#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3j n LEU 46 N 0.00 0.43 -4.71 0.99 -0.00 -1.26 -4.94 117.00 107.51 2k3j n LEU 46 Ca 0.00 -0.03 -0.35 0.00 -0.00 0.00 0.00 56.01 55.64 2k3j n LEU 46 Cb 0.00 -0.03 -0.09 0.00 -0.00 0.00 0.00 43.42 43.30 2k3j n LEU 46 CO 0.00 0.02 -0.29 -0.63 -0.00 0.00 0.00 177.39 176.49 2k3j s ILE 47 N -3.34 4.42 0.46 1.47 -1.09 -1.26 -1.25 121.20 120.61 2k3j s ILE 47 Ca -0.02 -0.26 -0.04 0.00 -2.23 0.00 0.00 60.65 58.11 2k3j s ILE 47 Cb 0.14 -2.89 -0.03 0.00 -1.58 0.00 0.00 42.46 38.10 2k3j s ILE 47 CO 0.86 0.56 0.73 -0.76 -1.23 0.00 0.00 174.94 175.11 2k3j s LEU 48 N -1.03 3.68 0.48 2.97 1.43 0.62 -4.89 118.68 121.94 2k3j s LEU 48 Ca 0.15 0.75 0.32 0.00 -1.03 0.00 0.00 54.13 54.33 2k3j s LEU 48 Cb -0.11 -3.67 1.56 0.00 0.03 0.00 0.00 46.19 43.99 2k3j s LEU 48 CO 0.04 -0.57 1.98 1.55 0.23 0.00 0.00 176.35 179.58 2k3j h PRO 49 N 0.32 0.00 -0.26 1.29 0.13 -2.01 -0.03 132.00 131.44 2k3j h PRO 49 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2k3j h PRO 49 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2k3j h PRO 49 CO 0.61 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.65 2k3j n ASN 50 N -2.75 1.65 0.00 1.44 6.94 -1.26 -4.95 115.26 116.33 2k3j n ASN 50 Ca -0.01 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 2k3j n ASN 50 Cb 0.17 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2k3j n ASN 50 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2k3j n GLY 51 N 1.05 1.06 3.92 4.83 0.00 -0.03 -5.05 105.19 110.97 2k3j n GLY 51 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 2k3j n GLY 51 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2k3j s ASN 52 N -3.07 4.92 0.04 1.61 3.84 -1.26 -4.77 114.94 116.25 2k3j s ASN 52 Ca 0.00 0.58 -0.16 0.00 0.21 0.00 0.00 52.86 53.49 2k3j s ASN 52 Cb 0.00 -1.27 -0.06 0.00 -0.55 0.00 0.00 41.25 39.37 2k3j s ASN 52 CO 0.00 -1.55 0.48 -0.63 -2.79 0.00 0.00 177.10 172.61 2k3j s ILE 53 N -3.27 4.90 -0.76 -5.21 1.01 -1.26 -0.27 121.20 116.35 2k3j s ILE 53 Ca 0.59 0.98 -0.26 0.00 0.00 0.00 0.00 60.65 61.96 2k3j s ILE 53 Cb -0.11 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.60 2k3j s ILE 53 CO 0.46 0.55 1.38 0.21 0.00 0.00 0.00 174.94 177.53 2k3j s ASN 54 N -1.14 6.07 -0.03 3.58 3.84 -0.38 -4.86 114.94 122.02 2k3j s ASN 54 Ca 0.27 -0.46 0.10 0.00 0.21 0.00 0.00 52.86 52.97 2k3j s ASN 54 Cb -0.18 -2.56 0.33 0.00 -0.55 0.00 0.00 41.25 38.30 2k3j s ASN 54 CO 0.16 -1.88 1.22 0.79 -2.79 0.00 0.00 177.10 174.60 2k3j n TRP 55 N 9.80 0.60 -0.01 0.43 5.03 -1.26 -3.88 117.44 128.15 2k3j n TRP 55 Ca 0.09 -0.26 0.00 0.00 3.03 0.00 0.00 57.50 60.35 2k3j n TRP 55 Cb 0.50 -0.07 0.00 0.00 -1.03 0.00 0.00 31.31 30.70 2k3j n TRP 55 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2k3j n ASN 56 N 0.48 0.02 -4.70 -0.99 4.13 -1.26 -4.12 115.26 108.82 2k3j n ASN 56 Ca 0.12 -0.40 -0.40 0.00 1.68 0.00 0.00 54.58 55.58 2k3j n ASN 56 Cb 0.40 0.75 0.02 0.00 -1.54 0.00 0.00 39.78 39.41 2k3j n ASN 56 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k3j n PRO 58 N -0.29 2.61 0.02 0.00 -0.04 -1.26 -1.17 135.00 134.86 2k3j n PRO 58 Ca 0.08 -1.54 0.00 0.00 -0.04 0.00 0.00 