#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3j h LEU 46 N 0.00 0.00 -9.52 0.99 8.10 -1.97 -3.41 115.31 109.50 2k3j h LEU 46 Ca 0.00 0.00 -0.64 0.00 0.11 0.00 0.00 57.88 57.35 2k3j h LEU 46 Cb 0.00 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 40.14 2k3j h LEU 46 CO 0.00 0.00 -0.43 -0.63 -4.11 0.00 0.00 178.44 173.27 2k3j s ILE 47 N -3.45 5.40 0.76 0.15 -1.09 -1.26 -0.63 121.20 121.07 2k3j s ILE 47 Ca 0.02 0.33 -0.11 0.00 -2.23 0.00 0.00 60.65 58.66 2k3j s ILE 47 Cb 0.09 -3.49 0.05 0.00 -1.58 0.00 0.00 42.46 37.53 2k3j s ILE 47 CO 0.38 0.55 1.08 -0.76 -1.23 0.00 0.00 174.94 174.95 2k3j s LEU 48 N -0.54 2.85 0.00 2.97 1.43 0.28 -4.84 118.68 120.83 2k3j s LEU 48 Ca 0.15 1.51 0.16 0.00 -1.03 0.00 0.00 54.13 54.93 2k3j s LEU 48 Cb -0.13 -4.23 0.98 0.00 0.03 0.00 0.00 46.19 42.84 2k3j s LEU 48 CO 0.04 -1.81 1.39 -0.81 0.23 0.00 0.00 176.35 175.39 2k3j n PRO 49 N -3.35 0.53 0.00 1.29 -0.04 -1.26 -2.05 135.00 130.12 2k3j n PRO 49 Ca 0.07 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.63 2k3j n PRO 49 Cb 0.55 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.98 1.97 0.00 3.54 6.94 -1.26 -5.01 115.26 120.45 2k3j n ASN 50 Ca 0.12 -1.48 0.00 0.00 -0.02 0.00 0.00 54.58 53.20 2k3j n ASN 50 Cb 0.06 0.41 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 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 1.27 1.02 3.86 4.83 0.00 -0.87 -5.09 105.19 110.22 2k3j n GLY 51 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 3.18 0.04 1.61 3.84 -1.26 -4.77 114.94 115.57 2k3j s ASN 52 Ca 0.00 0.52 -0.11 0.00 0.21 0.00 0.00 52.86 53.48 2k3j s ASN 52 Cb 0.00 -0.76 -0.06 0.00 -0.55 0.00 0.00 41.25 39.88 2k3j s ASN 52 CO 0.00 -2.72 0.38 -0.63 -2.79 0.00 0.00 177.10 171.35 2k3j s ILE 53 N -3.62 5.11 -1.36 -5.21 1.01 -1.26 -0.55 121.20 115.30 2k3j s ILE 53 Ca 0.70 0.55 -0.15 0.00 0.00 0.00 0.00 60.65 61.74 2k3j s ILE 53 Cb -0.08 -3.65 0.07 0.00 0.01 0.00 0.00 42.46 38.82 2k3j s ILE 53 CO 0.53 0.40 1.96 -3.20 0.00 0.00 0.00 174.94 174.62 2k3j n ASN 54 N 1.26 4.49 -0.13 3.58 5.15 0.19 -4.77 115.26 125.03 2k3j n ASN 54 Ca -0.11 -2.91 0.00 0.00 -0.60 0.00 0.00 54.58 50.97 2k3j n ASN 54 Cb 0.52 -1.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.11 2k3j n ASN 54 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 2k3j n TRP 55 N 6.65 0.00 0.17 1.20 7.02 -1.26 -2.49 117.44 128.73 2k3j n TRP 55 Ca 0.48 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 57.08 2k3j n TRP 55 Cb 0.41 -0.01 -0.05 0.00 -2.42 0.00 0.00 31.31 29.25 2k3j n TRP 55 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2k3j n ASN 56 N -0.30 0.54 -4.77 -0.99 4.13 -1.26 -4.25 115.26 108.36 2k3j n ASN 56 Ca 0.00 0.11 -0.40 0.00 1.68 0.00 0.00 54.58 55.97 2k3j n ASN 56 Cb 0.03 0.99 0.01 0.00 -1.54 0.00 0.00 39.78 39.26 2k3j n ASN 56 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k3j h PRO 58 N 2.73 0.28 0.00 0.00 0.13 -1.94 0.16 132.00 133.36 2k3j h PRO 58 Ca -0.51 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2k3j h PRO 58 Cb 1.25 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k3j