#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 0.00 -4.86 0.99 -0.00 -1.26 -4.95 117.00 106.92 2k3j n LEU 46 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.65 2k3j n LEU 46 Cb 0.00 -0.11 -0.06 0.00 -0.00 0.00 0.00 43.42 43.26 2k3j n LEU 46 CO 0.00 0.00 0.07 -0.63 -0.00 0.00 0.00 177.39 176.83 2k3j s ILE 47 N -0.40 5.10 0.66 1.47 -1.09 -1.26 -0.98 121.20 124.71 2k3j s ILE 47 Ca 0.00 0.55 -0.11 0.00 -2.23 0.00 0.00 60.65 58.86 2k3j s ILE 47 Cb 0.00 -3.65 -0.01 0.00 -1.58 0.00 0.00 42.46 37.22 2k3j s ILE 47 CO 0.00 0.40 1.06 -0.76 -1.23 0.00 0.00 174.94 174.40 2k3j s LEU 48 N -1.61 3.05 0.00 2.97 1.43 0.45 -4.78 118.68 120.19 2k3j s LEU 48 Ca 0.29 1.22 0.07 0.00 -1.03 0.00 0.00 54.13 54.68 2k3j s LEU 48 Cb -0.15 -4.11 0.43 0.00 0.03 0.00 0.00 46.19 42.39 2k3j s LEU 48 CO 0.16 -1.14 0.83 -0.81 0.23 0.00 0.00 176.35 175.62 2k3j n PRO 49 N -2.88 0.35 0.00 1.29 -0.04 -1.26 -1.74 135.00 130.72 2k3j n PRO 49 Ca 0.06 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.58 2k3j n PRO 49 Cb 0.56 -1.32 0.02 0.00 -0.04 0.00 0.00 33.50 32.72 2k3j n PRO 49 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2k3j n ASN 50 N -0.82 1.63 0.00 3.54 6.94 -1.26 -5.03 115.26 120.26 2k3j n ASN 50 Ca 0.05 -1.32 0.00 0.00 -0.02 0.00 0.00 54.58 53.30 2k3j n ASN 50 Cb 0.02 0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 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 0.77 0.49 3.96 4.83 0.00 -0.71 -5.09 105.19 109.43 2k3j n GLY 51 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.61 4.16 0.10 1.61 3.84 -1.26 -4.81 114.94 115.98 2k3j s ASN 52 Ca 0.00 0.02 -0.20 0.00 0.21 0.00 0.00 52.86 52.89 2k3j s ASN 52 Cb 0.00 -0.40 -0.07 0.00 -0.55 0.00 0.00 41.25 40.23 2k3j s ASN 52 CO 0.00 -2.01 0.61 -0.63 -2.79 0.00 0.00 177.10 172.28 2k3j s ILE 53 N -3.36 4.68 -1.06 -5.21 1.01 -1.26 -0.41 121.20 115.60 2k3j s ILE 53 Ca 0.67 1.26 -0.23 0.00 0.00 0.00 0.00 60.65 62.34 2k3j s ILE 53 Cb -0.06 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 2k3j s ILE 53 CO 0.46 0.50 1.84 0.21 0.00 0.00 0.00 174.94 177.96 2k3j s ASN 54 N -1.20 5.52 0.00 3.58 2.47 -0.15 -4.77 114.94 120.38 2k3j s ASN 54 Ca 0.32 -1.31 0.00 0.00 0.42 0.00 0.00 52.86 52.28 2k3j s ASN 54 Cb -0.19 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.03 2k3j s ASN 54 CO 0.20 -2.47 0.43 0.79 -3.72 0.00 0.00 177.10 172.33 2k3j n TRP 55 N 12.66 0.00 -1.45 0.43 5.03 -1.26 -2.63 117.44 130.22 2k3j n TRP 55 Ca 0.42 -0.22 0.00 0.00 3.03 0.00 0.00 57.50 60.73 2k3j n TRP 55 Cb 0.47 -0.19 0.00 0.00 -1.03 0.00 0.00 31.31 30.56 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 1.05 0.00 -4.76 -0.99 3.02 -1.26 -4.68 115.26 107.64 2k3j n ASN 56 Ca 0.00 -1.00 -0.35 0.00 -0.03 0.00 0.00 54.58 53.20 2k3j n ASN 56 Cb 0.18 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.39 2k3j n ASN 56 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k3j n PRO 58 N -1.94 1.23 0.00 0.00 -0.04 -1.26 -1.33 135.00 131.67 2k3j n PRO 58 Ca 0.12 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2k3j n PRO 58 Cb 0.51 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 