 -0.02 0.00 -0.53 0.00 0.00 40.66 40.77 2k9l h LEU 77 CO 0.04 0.13 0.28 0.06 -0.13 0.00 0.00 178.44 178.82 2k9l h GLN 78 N -0.61 0.64 -0.51 1.25 3.07 -1.20 -0.86 115.11 116.90 2k9l h GLN 78 Ca -0.03 -0.06 0.02 0.00 0.09 0.00 0.00 58.65 58.67 2k9l h GLN 78 Cb 0.45 -0.13 -0.03 0.00 0.08 0.00 0.00 27.48 27.84 2k9l h GLN 78 CO 0.05 0.47 0.31 1.96 0.09 0.00 0.00 178.83 181.71 2k9l h GLN 79 N 0.63 0.61 -0.09 0.06 1.08 -1.28 -1.78 115.11 114.33 2k9l h GLN 79 Ca 0.17 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.26 2k9l h GLN 79 Cb 0.00 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 2k9l h GLN 79 CO -0.03 0.40 -0.26 -0.91 -0.95 0.00 0.00 178.83 177.08 2k9l h ASN 80 N 0.63 0.16 0.46 1.46 2.35 -0.94 0.01 115.58 119.71 2k9l h ASN 80 Ca 0.20 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.88 2k9l h ASN 80 Cb -0.00 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.33 2k9l h ASN 80 CO -0.08 0.42 -0.22 0.40 -1.65 0.00 0.00 177.43 176.30 2k9l h ILE 81 N 0.15 0.47 0.00 2.81 2.04 -0.35 0.34 117.51 122.97 2k9l h ILE 81 Ca 0.02 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 2k9l h ILE 81 Cb 0.54 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2k9l h ILE 81 CO 0.04 0.06 -0.17 0.07 0.00 0.00 0.00 178.15 178.15 2k9l h LYS 82 N -0.87 0.00 0.00 2.37 2.10 -1.32 0.35 116.57 119.20 2k9l h LYS 82 Ca -0.06 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.41 2k9l h LYS 82 Cb 0.58 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.88 2k9l h LYS 82 CO 0.10 0.17 -0.96 -0.07 -2.00 0.00 0.00 179.45 176.69 2k9l h LEU 83 N 0.00 0.00 0.00 7.07 3.38 -0.87 -3.42 115.31 121.47 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 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 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 -3.22 0.00 -0.49 1.13 1.02 0.12 -5.04 120.64 114.16 2k9l n GLU 84 Ca -0.02 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.86 2k9l n GLU 84 Cb 0.87 -0.21 0.20 0.00 -0.02 0.00 0.00 31.44 32.28 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 -2.01 -1.47 0.00 -4.62 7.99 0.12 -5.04 117.00 111.97 2k9l n LEU 85 Ca 0.00 -0.41 0.02 0.00 -0.01 0.00 0.00 56.01 55.62 2k9l n LEU 85 Cb 0.00 -0.93 0.01 0.00 -0.11 0.00 0.00 43.42 42.40 2k9l n LEU 85 CO 0.00 -3.53 1.02 -1.84 -1.51 0.00 0.00 177.39 171.53 2k9l n GLU 86 N -3.14 0.21 0.00 3.23 0.28 -1.26 -4.64 120.64 115.32 2k9l n GLU 86 Ca 0.06 -0.79 0.00 0.00 -0.16 0.00 0.00 57.16 56.26 2k9l n GLU 86 Cb 0.51 1.28 0.00 0.00 1.43 0.00 0.00 31.44 34.65 2k9l n GLU 86 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2k9l n GLY 87 N -0.86 2.60 2.71 -1.84 0.00 -1.26 -1.58 105.19 104.96 2k9l n GLY 87 Ca 0.04 0.33 -0.35 0.00 0.00 0.00 0.00 46.02 46.04 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 6.80 2.96 0.09 1.61 0.00 -1.26 -4.43 118.16 123.93 2k9l n LYS 88 Ca 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 58.31 54.53 2k9l n LYS 88 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 35.03 32.76 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 -0.57 0.00 0.19 1.64 1.02 -0.61 -4.82 120.64 117.49 2k9l n GLU 89 Ca 0.51 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.69 