h PRO 58 CO 0.63 0.34 0.00 0.00 -0.23 0.00 0.00 178.00 178.74 2k3j h LEU 60 N 0.00 0.30 0.12 0.00 5.85 -1.92 0.81 115.31 120.47 2k3j h LEU 60 Ca 0.00 -0.10 -0.28 0.00 0.84 0.00 0.00 57.88 58.35 2k3j h LEU 60 Cb 0.00 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2k3j h LEU 60 CO 0.00 0.58 -1.28 1.23 -0.34 0.00 0.00 178.44 178.63 2k3j h GLY 61 N 1.03 0.29 0.96 3.75 0.00 -0.87 -2.89 103.07 105.34 2k3j h GLY 61 Ca 0.04 -0.73 -0.11 0.00 0.00 0.00 0.00 47.33 46.53 2k3j h GLY 61 CO 0.05 0.64 -0.23 -1.33 0.00 0.00 0.00 176.54 175.67 2k3j h GLY 62 N 1.71 0.77 2.00 4.60 0.00 -1.18 -2.86 103.07 108.10 2k3j h GLY 62 Ca -0.15 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.44 2k3j h GLY 62 CO 0.19 0.67 -0.02 1.98 0.00 0.00 0.00 176.54 179.36 2k3j h MET 63 N 0.46 0.00 -0.12 4.80 -1.53 -0.94 -1.35 114.93 116.25 2k3j h MET 63 Ca 0.06 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.32 2k3j h MET 63 Cb 0.79 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.84 2k3j h MET 63 CO 0.06 0.02 0.00 0.00 0.14 0.00 0.00 176.91 177.14 2k3j n ALA 64 N -2.24 2.54 -1.68 0.39 0.00 -1.09 -4.48 120.51 113.95 2k3j n ALA 64 Ca -0.03 -0.46 -0.29 0.00 0.00 0.00 0.00 53.44 52.66 2k3j n ALA 64 Cb 0.12 -1.13 0.14 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.65 3.50 0.81 0.00 0.15 -0.51 -4.49 113.70 111.50 2k3j s SER 65 Ca 0.33 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.73 2k3j s SER 65 Cb 0.18 -1.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 2k3j s SER 65 CO 0.27 -2.53 0.00 0.61 1.20 0.00 0.00 173.24 172.79 2k3j n GLY 66 N -2.73 0.65 0.09 9.45 0.00 -1.26 -2.86 105.19 108.52 2k3j n GLY 66 Ca 0.09 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.10 0.00 1.61 0.13 -1.99 -3.29 132.00 128.36 2k3j h PRO 67 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2k3j h PRO 67 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 2k3j h PRO 67 CO 0.00 0.30 0.00 0.00 -0.23 0.00 0.00 178.00 178.07 2k3j h GLY 69 N 0.52 0.00 1.53 0.00 0.00 -1.59 -0.33 103.07 103.20 2k3j h GLY 69 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2k3j h GLY 69 CO 0.00 0.00 -0.14 1.05 0.00 0.00 0.00 176.54 177.45 2k3j h GLU 70 N 0.00 0.56 -0.13 4.80 4.11 -1.75 0.68 114.58 122.85 2k3j h GLU 70 Ca 0.18 -0.17 -0.15 0.00 0.07 0.00 0.00 59.36 59.29 2k3j h GLU 70 Cb 0.78 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.98 2k3j h GLU 70 CO -0.00 0.68 -0.52 1.96 0.07 0.00 0.00 179.01 181.20 2k3j h GLN 71 N 0.51 0.57 -0.70 1.06 1.08 -1.32 -2.56 115.11 113.76 2k3j h GLN 71 Ca 0.09 -0.45 -0.02 0.00 -1.45 0.00 0.00 58.65 56.82 2k3j h GLN 71 Cb 0.54 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 28.03 2k3j h GLN 71 CO 0.03 1.07 0.34 0.35 -0.95 0.00 0.00 178.83 179.68 2k3j h PHE 72 N 0.21 1.00 0.00 2.96 3.57 -1.23 0.78 116.94 124.22 2k3j h PHE 72 Ca -0.03 -0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.45 2k3j h PHE 72 Cb 1.16 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 39.53 2k3j h PHE 72 CO 0.11 0.74 -0.41 0.87 -2.23 0.00 0.00 178.31 