63.50 62.00 2k3j n PRO 58 Cb 0.41 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 2k3j n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k3j h LEU 60 N 0.00 0.00 0.21 0.00 5.85 -1.82 -2.82 115.31 116.73 2k3j h LEU 60 Ca 0.00 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.45 2k3j h LEU 60 Cb 0.00 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.06 2k3j h LEU 60 CO 0.00 0.12 -1.20 1.23 -0.34 0.00 0.00 178.44 178.25 2k3j h GLY 61 N 0.96 0.51 0.87 3.75 0.00 -1.26 -3.35 103.07 104.56 2k3j h GLY 61 Ca -0.00 -1.30 -0.03 0.00 0.00 0.00 0.00 47.33 46.00 2k3j h GLY 61 CO 0.02 1.13 0.04 -1.33 0.00 0.00 0.00 176.54 176.40 2k3j h GLY 62 N -0.07 0.50 2.00 4.60 0.00 -1.69 -2.12 103.07 106.28 2k3j h GLY 62 Ca -0.21 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2k3j h GLY 62 CO 0.22 0.31 0.00 1.98 0.00 0.00 0.00 176.54 179.05 2k3j h MET 63 N 0.27 0.00 -0.38 4.80 -1.53 -1.73 -2.18 114.93 114.18 2k3j h MET 63 Ca 0.08 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.34 2k3j h MET 63 Cb 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.40 2k3j h MET 63 CO 0.01 0.00 0.00 0.00 0.14 0.00 0.00 176.91 177.06 2k3j n ALA 64 N -2.02 2.45 -2.74 0.39 0.00 -0.81 -4.76 120.51 113.02 2k3j n ALA 64 Ca -0.02 -0.85 -0.26 0.00 0.00 0.00 0.00 53.44 52.31 2k3j n ALA 64 Cb 0.11 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 2k3j n ALA 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k3j s SER 65 N -1.35 5.19 0.00 0.00 0.15 -0.82 -4.41 113.70 112.46 2k3j s SER 65 Ca 0.36 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.76 2k3j s SER 65 Cb 0.20 -1.25 0.00 0.00 -1.71 0.00 0.00 66.02 63.26 2k3j s SER 65 CO 0.28 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.40 2k3j n GLY 66 N -0.32 -2.66 0.19 9.45 0.00 -1.26 -4.42 105.19 106.18 2k3j n GLY 66 Ca -0.09 -1.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 2k3j n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3j h PRO 67 N 0.00 0.60 0.00 1.61 0.13 -2.01 -2.50 132.00 129.83 2k3j h PRO 67 Ca 0.00 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2k3j h PRO 67 Cb 0.00 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.05 2k3j h PRO 67 CO 0.00 0.65 0.00 0.00 -0.23 0.00 0.00 178.00 178.42 2k3j h GLY 69 N 0.48 0.89 0.29 0.00 0.00 -1.65 -2.01 103.07 101.07 2k3j h GLY 69 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 2k3j h GLY 69 CO 0.00 -0.19 0.61 1.05 0.00 0.00 0.00 176.54 178.01 2k3j h GLU 70 N 0.22 0.72 0.04 4.80 4.11 -1.83 0.28 114.58 122.92 2k3j h GLU 70 Ca 0.38 -0.04 -0.24 0.00 0.07 0.00 0.00 59.36 59.53 2k3j h GLU 70 Cb 0.63 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2k3j h GLU 70 CO -0.51 0.47 -1.15 1.96 0.07 0.00 0.00 179.01 179.86 2k3j h GLN 71 N 0.74 0.09 -0.11 1.06 1.08 -1.67 -0.60 115.11 115.70 2k3j h GLN 71 Ca 0.52 -0.15 -0.18 0.00 -1.45 0.00 0.00 58.65 57.39 2k3j h GLN 71 Cb 0.84 0.06 0.01 0.00 -0.05 0.00 0.00 27.48 28.33 2k3j h GLN 71 CO -0.29 1.03 -0.65 0.35 -0.95 0.00 0.00 178.83 178.32 2k3j h PHE 72 N 0.02 0.86 -0.29 2.96 3.57 -1.40 -0.84 116.94 121.82 2k3j h PHE 72 Ca -0.08 -0.39 0.06 0.00 3.53 0.00 0.00 57.97 61.10 2k3j h PHE 72 Cb 1.86 -0.13 -0.08 0.00 2.79 0.00 0.00 35.95 40.39 2k3j h PHE 72 CO 0.02 1.20 -0.37 0.87 -2.23 0.00 0.00 178.31 177.79 2k3j h LYS 73 N 0.28 -0.34 -0.36 1.11 1.79 -0.96 -1.48 116.57 116.61 2k3j h LYS 73 Ca -0.05 0.02 -0.14 0.00 -2.18 0.00 0.00 60.65 58.30 2k3j h LYS 73 Cb 1.29 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 32.01 2k3j h LYS 73 CO 0.13 -0.23 -0.34 1.03 -1.08 0.00 0.00 179.45 178.96 2k3j h SER 74 N -0.35 0.85 0.14 0.86 0.87 -1.13 -0.07 113.55 114.71 2k3j h SER 74 Ca 0.13 -0.36 -0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2k3j h SER 74 Cb 0.57 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2k3j h SER 74 CO -0.48 1.11 -0.09 0.00 -0.53 0.00 0.00 176.83 176.84 2k3j h ALA 75 N 0.94 -0.22 -0.39 6.23 0.00 -0.95 -0.19 119.26 124.68 2k3j h ALA 75 Ca 0.07 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2k3j h ALA 75 Cb 0.89 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2k3j h ALA 75 CO 0.08 -0.63 -0.30 0.74 0.00 0.00 0.00 179.25 179.14 2k3j h PHE 76 N -0.23 0.99 0.72 0.00 -1.00 -1.24 -2.40 116.94 113.79 2k3j h PHE 76 Ca -0.01 -0.26 -0.03 0.00 2.81 0.00 0.00 57.97 60.48 2k3j h PHE 76 Cb 0.20 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 39.54 2k3j h PHE 76 CO -0.09 1.04 -0.37 1.03 -1.61 0.00 0.00 178.31 178.30 2k3j h SER 77 N 0.72 -0.91 -0.86 2.17 0.87 -0.92 -0.57 113.55 114.04 2k3j h SER 77 Ca 0.08 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.72 2k3j h SER 77 Cb 0.85 0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 63.01 2k3j h SER 77 CO 0.08 -0.62 0.55 0.00 -0.53 0.00 0.00 176.83 176.31 2k3j h PHE 79 N 1.05 0.92 0.46 0.00 3.57 -1.39 -0.39 116.94 121.16 2k3j h PHE 79 Ca 0.35 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.81 2k3j h PHE 79 Cb 0.06 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.51 2k3j h PHE 79 CO -0.02 0.65 -0.22 1.25 -2.23 0.00 0.00 178.31 177.74 2k3j h HIS 80 N 0.92 -0.58 0.00 0.41 2.76 -0.24 -2.61 115.15 115.81 2k3j h HIS 80 Ca 0.24 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2k3j h HIS 80 Cb 0.03 0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.18 2k3j h HIS 80 CO -0.01 -0.34 0.00 0.66 -1.30 0.00 0.00 177.93 176.94 2k3j n TYR 81 N -5.35 0.43 0.10 5.26 4.01 -0.40 -2.30 117.16 118.91 2k3j n TYR 81 Ca -0.11 0.18 -0.22 0.00 -0.16 0.00 0.00 57.90 57.58 2k3j n TYR 81 Cb 0.27 -0.79 -0.15 0.00 -0.31 0.00 0.00 39.34 38.36 2k3j n TYR 81 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2k3j h SER 82 N 0.00 0.66 -0.79 7.72 0.87 -0.86 -3.49 113.55 117.66 2k3j h SER 82 Ca 0.00 -0.94 -0.34 0.00 -1.23 0.00 0.00 61.79 59.28 2k3j h SER 82 Cb 0.25 -0.22 -0.13 0.00 -0.44 0.00 0.00 62.40 61.86 2k3j h SER 82 CO 0.00 1.55 -0.31 0.35 -0.53 0.00 0.00 176.83 177.90 2k3j n THR 83 N -3.93 0.00 -2.04 2.23 -2.24 -0.97 -5.02 114.28 102.31 2k3j n THR 83 Ca -0.15 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.35 2k3j n THR 83 Cb 0.96 -1.76 0.07 0.00 -2.10 0.00 0.00 70.33 67.50 2k3j n THR 83 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2k3j s GLU 84 N -3.39 2.25 0.16 -0.78 2.02 -1.26 -5.04 118.70 112.66 2k3j s GLU 84 Ca 0.00 0.03 0.12 0.00 0.02 0.00 0.00 54.97 55.14 2k3j s