2k9l n GLU 89 Cb 0.42 -0.04 0.47 0.00 -0.02 0.00 0.00 31.44 32.26 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 0.09 -0.42 3.49 3.07 -1.80 -2.49 115.11 117.05 2k9l h GLN 90 Ca 0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 58.65 58.71 2k9l h GLN 90 Cb 0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.56 2k9l h GLN 90 CO 0.00 0.24 0.20 1.05 0.09 0.00 0.00 178.83 180.41 2k9l h GLU 91 N 0.09 0.60 0.30 0.06 4.11 -1.87 -0.43 114.58 117.44 2k9l h GLU 91 Ca 0.02 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 2k9l h GLU 91 Cb 0.32 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2k9l h GLU 91 CO 0.02 0.53 -0.14 -0.07 0.07 0.00 0.00 179.01 179.42 2k9l h LEU 92 N 0.53 -0.34 -0.25 3.06 3.38 -1.80 0.99 115.31 120.88 2k9l h LEU 92 Ca 0.14 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.01 2k9l h LEU 92 Cb 0.13 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2k9l h LEU 92 CO -0.02 -0.01 -0.15 0.00 0.09 0.00 0.00 178.44 178.35 2k9l h ALA 93 N -0.11 0.03 -0.41 1.53 0.00 -1.44 -1.28 119.26 117.59 2k9l h ALA 93 Ca -0.04 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2k9l h ALA 93 Cb 0.48 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2k9l h ALA 93 CO 0.07 -0.56 0.01 -0.07 0.00 0.00 0.00 179.25 178.69 2k9l h LEU 94 N -0.13 0.62 0.48 0.00 3.38 -1.10 -1.54 115.31 117.02 2k9l h LEU 94 Ca 0.14 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2k9l h LEU 94 Cb 0.34 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2k9l h LEU 94 CO -0.33 0.68 -0.48 -0.33 0.09 0.00 0.00 178.44 178.07 2k9l h GLU 95 N 0.62 -0.93 -0.53 1.13 3.07 0.33 0.20 114.58 118.47 2k9l h GLU 95 Ca 0.13 0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 59.03 2k9l h GLU 95 Cb 0.38 0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.48 2k9l h GLU 95 CO 0.01 -0.62 0.24 1.25 -1.40 0.00 0.00 179.01 178.49 2k9l h LEU 96 N -0.97 0.71 0.13 1.33 5.85 -1.32 0.77 115.31 121.81 2k9l h LEU 96 Ca -0.06 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.54 2k9l h LEU 96 Cb 0.85 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 2k9l h LEU 96 CO -0.06 0.65 -0.30 0.25 -0.34 0.00 0.00 178.44 178.64 2k9l h LEU 97 N 0.71 -0.85 -1.32 2.25 6.46 -1.06 0.46 115.31 121.96 2k9l h LEU 97 Ca 0.18 0.10 -0.07 0.00 -0.12 0.00 0.00 57.88 57.97 2k9l h LEU 97 Cb 0.14 0.32 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 2k9l h LEU 97 CO -0.02 -0.39 -0.30 0.78 -0.62 0.00 0.00 178.44 177.89 2k9l h ASN 98 N -0.52 0.07 0.04 1.25 4.21 -0.51 -2.49 115.58 117.61 2k9l h ASN 98 Ca 0.03 -0.02 -0.08 0.00 1.21 0.00 0.00 56.30 57.43 2k9l h ASN 98 Cb 0.55 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.72 2k9l h ASN 98 CO -0.17 0.37 -0.25 1.88 -1.29 0.00 0.00 177.43 177.97 2k9l h TYR 99 N 0.06 0.39 -0.98 1.19 0.05 -0.02 -3.41 116.97 114.25 2k9l h TYR 99 Ca 0.01 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 58.75 2k9l h TYR 99 Cb 0.56 -0.10 -0.21 0.00 1.01 0.00 0.00 36.73 37.99 2k9l h TYR 99 CO 0.00 0.58 -0.36 -1.17 -1.05 0.00 0.00 178.16 176.16 2k9l s LEU 100 N -8.60 -1.60 0.20 3.88 2.96 0.08 -5.04 118.68 110.57 2k9l s LEU 100 Ca -0.06 0.23 -0.12 0.00 -0.22 0.00 