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 0.25 -0.76 0.00 5.85 -1.96 0.41 115.31 119.11 2k3j h LEU 60 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2k3j h LEU 60 Cb 0.00 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.00 2k3j h LEU 60 CO 0.00 0.18 0.00 1.23 -0.34 0.00 0.00 178.44 179.51 2k3j h GLY 61 N 0.36 0.00 0.71 3.75 0.00 -1.38 -3.02 103.07 103.48 2k3j h GLY 61 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.25 2k3j h GLY 61 CO -0.11 0.00 -1.10 -1.33 0.00 0.00 0.00 176.54 174.00 2k3j h GLY 62 N 2.88 0.35 2.00 4.60 0.00 -1.44 -3.34 103.07 108.12 2k3j h GLY 62 Ca 0.00 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.41 2k3j h GLY 62 CO 0.00 0.79 -0.07 -0.33 0.00 0.00 0.00 176.54 176.93 2k3j h MET 63 N -0.29 0.00 -0.11 4.80 2.07 -0.92 -2.33 114.93 118.15 2k3j h MET 63 Ca -0.21 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.42 2k3j h MET 63 Cb 1.75 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.48 2k3j h MET 63 CO 0.13 0.07 0.00 0.00 1.07 0.00 0.00 176.91 178.19 2k3j n ALA 64 N -2.22 2.31 -2.00 6.32 0.00 -1.15 -4.64 120.51 119.14 2k3j n ALA 64 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 2k3j n ALA 64 Cb 0.20 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.69 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 -1.05 5.30 0.66 0.00 0.15 -0.88 -4.55 113.70 113.33 2k3j s SER 65 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 2k3j s SER 65 Cb 0.00 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 63.73 2k3j s SER 65 CO 0.00 -1.10 0.00 0.61 1.20 0.00 0.00 173.24 173.95 2k3j n GLY 66 N -2.20 0.48 0.15 9.45 0.00 -1.26 -2.52 105.19 109.29 2k3j n GLY 66 Ca 0.10 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.26 0.00 1.61 0.13 -1.99 -3.26 132.00 128.23 2k3j h PRO 67 Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2k3j h PRO 67 Cb 0.00 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.19 2k3j h PRO 67 CO 0.00 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 177.79 2k3j h GLY 69 N 0.75 1.30 2.00 0.00 0.00 -1.53 -1.70 103.07 103.90 2k3j h GLY 69 Ca 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2k3j h GLY 69 CO 0.00 0.16 -0.14 1.05 0.00 0.00 0.00 176.54 177.61 2k3j h GLU 70 N 0.83 0.00 -0.00 4.80 4.11 -1.76 0.70 114.58 123.27 2k3j h GLU 70 Ca 0.43 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.86 2k3j h GLU 70 Cb 0.51 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 2k3j h GLU 70 CO -0.20 0.14 -0.00 1.96 0.07 0.00 0.00 179.01 180.99 2k3j h GLN 71 N 0.00 0.00 -0.71 1.06 1.08 -1.57 -2.05 115.11 112.92 2k3j h GLN 71 Ca -0.00 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 2k3j h GLN 71 Cb 0.43 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.83 2k3j h GLN 71 CO 0.02 0.38 0.27 0.35 -0.95 0.00 0.00 178.83 178.90 2k3j h PHE 72 N -0.38 1.10 -0.01 2.96 3.57 -1.28 0.13 116.94 123.03 2k3j h PHE 72 Ca 0.00 -0.09 0.03 0.00 3.53 0.00 0.00 57.97 61.44 2k3j h PHE 72 Cb 0.38 -0.33 -0.06 0.00 2.79 0.00 0.00 35.95 38.74 2k3j h PHE 72 CO 0.06 0.85 -0.45 0.87 -2.23 0.00 0.00 178.31 177.41 2k3j h LYS 73 N 1.03 -0.57 0.36 1.11 1.79 -0.94 -2.11 116.57 117.23 2k3j h LYS 73 Ca 0.24 0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.73 2k3j h LYS 73 Cb 0.23 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 2k3j h LYS 73 CO -0.02 -0.38 -0.32 1.03 -1.08 0.00 0.00 179.45 178.68 2k3j h SER 74 N -0.60 -0.88 -0.56 0.86 0.87 -0.96 -0.55 113.55 111.74 2k3j h SER 74 Ca 0.04 0.07 0.11 0.00 -1.23 0.00 0.00 61.79 60.77 2k3j h SER 74 Cb 0.67 0.28 -0.11 0.00 -0.44 0.00 0.00 62.40 62.80 2k3j h SER 74 CO -0.33 -0.44 -0.28 0.00 -0.53 0.00 0.00 176.83 175.25 2k3j h ALA 75 N -1.26 0.07 -0.19 6.23 0.00 -0.78 0.19 119.26 123.53 2k3j h ALA 75 Ca -0.05 0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.83 2k3j h ALA 75 Cb 0.57 0.67 0.01 0.00 0.00 0.00 0.00 17.79 19.04 2k3j h ALA 75 CO -0.02 -0.61 -0.71 0.35 0.00 0.00 0.00 179.25 178.26 2k3j h PHE 76 N -0.13 1.06 -0.19 0.00 3.04 -1.40 -1.12 116.94 118.20 2k3j h PHE 76 Ca 0.24 -0.44 0.00 0.00 3.98 0.00 0.00 57.97 61.75 2k3j h PHE 76 Cb 0.52 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.85 2k3j h PHE 76 CO -0.57 1.27 0.12 0.66 -2.02 0.00 0.00 178.31 177.77 2k3j h SER 77 N 0.57 0.21 -0.55 0.41 4.64 -0.23 -0.83 113.55 117.77 2k3j h SER 77 Ca -0.03 -0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.31 2k3j h SER 77 Cb 1.34 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 2k3j h SER 77 CO 0.15 0.15 0.32 0.00 -0.87 0.00 0.00 176.83 176.57 2k3j h PHE 79 N 0.62 0.17 0.02 0.00 3.57 -1.02 -1.13 116.94 119.16 2k3j h PHE 79 Ca 0.23 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 2k3j h PHE 79 Cb 0.06 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.74 2k3j h PHE 79 CO -0.07 0.12 -0.01 1.25 -2.23 0.00 0.00 178.31 177.37 2k3j h HIS 80 N 0.18 -0.02 0.00 0.41 2.76 -0.21 -3.36 115.15 114.90 2k3j h HIS 80 Ca 0.05 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.19 2k3j h HIS 80 Cb 0.01 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 28.97 2k3j h HIS 80 CO 0.00 0.51 -0.11 1.88 -1.30 0.00 0.00 177.93 178.92 2k3j h TYR 81 N -0.99 0.00 0.00 5.26 -1.99 -0.69 -1.50 116.97 117.07 2k3j h TYR 81 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2k3j h TYR 81 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 2k3j h TYR 81 CO 0.15 0.11 0.00 1.03 -0.00 0.00 0.00 178.16 179.44 2k3j h SER 82 N 0.00 0.00 -4.90 3.88 0.87 -1.38 -3.49 113.55 108.53 2k3j h SER 82 Ca -0.00 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.32 2k3j h SER 82 Cb 0.25 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.22 2k3j h SER 82 CO 0.01 0.00 -0.66 0.35 -0.53 0.00 0.00 176.83 176.00 2k3j n THR 83 N -2.55 -2.03 0.00 2.23 -2.24 -0.56 -5.00 114.28 104.12 2k3j n THR 83 Ca 0.03 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2k3j n THR 83 Cb 0.34 -1.84 0.00 0.00 -2.10 0.00 0.00 70.33 66.73 2k3j n THR 83 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k3j n GLU 84 N -0.50 0.00 0.14 -0.78 1.02 -1.26 -5.14 120.64 114.12 2k3j n GLU 84 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 2k3j n GLU 84 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.80 2k3j n GLU 84 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2k3j