GLU 84 Cb 0.00 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 32.08 2k3j s GLU 84 CO 0.00 -1.33 1.25 0.93 0.02 0.00 0.00 175.26 176.13 2k3j h GLU 85 N -0.78 0.00 -5.95 1.61 3.07 -1.97 -3.46 114.58 107.11 2k3j h GLU 85 Ca -0.45 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 57.84 2k3j h GLU 85 Cb 1.31 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.15 2k3j h GLU 85 CO 0.63 0.69 0.14 0.42 -1.40 0.00 0.00 179.01 179.50 2k3j s ILE 86 N -2.82 5.02 -0.78 3.13 -1.09 -1.26 -4.97 121.20 118.42 2k3j s ILE 86 Ca 0.01 1.43 -0.25 0.00 -2.23 0.00 0.00 60.65 59.60 2k3j s ILE 86 Cb 0.09 -4.04 -0.05 0.00 -1.58 0.00 0.00 42.46 36.88 2k3j s ILE 86 CO 0.79 0.19 2.00 -0.54 -1.23 0.00 0.00 174.94 176.15 2k3j s LYS 87 N 1.22 2.44 0.00 2.79 -0.14 -1.26 -1.18 119.74 123.61 2k3j s LYS 87 Ca 0.36 0.17 0.00 0.00 -1.36 0.00 0.00 55.97 55.14 2k3j s LYS 87 Cb -0.17 -4.80 0.00 0.00 -1.68 0.00 0.00 37.83 31.17 2k3j s LYS 87 CO 0.16 -3.31 0.00 0.41 -0.76 0.00 0.00 175.35 171.85 2k3j n GLY 88 N 6.46 0.77 0.00 -3.33 0.00 -1.26 -4.97 105.19 102.85 2k3j n GLY 88 Ca 0.35 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k3j n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k3j n SER 89 N 0.64 0.00 0.04 1.61 2.88 -0.33 -1.11 113.62 117.35 2k3j n SER 89 Ca 0.00 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.36 2k3j n SER 89 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 2k3j n SER 89 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2k3j h ASP 90 N 0.00 0.40 0.00 -3.46 5.19 -1.96 -3.39 116.42 113.19 2k3j h ASP 90 Ca 0.00 -0.66 0.00 0.00 -0.62 0.00 0.00 57.03 55.75 2k3j h ASP 90 Cb 0.00 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.38 2k3j h ASP 90 CO 0.00 1.57 0.00 0.00 -3.12 0.00 0.00 179.24 177.69 2k3j h VAL 92 N 0.00 0.54 -0.87 0.00 3.04 -1.35 -1.54 116.25 116.07 2k3j h VAL 92 Ca 0.00 0.00 0.18 0.00 -1.01 0.00 0.00 66.70 65.87 2k3j h VAL 92 Cb 0.00 0.89 -0.06 0.00 -2.01 0.00 0.00 31.29 30.10 2k3j h VAL 92 CO 0.00 0.00 0.57 -0.78 -1.01 0.00 0.00 177.57 176.35 2k3j h ASP 93 N 0.00 0.46 0.60 3.17 3.58 -1.89 -1.20 116.42 121.14 2k3j h ASP 93 Ca 0.06 0.04 -0.27 0.00 0.42 0.00 0.00 57.03 57.28 2k3j h ASP 93 Cb 0.34 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.30 2k3j h ASP 93 CO -0.00 0.20 -1.55 1.56 -2.88 0.00 0.00 179.24 176.57 2k3j h GLN 94 N 0.47 0.00 -0.24 0.28 4.20 -1.66 -0.10 115.11 118.06 2k3j h GLN 94 Ca 0.45 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 59.06 2k3j h GLN 94 Cb 1.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 2k3j h GLN 94 CO -0.17 0.58 -0.26 0.74 -0.67 0.00 0.00 178.83 179.05 2k3j h PHE 95 N 0.00 0.51 0.17 2.96 -1.00 -1.55 0.82 116.94 118.84 2k3j h PHE 95 Ca -0.23 -0.11 -0.01 0.00 2.81 0.00 0.00 57.97 60.44 2k3j h PHE 95 Cb 1.95 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 41.39 2k3j h PHE 95 CO 0.00 0.68 -0.08 -0.09 -1.61 0.00 0.00 178.31 177.20 2k3j h ARG 96 N 0.40 -0.22 -0.59 1.51 2.43 -1.23 -2.73 114.38 113.94 2k3j h ARG 96 Ca 0.06 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2k3j h ARG 96 Cb 0.67 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.24 2k3j h ARG 96 CO 0.05 0.15 0.39 0.00 -1.51 0.00 0.00 179.97 179.05 2k3j h ALA 97 N 0.07 1.61 -0.63 2.80 0.00 -0.94 0.49 119.26 122.66 2k3j h ALA 97 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2k3j h ALA 97 Cb 0.