0.00 54.13 53.97 2k9l s LEU 100 Cb 0.14 2.03 0.25 0.00 0.50 0.00 0.00 46.19 49.11 2k9l s LEU 100 CO 0.77 -0.29 1.69 -0.55 -1.32 0.00 0.00 176.35 176.64 2k9l h ASN 101 N 7.98 -0.15 -0.57 3.68 -1.07 -1.72 0.24 115.58 123.97 2k9l h ASN 101 Ca -0.03 0.12 0.17 0.00 0.07 0.00 0.00 56.30 56.63 2k9l h ASN 101 Cb 1.19 0.20 -0.02 0.00 -2.07 0.00 0.00 38.32 37.62 2k9l h ASN 101 CO 0.15 -0.05 0.47 -0.08 0.07 0.00 0.00 177.43 177.99 2k9l h GLU 102 N 0.16 0.00 -3.68 4.14 4.57 -1.95 -3.23 114.58 114.59 2k9l h GLU 102 Ca 0.29 0.00 -0.79 0.00 -1.18 0.00 0.00 59.36 57.68 2k9l h GLU 102 Cb 0.44 0.00 -0.28 0.00 -0.16 0.00 0.00 28.75 28.75 2k9l h GLU 102 CO -0.44 0.00 0.21 0.15 -1.18 0.00 0.00 179.01 177.75 2k9l s LYS 103 N -4.83 3.79 0.00 1.92 3.01 0.84 -4.20 119.74 120.26 2k9l s LYS 103 Ca -0.05 -2.82 0.00 0.00 -1.01 0.00 0.00 55.97 52.09 2k9l s LYS 103 Cb 0.18 -4.42 0.00 0.00 -1.01 0.00 0.00 37.83 32.58 2k9l s LYS 103 CO 0.66 -1.26 0.00 0.41 0.51 0.00 0.00 175.35 175.67 2k9l n GLY 104 N 3.35 -2.11 0.25 -3.33 0.00 -1.22 -4.23 105.19 97.89 2k9l n GLY 104 Ca 0.18 0.76 0.03 0.00 0.00 0.00 0.00 46.02 46.99 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 0.06 -0.01 1.61 3.57 -1.85 -2.21 116.94 118.12 2k9l h PHE 105 Ca 0.00 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 2k9l h PHE 105 Cb 0.00 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.81 2k9l h PHE 105 CO 0.00 -0.14 -0.28 -0.11 -2.23 0.00 0.00 178.31 175.55 2k9l n LEU 106 N -5.24 2.59 -4.24 0.59 -0.00 -1.26 -5.07 117.00 104.37 2k9l n LEU 106 Ca 0.11 -3.55 -0.30 0.00 -0.00 0.00 0.00 56.01 52.27 2k9l n LEU 106 Cb 0.40 -0.49 0.18 0.00 -0.00 0.00 0.00 43.42 43.50 2k9l n LEU 106 CO 0.11 1.10 -0.44 -0.24 -0.00 0.00 0.00 177.39 177.92 2k9l n SER 107 N -1.25 -2.52 -3.17 1.96 2.88 -0.83 -4.98 113.62 105.70 2k9l n SER 107 Ca 0.18 -0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2k9l n SER 107 Cb 0.68 -0.93 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 2k9l n SER 107 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2k9l n LYS 108 N -2.19 0.41 -1.15 -1.46 4.76 -1.26 -4.88 118.16 112.38 2k9l n LYS 108 Ca 0.02 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.14 2k9l n LYS 108 Cb 0.59 0.00 0.11 0.00 -1.84 0.00 0.00 35.03 33.89 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 -1.48 3.93 0.39 4.39 0.01 -1.26 -4.80 113.70 114.88 2k9l s SER 109 Ca 0.00 2.09 0.15 0.00 1.31 0.00 0.00 55.95 59.50 2k9l s SER 109 Cb 0.00 -2.56 1.01 0.00 0.21 0.00 0.00 66.02 64.68 2k9l s SER 109 CO 0.00 -2.43 1.83 -0.37 0.41 0.00 0.00 173.24 172.68 2k9l h VAL 110 N -1.08 0.66 -0.69 3.43 -1.51 -1.97 0.27 116.25 115.36 2k9l h VAL 110 Ca -0.45 -0.17 0.04 0.00 -1.23 0.00 0.00 66.70 64.90 2k9l h VAL 110 Cb 1.26 0.13 -0.05 0.00 -2.13 0.00 0.00 31.29 30.50 2k9l h VAL 110 CO 0.48 0.09 0.41 -0.33 -1.23 0.00 0.00 177.57 176.99 2k9l h GLU 111 N 0.49 0.77 0.88 5.19 5.08 -1.94 0.40 114.58 125.45 2k9l h GLU 111 Ca 0.51 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.79 2k9l h GLU 111 Cb 1.16 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2k9l h GLU 111 CO -0.24 0.51 -0.47 0.93 -1.00 0.00 0.00 179.01 178.74 2k9l h GLU 112 N 0.79 -1.19 -0.57 2.33 4.39 -1.28 -0.55 114.58 118.51 2k9l h GLU 112 Ca 0.29 0.08 0.09 0.00 0.34 0.00 0.00 59.36 60.16 2k9l h GLU 112 Cb 0.10 0.27 -0.07 0.00 -0.10 0.00 0.00 28.75 28.95 2k9l h GLU 112 CO -0.14 -0.79 0.19 0.82 -1.16 0.00 0.00 179.01 177.92 2k9l h ILE 113 N -1.24 0.76 -0.67 3.13 2.04 -1.40 -0.83 117.51 119.31 2k9l h ILE 113 Ca -0.12 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.69 2k9l h ILE 113 Cb 0.96 0.38 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 2k9l h ILE 113 CO 0.17 0.06 0.36 -1.28 0.00 0.00 0.00 178.15 177.47 2k9l h SER 114 N 0.35 0.52 -0.70 1.72 0.87 -0.81 0.28 113.55 115.79 2k9l h SER 114 Ca 0.28 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2k9l h SER 114 Cb 0.35 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 2k9l h SER 114 CO -0.31 0.33 0.20 -0.78 -0.53 0.00 0.00 176.83 175.75 2k9l h ASP 115 N 0.65 1.03 0.25 6.23 3.58 -0.08 0.27 116.42 128.35 2k9l h ASP 115 Ca 0.31 -0.22 -0.13 0.00 0.42 0.00 0.00 57.03 57.41 2k9l h ASP 115 Cb 0.23 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 2k9l h ASP 115 CO -0.20 0.97 -0.50 0.58 -2.88 0.00 0.00 179.24 177.21 2k9l h VAL 116 N 1.03 1.34 -0.00 2.25 2.07 -0.33 -2.76 116.25 119.85 2k9l h VAL 116 Ca 0.22 -1.74 0.00 0.00 0.82 0.00 0.00 66.70 66.00 2k9l h VAL 116 Cb 0.32 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2k9l h VAL 116 CO -0.00 0.52 -0.27 -0.11 0.02 0.00 0.00 177.57 177.73 2k9l n LEU 117 N -3.95 0.71 -1.43 2.57 -0.00 0.90 -4.91 117.00 110.88 2k9l n LEU 117 Ca -0.02 -0.09 -0.18 0.00 -0.00 0.00 0.00 56.01 55.71 2k9l n LEU 117 Cb 0.55 -0.19 -0.08 0.00 -0.00 0.00 0.00 43.42 43.70 2k9l n LEU 117 CO 0.43 0.14 -0.18 0.54 -0.00 0.00 0.00 177.39 178.33 2k9l n ARG 118 N -0.98 -1.52 -4.08 1.96 3.00 0.86 -4.95 116.66 110.95 2k9l n ARG 118 Ca 0.11 1.14 -0.23 0.00 -0.01 0.00 0.00 57.85 58.86 2k9l n ARG 118 Cb 0.33 -5.54 -0.06 0.00 0.00 0.00 0.00 32.46 27.19 2k9l n ARG 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k9l s SER 120 N -3.86 6.10 0.35 0.00 0.01 -1.26 -4.47 113.70 110.57 2k9l s SER 120 Ca 0.38 2.65 0.03 0.00 1.31 0.00 0.00 55.95 60.32 2k9l s SER 120 Cb -0.02 -2.63 0.65 0.00 0.21 0.00 0.00 66.02 64.22 2k9l s SER 120 CO 0.23 -0.99 1.96 0.58 0.41 0.00 0.00 173.24 175.43 2k9l h VAL 121 N 2.22 1.17 -0.57 3.43 2.07 -1.91 -2.71 116.25 119.95 2k9l h VAL 121 Ca -0.50 -0.46 0.11 0.00 0.82 0.00 0.00 66.70 66.68 2k9l h VAL 121 Cb 1.26 0.53 -0.09 0.00 -1.52 0.00 0.00 31.29 31.46 2k9l h VAL 121 CO 0.61 0.19 0.01 1.05 0.02 0.00 0.00 177.57 179.46 2k9l h GLU 122 N 0.69 0.13 -0.00 1.57 4.11 -1.96 0.28 114.58 119.39 2k9l h GLU 122 Ca 0.17 -0.01 -0.00 0.00 0.07 0.00 0.00 59.36 59.60 2k9l h GLU 122 Cb 0.07 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 2k9l h GLU 122 CO -0.02 0.08 0.00 1.49 0.07 0.00 0.00 179.01 180.63 2k9l h GLU 123 N 0.13 0.01 -0.93 1.06 4.22 -1.87 -1.11 114.58 116.08 2k9l h GLU 123 Ca 0.29 -0.00 0.08 0.00 0.08 0.00 0.00 59.36 59.81 2k9l h GLU 123 Cb 0.46 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 2k9l h GLU 123 CO -0.47 0.18 0.60 1.25 -2.18 0.00 0.00 179.01 178.39 2k9l h LEU 124 N -0.17 0.91 -0.27 1.64 7.12 -1.23 -1.18 115.31 122.14 