#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 0.12 -4.58 0.99 -0.00 -1.26 -4.79 117.00 107.48 2k3j n LEU 46 Ca 0.00 0.22 -0.34 0.00 -0.00 0.00 0.00 56.01 55.88 2k3j n LEU 46 Cb 0.00 -0.27 -0.11 0.00 -0.00 0.00 0.00 43.42 43.05 2k3j n LEU 46 CO 0.00 0.02 -0.28 -0.63 -0.00 0.00 0.00 177.39 176.51 2k3j s ILE 47 N -2.57 4.53 0.84 1.47 -1.09 -1.26 -0.76 121.20 122.36 2k3j s ILE 47 Ca 0.28 -0.12 -0.11 0.00 -2.23 0.00 0.00 60.65 58.46 2k3j s ILE 47 Cb 0.20 -3.04 0.10 0.00 -1.58 0.00 0.00 42.46 38.15 2k3j s ILE 47 CO 0.47 0.46 1.15 -0.76 -1.23 0.00 0.00 174.94 175.02 2k3j s LEU 48 N 0.49 2.99 0.28 2.97 1.43 0.28 -4.88 118.68 122.25 2k3j s LEU 48 Ca 0.02 2.14 0.21 0.00 -1.03 0.00 0.00 54.13 55.46 2k3j s LEU 48 Cb -0.13 -4.56 1.05 0.00 0.03 0.00 0.00 46.19 42.58 2k3j s LEU 48 CO 0.01 -2.68 1.63 -0.81 0.23 0.00 0.00 176.35 174.73 2k3j n PRO 49 N -3.75 0.14 0.00 1.29 -0.04 -1.26 -1.46 135.00 129.92 2k3j n PRO 49 Ca 0.12 0.57 0.13 0.00 -0.04 0.00 0.00 63.50 64.28 2k3j n PRO 49 Cb 0.52 -1.91 0.40 0.00 -0.04 0.00 0.00 33.50 32.48 2k3j n PRO 49 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2k3j n ASN 50 N -2.20 1.41 0.00 3.54 5.15 -1.26 -4.98 115.26 116.92 2k3j n ASN 50 Ca -0.00 -1.26 0.00 0.00 -0.60 0.00 0.00 54.58 52.72 2k3j n ASN 50 Cb 0.08 0.09 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 2k3j n ASN 50 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k3j n GLY 51 N 1.27 1.04 3.89 8.20 0.00 -0.54 -5.07 105.19 113.98 2k3j n GLY 51 Ca 0.15 0.00 -0.29 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 -2.28 5.38 0.26 1.61 3.84 -1.26 -4.79 114.94 117.70 2k3j s ASN 52 Ca 0.00 1.02 -0.28 0.00 0.21 0.00 0.00 52.86 53.81 2k3j s ASN 52 Cb 0.00 -1.82 -0.09 0.00 -0.55 0.00 0.00 41.25 38.79 2k3j s ASN 52 CO 0.00 -1.35 0.92 -0.63 -2.79 0.00 0.00 177.10 173.25 2k3j s ILE 53 N -3.32 4.17 -1.32 -5.21 1.01 -1.26 -0.56 121.20 114.71 2k3j s ILE 53 Ca 0.58 1.93 -0.17 0.00 0.00 0.00 0.00 60.65 62.98 2k3j s ILE 53 Cb -0.11 -4.18 0.05 0.00 0.01 0.00 0.00 42.46 38.24 2k3j s ILE 53 CO 0.50 0.36 1.86 -3.20 0.00 0.00 0.00 174.94 174.46 2k3j n ASN 54 N 1.12 4.57 0.00 3.58 5.15 0.06 -4.76 115.26 124.98 2k3j n ASN 54 Ca -0.01 -2.89 0.01 0.00 -0.60 0.00 0.00 54.58 51.09 2k3j n ASN 54 Cb 0.48 -1.72 0.04 0.00 -0.53 0.00 0.00 39.78 38.06 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 8.12 0.00 1.10 1.20 7.02 -1.26 -2.37 117.44 131.25 2k3j n TRP 55 Ca 0.50 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 57.11 2k3j n TRP 55 Cb 0.44 -0.10 0.45 0.00 -2.42 0.00 0.00 31.31 29.69 2k3j n TRP 55 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2k3j n ASN 56 N -1.10 0.37 -4.78 -0.99 2.85 -1.26 -3.92 115.26 106.43 2k3j n ASN 56 Ca 0.01 -0.12 -0.34 0.00 -0.11 0.00 0.00 54.58 54.02 2k3j n ASN 56 Cb 0.01 -0.06 0.02 0.00 1.24 0.00 0.00 39.78 40.98 2k3j n ASN 56 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k3j h PRO 58 N 0.74 -0.53 0.09 0.00 0.13 -1.92 -0.02 132.00 130.48 2k3j h PRO 58 Ca -0.48 0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2k3j h PRO 58 Cb 1.25 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2k3j h PRO 58 CO 0.56 -0.28 -0.04 0.00 -0.23 0.00 0.00 178.00 178.01 