177.38 2k3j h LYS 73 N 0.97 -0.55 -0.16 1.11 1.79 -0.89 -1.83 116.57 117.00 2k3j h LYS 73 Ca 0.24 0.04 -0.05 0.00 -2.18 0.00 0.00 60.65 58.69 2k3j h LYS 73 Cb 0.11 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.88 2k3j h LYS 73 CO -0.03 -0.37 -0.10 1.03 -1.08 0.00 0.00 179.45 178.90 2k3j h SER 74 N -0.57 0.37 0.12 0.86 0.87 -1.13 -1.94 113.55 112.13 2k3j h SER 74 Ca 0.05 -0.43 0.01 0.00 -1.23 0.00 0.00 61.79 60.19 2k3j h SER 74 Cb 0.65 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 2k3j h SER 74 CO -0.31 0.73 -0.20 0.00 -0.53 0.00 0.00 176.83 176.51 2k3j h ALA 75 N 0.66 -0.35 -0.11 6.23 0.00 -0.88 0.59 119.26 125.40 2k3j h ALA 75 Ca 0.03 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2k3j h ALA 75 Cb 0.60 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k3j h ALA 75 CO 0.03 -0.73 -0.72 0.35 0.00 0.00 0.00 179.25 178.17 2k3j h PHE 76 N -0.39 0.71 0.55 0.00 3.57 -1.40 -1.29 116.94 118.69 2k3j h PHE 76 Ca 0.02 -0.31 -0.02 0.00 3.53 0.00 0.00 57.97 61.20 2k3j h PHE 76 Cb 0.40 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2k3j h PHE 76 CO -0.19 1.08 -0.43 1.03 -2.23 0.00 0.00 178.31 177.57 2k3j h SER 77 N 0.37 -1.14 -0.72 0.41 0.87 -1.25 -1.27 113.55 110.81 2k3j h SER 77 Ca -0.03 0.08 0.11 0.00 -1.23 0.00 0.00 61.79 60.72 2k3j h SER 77 Cb 1.31 0.36 -0.08 0.00 -0.44 0.00 0.00 62.40 63.55 2k3j h SER 77 CO 0.13 -0.62 0.34 0.00 -0.53 0.00 0.00 176.83 176.15 2k3j h PHE 79 N 0.55 1.06 0.02 0.00 3.57 -1.14 -1.12 116.94 119.88 2k3j h PHE 79 Ca 0.37 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2k3j h PHE 79 Cb 0.45 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.88 2k3j h PHE 79 CO -0.12 0.86 -0.01 1.25 -2.23 0.00 0.00 178.31 178.06 2k3j h HIS 80 N 0.98 -0.02 0.00 0.41 2.76 -0.48 -3.29 115.15 115.50 2k3j h HIS 80 Ca 0.21 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.34 2k3j h HIS 80 Cb 0.33 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.29 2k3j h HIS 80 CO 0.02 0.41 -0.17 1.88 -1.30 0.00 0.00 177.93 178.78 2k3j h TYR 81 N -0.46 0.00 0.00 5.26 -1.99 -1.02 -1.98 116.97 116.78 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 0.44 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.17 2k3j h TYR 81 CO 0.08 0.17 0.00 1.03 -0.00 0.00 0.00 178.16 179.43 2k3j h SER 82 N 0.00 0.00 -6.84 3.88 0.87 -1.29 -3.49 113.55 106.68 2k3j h SER 82 Ca -0.00 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.03 2k3j h SER 82 Cb 0.48 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 2k3j h SER 82 CO 0.02 0.00 -1.04 0.35 -0.53 0.00 0.00 176.83 175.63 2k3j n THR 83 N -2.61 -2.85 0.00 2.23 -2.24 -0.75 -5.00 114.28 103.07 2k3j n THR 83 Ca 0.04 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2k3j n THR 83 Cb 0.44 -2.49 0.00 0.00 -2.10 0.00 0.00 70.33 66.17 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 -3.60 0.00 0.00 -0.78 -0.58 -1.26 -5.15 120.64 109.27 2k3j n GLU 84 Ca -0.23 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.51 2k3j n GLU 84 Cb 0.62 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.49 2k3j n