n GLU 85 N 0.00 0.00 -3.58 3.49 2.13 -1.26 -5.16 120.64 116.26 2k3j n GLU 85 Ca 0.00 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 2k3j n GLU 85 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 2k3j n GLU 85 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2k3j s ILE 86 N -2.00 5.12 -0.52 6.31 -1.09 -1.26 -4.99 121.20 122.77 2k3j s ILE 86 Ca 0.00 0.60 -0.26 0.00 -2.23 0.00 0.00 60.65 58.76 2k3j s ILE 86 Cb 0.00 -3.65 -0.08 0.00 -1.58 0.00 0.00 42.46 37.15 2k3j s ILE 86 CO 0.00 0.47 2.43 0.29 -1.23 0.00 0.00 174.94 176.90 2k3j n LYS 87 N 1.47 0.98 0.00 2.79 5.02 -1.26 -1.26 118.16 125.91 2k3j n LYS 87 Ca -0.12 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.13 2k3j n LYS 87 Cb 0.53 -3.39 0.00 0.00 -0.02 0.00 0.00 35.03 32.15 2k3j n LYS 87 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k3j n GLY 88 N 6.06 0.96 0.00 0.72 0.00 -1.26 -4.97 105.19 106.70 2k3j n GLY 88 Ca 0.39 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.44 2k3j n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k3j n SER 89 N 0.00 0.00 0.00 1.61 3.41 -0.39 -1.04 113.62 117.21 2k3j n SER 89 Ca 0.00 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2k3j n SER 89 Cb 0.00 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2k3j n SER 89 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2k3j n ASP 90 N -1.33 0.43 -0.03 4.04 2.03 -1.26 -4.91 116.55 115.51 2k3j n ASP 90 Ca 0.03 -1.12 0.00 0.00 0.52 0.00 0.00 54.79 54.22 2k3j n ASP 90 Cb 0.06 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 2k3j n ASP 90 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k3j h VAL 92 N 2.74 0.41 -0.61 0.00 3.04 -1.44 -1.06 116.25 119.33 2k3j h VAL 92 Ca 0.00 -0.09 0.15 0.00 -1.01 0.00 0.00 66.70 65.74 2k3j h VAL 92 Cb 0.95 0.12 -0.03 0.00 -2.01 0.00 0.00 31.29 30.32 2k3j h VAL 92 CO 0.00 0.05 0.43 -0.78 -1.01 0.00 0.00 177.57 176.25 2k3j h ASP 93 N 0.27 0.18 0.28 3.17 3.58 -1.92 -1.12 116.42 120.84 2k3j h ASP 93 Ca 0.64 0.01 -0.34 0.00 0.42 0.00 0.00 57.03 57.77 2k3j h ASP 93 Cb 1.87 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 42.89 2k3j h ASP 93 CO -0.28 0.09 -1.76 1.56 -2.88 0.00 0.00 179.24 175.97 2k3j h GLN 94 N 0.19 0.28 -0.77 0.28 4.20 -1.56 -1.42 115.11 116.30 2k3j h GLN 94 Ca 0.30 -0.48 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 2k3j h GLN 94 Cb 0.90 0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.82 2k3j h GLN 94 CO -0.05 1.15 0.47 0.74 -0.67 0.00 0.00 178.83 180.47 2k3j h PHE 95 N 0.08 1.01 0.13 2.96 -1.00 -1.59 -0.10 116.94 118.43 2k3j h PHE 95 Ca -0.33 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.44 2k3j h PHE 95 Cb 2.05 -0.33 0.00 0.00 3.61 0.00 0.00 35.95 41.28 2k3j h PHE 95 CO 0.07 0.68 -0.06 -0.09 -1.61 0.00 0.00 178.31 177.30 2k3j h ARG 96 N 1.05 -0.16 -0.88 1.51 2.43 -1.28 -0.91 114.38 116.14 2k3j h ARG 96 Ca 0.28 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.50 2k3j h ARG 96 Cb -0.04 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.49 2k3j h ARG 96 CO -0.05 -0.04 0.56 0.00 -1.51 0.00 0.00 179.97 178.93 2k3j h ALA 97 N 0.62 1.18 -0.63 