2k3j h LEU 60 N -0.94 0.00 0.11 0.00 5.85 -1.94 -1.96 115.31 116.43 2k3j h LEU 60 Ca -0.01 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.36 2k3j h LEU 60 Cb 0.51 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2k3j h LEU 60 CO 0.02 0.01 -1.88 1.23 -0.34 0.00 0.00 178.44 177.48 2k3j h GLY 61 N 0.38 0.28 0.82 3.75 0.00 -1.09 -3.29 103.07 103.91 2k3j h GLY 61 Ca -0.00 -0.71 -0.01 0.00 0.00 0.00 0.00 47.33 46.62 2k3j h GLY 61 CO 0.00 0.62 0.03 -1.33 0.00 0.00 0.00 176.54 175.85 2k3j h GLY 62 N 1.47 0.15 2.00 4.60 0.00 -0.93 -2.15 103.07 108.21 2k3j h GLY 62 Ca -0.38 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2k3j h GLY 62 CO 0.11 0.08 -0.00 -0.33 0.00 0.00 0.00 176.54 176.40 2k3j h MET 63 N -0.06 0.00 -0.18 4.80 2.07 -1.58 -1.56 114.93 118.42 2k3j h MET 63 Ca 0.03 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.66 2k3j h MET 63 Cb 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.96 2k3j h MET 63 CO -0.00 0.00 0.00 0.00 1.07 0.00 0.00 176.91 177.98 2k3j n ALA 64 N -2.11 2.45 -2.34 6.32 0.00 -0.89 -4.31 120.51 119.63 2k3j n ALA 64 Ca -0.03 -0.79 -0.22 0.00 0.00 0.00 0.00 53.44 52.40 2k3j n ALA 64 Cb 0.07 -0.87 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 2k3j n ALA 64 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k3j s SER 65 N -1.78 5.00 0.23 0.00 0.01 -0.59 -4.22 113.70 112.36 2k3j s SER 65 Ca 0.33 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.87 2k3j s SER 65 Cb 0.21 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.77 2k3j s SER 65 CO 0.31 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 174.03 2k3j n GLY 66 N -1.43 0.74 0.00 3.44 0.00 -1.26 -2.84 105.19 103.84 2k3j n GLY 66 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2k3j n GLY 66 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3j n PRO 67 N 10.08 0.00 0.00 1.61 -0.04 -1.26 -3.97 135.00 141.42 2k3j n PRO 67 Ca 0.00 0.37 0.08 0.00 -0.04 0.00 0.00 63.50 63.91 2k3j n PRO 67 Cb 0.00 -1.04 0.44 0.00 -0.04 0.00 0.00 33.50 32.87 2k3j n PRO 67 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k3j h GLY 69 N 2.71 1.49 2.00 0.00 0.00 -1.65 -0.12 103.07 107.49 2k3j h GLY 69 Ca 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 2k3j h GLY 69 CO 0.00 0.16 -0.26 1.05 0.00 0.00 0.00 176.54 177.49 2k3j h GLU 70 N 0.92 0.00 -0.01 4.80 4.11 -1.73 0.13 114.58 122.80 2k3j h GLU 70 Ca 0.47 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.72 2k3j h GLU 70 Cb 0.51 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.77 2k3j h GLU 70 CO -0.23 0.26 -0.71 1.96 0.07 0.00 0.00 179.01 180.36 2k3j h GLN 71 N 0.00 0.49 -0.49 1.06 1.08 -1.32 0.99 115.11 116.92 2k3j h GLN 71 Ca -0.00 -0.52 0.01 0.00 -1.45 0.00 0.00 58.65 56.69 2k3j h GLN 71 Cb 0.50 0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 28.05 2k3j h GLN 71 CO 0.03 1.16 0.31 0.35 -0.95 0.00 0.00 178.83 179.73 2k3j h PHE 72 N 0.04 0.58 -0.23 2.96 3.57 -1.26 0.87 116.94 123.47 2k3j h PHE 72 Ca -0.09 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.47 2k3j h PHE 72 Cb 1.40 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.92 2k3j h PHE 72 CO 0.13 0.35 0.00 0.87 -2.23 0.00 0.00 178.31 177.43 2k3j h LYS 73 N 