GLU 84 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2k3j n GLU 85 N 0.00 0.00 -2.36 3.49 0.28 -1.26 -5.13 120.64 115.66 2k3j n GLU 85 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 56.60 2k3j n GLU 85 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 2k3j n GLU 85 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2k3j s ILE 86 N 0.00 3.26 -0.21 3.84 1.01 -1.26 -4.94 121.20 122.89 2k3j s ILE 86 Ca 0.00 1.23 -0.38 0.00 0.00 0.00 0.00 60.65 61.50 2k3j s ILE 86 Cb 0.00 -3.77 -0.14 0.00 0.01 0.00 0.00 42.46 38.56 2k3j s ILE 86 CO 0.00 0.27 1.81 0.29 0.00 0.00 0.00 174.94 177.31 2k3j n LYS 87 N 0.91 1.54 -1.03 2.79 4.76 -1.26 -1.85 118.16 124.02 2k3j n LYS 87 Ca -0.00 0.56 -0.01 0.00 -2.87 0.00 0.00 58.31 55.99 2k3j n LYS 87 Cb 0.44 -2.31 -0.00 0.00 -1.84 0.00 0.00 35.03 31.31 2k3j n LYS 87 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k3j n GLY 88 N 4.34 0.45 0.30 0.72 0.00 -1.26 -4.92 105.19 104.81 2k3j n GLY 88 Ca 0.25 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.27 2k3j n GLY 88 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2k3j h SER 89 N 0.00 0.00 -0.00 1.61 0.87 -1.76 0.08 113.55 114.35 2k3j h SER 89 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2k3j h SER 89 Cb 0.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 2k3j h SER 89 CO 0.03 0.00 -0.04 -0.67 -0.53 0.00 0.00 176.83 175.62 2k3j n ASP 90 N -2.74 0.67 -0.17 6.23 2.03 -1.26 -4.78 116.55 116.52 2k3j n ASP 90 Ca -0.02 -0.83 0.02 0.00 0.52 0.00 0.00 54.79 54.48 2k3j n ASP 90 Cb 0.29 0.47 0.03 0.00 -0.72 0.00 0.00 41.12 41.19 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 2.95 0.57 -0.83 0.00 3.04 -1.37 -1.01 116.25 119.60 2k3j h VAL 92 Ca 0.00 -0.14 0.21 0.00 -1.01 0.00 0.00 66.70 65.75 2k3j h VAL 92 Cb 1.03 0.11 -0.13 0.00 -2.01 0.00 0.00 31.29 30.29 2k3j h VAL 92 CO 0.00 0.08 0.18 0.44 -1.01 0.00 0.00 177.57 177.26 2k3j h ASP 93 N 0.42 -0.06 0.60 3.17 5.19 -1.92 -0.33 116.42 123.48 2k3j h ASP 93 Ca 0.57 0.19 -0.27 0.00 -0.62 0.00 0.00 57.03 56.90 2k3j h ASP 93 Cb 1.41 0.27 0.00 0.00 0.18 0.00 0.00 39.33 41.19 2k3j h ASP 93 CO -0.27 -0.13 -1.20 1.56 -3.12 0.00 0.00 179.24 176.08 2k3j h GLN 94 N 0.20 0.29 -0.35 3.56 4.20 -1.57 -0.36 115.11 121.07 2k3j h GLN 94 Ca 0.50 -0.46 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 2k3j h GLN 94 Cb 0.95 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.88 2k3j h GLN 94 CO -0.63 1.20 -0.15 0.74 -0.67 0.00 0.00 178.83 179.32 2k3j h PHE 95 N 0.09 0.69 -0.11 2.96 -1.00 -1.49 -0.48 116.94 117.60 2k3j h PHE 95 Ca -0.13 -0.12 -0.23 0.00 2.81 0.00 0.00 57.97 60.30 2k3j h PHE 95 Cb 1.91 -0.18 0.01 0.00 3.61 0.00 0.00 35.95 41.31 2k3j h PHE 95 CO 0.06 0.74 -0.83 -0.09 -1.61 0.00 0.00 178.31 176.59 2k3j h ARG 96 N 0.57 0.73 -0.90 1.51 2.43 -0.94 -0.22 114.38 117.55 2k3j h ARG 96 Ca 0.10 -0.64 0.04 0.00 -0.81 0.00 0.00 59.98 58.67 2k3j h ARG 96 Cb 0.59 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.23 2k3j h ARG 96 CO 0.04 1.24 0.58 0.00 -1.51 0.00 0.00 179.97 180.32 2k3j h ALA 97 N 0.57 1.20 -0.47 