2k9l h LEU 124 Ca 0.00 0.01 -0.06 0.00 0.13 0.00 0.00 57.88 57.97 2k9l h LEU 124 Cb 0.18 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.12 2k9l h LEU 124 CO -0.00 0.57 -0.07 -0.08 -0.13 0.00 0.00 178.44 178.73 2k9l h GLU 125 N 1.03 0.52 0.25 1.25 4.81 -0.27 -0.86 114.58 121.31 2k9l h GLU 125 Ca 0.41 -0.20 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2k9l h GLU 125 Cb 0.26 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2k9l h GLU 125 CO -0.17 0.73 -0.20 0.87 -0.73 0.00 0.00 179.01 179.51 2k9l h LYS 126 N 0.27 -0.44 -0.88 1.92 1.57 -0.54 0.14 116.57 118.60 2k9l h LYS 126 Ca 0.07 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2k9l h LYS 126 Cb 0.54 0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.91 2k9l h LYS 126 CO 0.03 -0.30 0.52 -0.39 -0.57 0.00 0.00 179.45 178.74 2k9l h VAL 127 N -0.46 1.25 -0.43 0.50 -1.51 -1.27 -0.11 116.25 114.21 2k9l h VAL 127 Ca -0.01 -0.56 -0.02 0.00 -1.23 0.00 0.00 66.70 64.87 2k9l h VAL 127 Cb 0.41 0.02 -0.02 0.00 -2.13 0.00 0.00 31.29 29.57 2k9l h VAL 127 CO -0.01 0.26 0.18 0.03 -1.23 0.00 0.00 177.57 176.80 2k9l h ARG 128 N 1.22 0.64 -0.13 5.19 2.47 -0.84 -0.99 114.38 121.95 2k9l h ARG 128 Ca 0.32 -0.11 -0.10 0.00 -1.26 0.00 0.00 59.98 58.82 2k9l h ARG 128 Cb -0.03 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.17 2k9l h ARG 128 CO -0.06 0.58 -0.36 1.96 0.56 0.00 0.00 179.97 182.65 2k9l h GLN 129 N 0.55 0.26 -0.21 0.04 1.08 -0.40 0.33 115.11 116.76 2k9l h GLN 129 Ca 0.14 -0.11 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 2k9l h GLN 129 Cb 0.18 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 2k9l h GLN 129 CO -0.01 0.60 -0.47 0.87 -0.95 0.00 0.00 178.83 178.86 2k9l h LYS 130 N 0.22 0.55 0.00 1.46 1.57 -0.68 0.69 116.57 120.38 2k9l h LYS 130 Ca 0.03 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2k9l h LYS 130 Cb 0.75 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.08 2k9l h LYS 130 CO 0.06 0.90 -0.84 -0.39 -0.57 0.00 0.00 179.45 178.61 2k9l h VAL 131 N 0.44 0.00 0.00 0.50 -1.51 -0.97 -3.34 116.25 111.37 2k9l h VAL 131 Ca 0.02 -0.85 -0.22 0.00 -1.23 0.00 0.00 66.70 64.42 2k9l h VAL 131 Cb 0.99 1.40 -0.04 0.00 -2.13 0.00 0.00 31.29 31.51 2k9l h VAL 131 CO 0.09 0.00 -1.45 0.25 -1.23 0.00 0.00 177.57 175.23 2k9l h LEU 132 N 0.00 0.00 -1.92 4.19 5.85 -0.25 -3.34 115.31 119.84 2k9l h LEU 132 Ca 0.00 0.00 0.25 0.00 0.84 0.00 0.00 57.88 58.97 2k9l h LEU 132 Cb 0.93 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 2k9l h LEU 132 CO 0.00 0.79 0.62 0.08 -0.34 0.00 0.00 178.44 179.60 2k9l h ARG 133 N 0.00 0.06 -0.45 1.25 0.11 -0.98 0.55 114.38 114.92 2k9l h ARG 133 Ca -0.19 -0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.87 2k9l h ARG 133 Cb 1.78 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 32.82 2k9l h ARG 133 CO 0.07 0.04 0.23 -0.07 0.10 0.00 0.00 179.97 180.33 2k9l h LEU 134 N 0.06 0.59 -1.61 0.08 4.07 -1.78 -3.52 115.31 113.20 2k9l h LEU 134 Ca 0.42 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.27 2k9l h LEU 134 Cb 1.60 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 43.18 2k9l h LEU 134 CO -0.03 0.54 0.00 -1.84 -1.08 0.00 0.00 178.44 176.03