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2k3j h ALA 97 CO 0.04 0.35 0.35 1.98 0.00 0.00 0.00 179.25 181.97 2k3j h MET 98 N 0.77 0.87 -0.45 0.00 1.85 -0.86 0.07 114.93 117.18 2k3j h MET 98 Ca 0.22 -0.10 -0.07 0.00 -0.61 0.00 0.00 59.70 59.14 2k3j h MET 98 Cb -0.04 -0.17 -0.02 0.00 0.43 0.00 0.00 31.60 31.80 2k3j h MET 98 CO -0.05 0.65 0.01 1.96 -0.40 0.00 0.00 176.91 179.08 2k3j h GLN 99 N 0.85 0.80 -0.64 0.39 4.20 -1.06 -1.89 115.11 117.76 2k3j h GLN 99 Ca 0.22 -0.25 0.02 0.00 0.06 0.00 0.00 58.65 58.70 2k3j h GLN 99 Cb 0.03 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2k3j h GLN 99 CO -0.04 0.85 0.42 1.05 -0.67 0.00 0.00 178.83 180.45 2k3j h GLU 100 N 0.64 0.79 -0.08 1.46 4.11 -0.49 -0.25 114.58 120.76 2k3j h GLU 100 Ca 0.13 -0.05 -0.12 0.00 0.07 0.00 0.00 59.36 59.39 2k3j h GLU 100 Cb 0.49 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2k3j h GLU 100 CO 0.02 0.52 -0.43 0.00 0.07 0.00 0.00 179.01 179.19 2k3j h MET 102 N -0.01 0.00 -0.00 0.00 2.86 -0.82 -1.82 114.93 115.13 2k3j h MET 102 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2k3j h MET 102 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2k3j h MET 102 CO 0.09 0.28 -0.06 0.00 1.06 0.00 0.00 176.91 178.27 2k3j n GLN 103 N -3.82 0.20 0.02 1.72 -0.00 -0.15 -3.60 117.38 111.74 2k3j n GLN 103 Ca -0.01 -0.03 -0.13 0.00 -0.00 0.00 0.00 57.00 56.83 2k3j n GLN 103 Cb 0.37 -1.50 -0.14 0.00 -0.00 0.00 0.00 30.24 28.97 2k3j n GLN 103 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 2k3j h LYS 104 N 0.06 0.13 -3.21 2.61 1.79 -1.35 -3.46 116.57 113.15 2k3j h LYS 104 Ca 0.00 -0.22 -0.60 0.00 -2.18 0.00 0.00 60.65 57.65 2k3j h LYS 104 Cb 0.42 0.08 -0.40 0.00 -1.58 0.00 0.00 32.23 30.76 2k3j h LYS 104 CO 0.00 0.88 -0.76 0.71 -1.08 0.00 0.00 179.45 179.21 2k3j s TYR 105 N -2.61 1.76 -0.15 -1.35 2.02 -1.03 -5.02 117.35 110.96 2k3j s TYR 105 Ca -0.09 -2.06 -0.21 0.00 -0.37 0.00 0.00 57.07 54.35 2k3j s TYR 105 Cb 0.08 -1.73 -0.24 0.00 -0.40 0.00 0.00 41.96 39.67 2k3j s TYR 105 CO 0.82 -0.83 0.46 -1.00 -1.57 0.00 0.00 175.55 173.44 2k3j h PRO 106 N 7.35 0.10 0.00 -1.71 0.13 -1.90 -3.46 132.00 132.51 2k3j h PRO 106 Ca -0.06 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2k3j h PRO 106 Cb 0.97 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2k3j h PRO 106 CO 0.46 1.08 0.00 -3.47 -0.23 0.00 0.00 178.00 175.84 2k3j n ASP 107 N -4.25 0.00 0.30 1.44 -0.08 -1.26 -4.94 116.55 107.76 2k3j n ASP 107 Ca -0.25 -0.92 0.19 0.00 -1.51 0.00 0.00 54.79 52.30 2k3j n ASP 107 Cb 0.73 0.00 0.92 0.00 2.34 0.00 0.00 41.12 45.12 2k3j n ASP 107 CO 0.00 0.00 0.00 0.17 0.12 0.00 0.00 177.20 177.49 2k3j h LEU 108 N 0.00 0.00 0.00 -2.67 -0.00 -1.98 -3.57 115.31 107.09 2k3j h LEU 108 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2k3j h LEU 108 Cb 0.92 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.58 2k3j h LEU 108 CO 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 178.44 178.47