2.80 0.00 -1.01 -1.35 119.26 121.00 2k3j h ALA 97 Ca -0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2k3j h ALA 97 Cb 1.46 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2k3j h ALA 97 CO 0.17 0.43 0.15 1.98 0.00 0.00 0.00 179.25 181.98 2k3j h MET 98 N 1.12 0.72 -0.38 0.00 1.85 -0.94 -2.85 114.93 114.44 2k3j h MET 98 Ca 0.36 -0.15 -0.02 0.00 -0.61 0.00 0.00 59.70 59.28 2k3j h MET 98 Cb 0.03 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 31.93 2k3j h MET 98 CO -0.13 0.68 0.16 1.96 -0.40 0.00 0.00 176.91 179.18 2k3j h GLN 99 N 0.62 0.57 -0.79 0.39 4.20 -0.55 -1.19 115.11 118.36 2k3j h GLN 99 Ca 0.15 -0.10 0.04 0.00 0.06 0.00 0.00 58.65 58.80 2k3j h GLN 99 Cb 0.25 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.89 2k3j h GLN 99 CO -0.01 0.54 0.52 1.05 -0.67 0.00 0.00 178.83 180.27 2k3j h GLU 100 N 0.47 0.93 0.03 1.46 4.11 -1.25 -1.31 114.58 119.02 2k3j h GLU 100 Ca 0.13 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.50 2k3j h GLU 100 Cb 0.18 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2k3j h GLU 100 CO -0.01 0.61 -0.02 0.00 0.07 0.00 0.00 179.01 179.67 2k3j h MET 102 N -0.37 0.00 0.00 0.00 2.86 -0.80 -0.68 114.93 115.94 2k3j h MET 102 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2k3j h MET 102 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 2k3j h MET 102 CO 0.01 0.15 0.00 -0.56 1.06 0.00 0.00 176.91 177.57 2k3j h GLN 103 N 0.00 0.00 0.11 1.72 -0.00 -1.35 -3.27 115.11 112.32 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 1.02 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.49 2k3j h GLN 103 CO 0.02 0.00 -1.40 0.87 -0.00 0.00 0.00 178.83 178.32 2k3j h LYS 104 N 0.00 0.23 -3.50 0.06 1.79 -1.27 -3.44 116.57 110.43 2k3j h LYS 104 Ca 0.00 -0.39 -0.69 0.00 -2.18 0.00 0.00 60.65 57.39 2k3j h LYS 104 Cb 0.95 0.15 -0.36 0.00 -1.58 0.00 0.00 32.23 31.38 2k3j h LYS 104 CO 0.00 1.12 -0.39 0.71 -1.08 0.00 0.00 179.45 179.81 2k3j s TYR 105 N -2.64 3.40 -0.10 -1.35 2.02 -0.31 -4.98 117.35 113.40 2k3j s TYR 105 Ca -0.06 -2.83 -0.27 0.00 -0.37 0.00 0.00 57.07 53.54 2k3j s TYR 105 Cb 0.07 -3.13 -0.23 0.00 -0.40 0.00 0.00 41.96 38.27 2k3j s TYR 105 CO 0.86 -0.81 0.88 -1.00 -1.57 0.00 0.00 175.55 173.91 2k3j h PRO 106 N 6.81 -0.01 0.00 -1.71 0.13 -1.87 -3.44 132.00 131.92 2k3j h PRO 106 Ca -0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2k3j h PRO 106 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 2k3j h PRO 106 CO 0.72 0.80 -0.01 -3.47 -0.23 0.00 0.00 178.00 175.81 2k3j n ASP 107 N -4.69 -0.02 0.00 1.44 2.03 -1.26 -4.99 116.55 109.05 2k3j n ASP 107 Ca -0.09 -0.63 0.05 0.00 0.52 0.00 0.00 54.79 54.64 2k3j n ASP 107 Cb 0.39 0.01 0.28 0.00 -0.72 0.00 0.00 41.12 41.09 2k3j n ASP 107 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k3j n LEU 108 N 0.00 0.00 -0.63 -2.67 -0.00 -1.26 -5.33 117.00 107.12 2k3j n LEU 108 Ca -0.01 0.26 0.13 0.00 -0.00 0.00 0.00 56.01 56.40 2k3j n LEU 108 Cb 0.31 -0.26 0.39 0.00 -0.00 0.00 0.00 43.42 43.86 2k3j n LEU 108 CO -0.00 -0.17 0.80 0.00 -0.00 0.00 0.00 177.39 178.02