2.80 0.00 -1.16 -0.90 119.26 121.17 2k3j h ALA 97 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2k3j h ALA 97 Cb 0.20 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2k3j h ALA 97 CO 0.03 0.38 0.31 1.98 0.00 0.00 0.00 179.25 181.95 2k3j h MET 98 N 1.07 0.88 0.12 0.00 1.85 -0.86 -2.45 114.93 115.55 2k3j h MET 98 Ca 0.36 -0.11 -0.01 0.00 -0.61 0.00 0.00 59.70 59.34 2k3j h MET 98 Cb 0.06 -0.17 0.00 0.00 0.43 0.00 0.00 31.60 31.92 2k3j h MET 98 CO -0.14 0.68 -0.06 1.96 -0.40 0.00 0.00 176.91 178.95 2k3j h GLN 99 N 0.89 -0.16 -0.02 0.39 1.08 -0.08 -0.09 115.11 117.11 2k3j h GLN 99 Ca 0.22 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.44 2k3j h GLN 99 Cb 0.08 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2k3j h GLN 99 CO -0.03 0.31 0.02 1.05 -0.95 0.00 0.00 178.83 179.23 2k3j h GLU 100 N -0.73 0.00 0.31 1.46 4.11 -1.25 -1.41 114.58 117.07 2k3j h GLU 100 Ca -0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.40 2k3j h GLU 100 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2k3j h GLU 100 CO 0.03 0.00 -0.15 0.00 0.07 0.00 0.00 179.01 178.96 2k3j h MET 102 N -0.95 0.00 0.00 0.00 2.86 -0.32 -0.47 114.93 116.05 2k3j h MET 102 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2k3j h MET 102 Cb 0.50 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.16 2k3j h MET 102 CO 0.07 0.08 0.00 -0.56 1.06 0.00 0.00 176.91 177.56 2k3j h GLN 103 N 0.00 0.00 0.05 1.72 -0.00 -1.43 -2.88 115.11 112.57 2k3j h GLN 103 Ca -0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 58.65 58.36 2k3j h GLN 103 Cb 0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.60 2k3j h GLN 103 CO 0.01 0.00 -1.57 0.87 -0.00 0.00 0.00 178.83 178.14 2k3j h LYS 104 N 0.00 0.11 -3.54 0.06 1.57 -1.20 -3.44 116.57 110.12 2k3j h LYS 104 Ca 0.00 -0.18 -0.70 0.00 -1.87 0.00 0.00 60.65 57.89 2k3j h LYS 104 Cb 0.51 0.07 -0.35 0.00 0.08 0.00 0.00 32.23 32.54 2k3j h LYS 104 CO 0.00 0.85 -0.30 0.71 -0.57 0.00 0.00 179.45 180.14 2k3j s TYR 105 N -2.62 3.48 -0.08 -1.35 2.02 -0.75 -4.95 117.35 113.10 2k3j s TYR 105 Ca -0.07 -2.73 -0.02 0.00 -0.37 0.00 0.00 57.07 53.89 2k3j s TYR 105 Cb 0.08 -3.24 -0.01 0.00 -0.40 0.00 0.00 41.96 38.39 2k3j s TYR 105 CO 0.83 -0.83 0.08 -1.00 -1.57 0.00 0.00 175.55 173.05 2k3j h PRO 106 N 6.90 -0.06 0.00 -1.71 0.13 -1.87 -3.44 132.00 131.96 2k3j h PRO 106 Ca 0.02 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.06 2k3j h PRO 106 Cb 0.94 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 31.97 2k3j h PRO 106 CO 0.73 -0.04 -0.30 -3.47 -0.23 0.00 0.00 178.00 174.69 2k3j n ASP 107 N -4.44 -0.43 0.11 1.44 -0.08 -1.26 -4.94 116.55 106.95 2k3j n ASP 107 Ca -0.01 -1.71 0.09 0.00 -1.51 0.00 0.00 54.79 51.66 2k3j n ASP 107 Cb 0.02 0.12 0.44 0.00 2.34 0.00 0.00 41.12 44.04 2k3j n ASP 107 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k3j n LEU 108 N 0.06 0.46 -0.50 -2.67 -0.00 -1.26 -5.34 117.00 107.76 2k3j n LEU 108 Ca -0.14 0.66 0.14 0.00 -0.00 0.00 0.00 56.01 56.67 2k3j n LEU 108 Cb 0.69 -0.66 0.51 0.00 -0.00 0.00 0.00 43.42 43.96 2k3j n LEU 108 CO -0.08 -0.67 0.86 0.00 -0.00 0.00 0.00 177.39 177.50