0.62 0.08 -0.67 1.11 1.57 -0.89 0.25 116.57 118.64 2k3j h LYS 73 Ca 0.19 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.90 2k3j h LYS 73 Cb -0.02 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2k3j h LYS 73 CO -0.07 0.05 0.17 1.03 -0.57 0.00 0.00 179.45 180.07 2k3j h SER 74 N 0.08 1.01 0.03 0.86 0.87 -0.44 0.72 113.55 116.68 2k3j h SER 74 Ca 0.11 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2k3j h SER 74 Cb 0.14 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 2k3j h SER 74 CO -0.18 0.97 -0.01 0.00 -0.53 0.00 0.00 176.83 177.08 2k3j h ALA 75 N 1.07 -0.04 -0.17 6.23 0.00 -0.66 -1.74 119.26 123.95 2k3j h ALA 75 Ca 0.21 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2k3j h ALA 75 Cb 0.35 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k3j h ALA 75 CO 0.00 -0.32 -0.68 0.35 0.00 0.00 0.00 179.25 178.60 2k3j h PHE 76 N -0.45 0.88 -0.48 0.00 3.04 -0.90 -1.94 116.94 117.09 2k3j h PHE 76 Ca -0.00 -0.36 -0.03 0.00 3.98 0.00 0.00 57.97 61.56 2k3j h PHE 76 Cb 0.42 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.76 2k3j h PHE 76 CO 0.06 1.15 0.20 1.03 -2.02 0.00 0.00 178.31 178.74 2k3j h SER 77 N 0.48 0.65 -0.55 0.41 0.87 -0.96 -1.82 113.55 112.64 2k3j h SER 77 Ca -0.02 -0.16 -0.06 0.00 -1.23 0.00 0.00 61.79 60.32 2k3j h SER 77 Cb 1.27 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 63.04 2k3j h SER 77 CO 0.13 0.64 0.14 0.00 -0.53 0.00 0.00 176.83 177.21 2k3j h PHE 79 N 0.88 0.79 0.00 0.00 3.57 -1.26 0.12 116.94 121.05 2k3j h PHE 79 Ca 0.19 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2k3j h PHE 79 Cb 0.33 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2k3j h PHE 79 CO 0.02 0.64 -0.18 0.45 -2.23 0.00 0.00 178.31 177.01 2k3j h HIS 80 N 0.72 0.00 0.00 0.41 3.86 -0.43 -2.36 115.15 117.35 2k3j h HIS 80 Ca 0.18 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.28 2k3j h HIS 80 Cb 0.16 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 2k3j h HIS 80 CO 0.00 0.18 -1.38 0.66 0.86 0.00 0.00 177.93 178.25 2k3j n TYR 81 N -3.22 0.87 0.24 2.45 4.02 0.18 -4.41 117.16 117.30 2k3j n TYR 81 Ca 0.02 0.28 -0.14 0.00 -0.01 0.00 0.00 57.90 58.04 2k3j n TYR 81 Cb 0.49 -1.01 -0.08 0.00 -0.02 0.00 0.00 39.34 38.73 2k3j n TYR 81 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k3j h SER 82 N 0.00 -0.54 -4.01 7.72 0.87 -0.57 -3.49 113.55 113.53 2k3j h SER 82 Ca -0.12 -0.08 -0.19 0.00 -1.23 0.00 0.00 61.79 60.17 2k3j h SER 82 Cb 1.40 0.14 0.09 0.00 -0.44 0.00 0.00 62.40 63.59 2k3j h SER 82 CO 0.03 -0.19 -0.43 0.35 -0.53 0.00 0.00 176.83 176.06 2k3j n THR 83 N -5.26 -3.22 0.00 2.23 -2.24 -0.90 -5.08 114.28 99.81 2k3j n THR 83 Ca -0.11 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 2k3j n THR 83 Cb 0.31 -3.82 0.00 0.00 -2.10 0.00 0.00 70.33 64.72 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 -2.77 0.00 0.00 -0.78 -0.58 -1.26 -5.09 120.64 110.16 2k3j n GLU 84 Ca -0.15 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2k3j n GLU 84 Cb 0.59 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.46 2k3j n GLU 84 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2k3j n GLU 85 N 0.00 2.98 -5.21 3.49 2.13 -1.26 -5.09 120.64 117.67 2k3j n GLU 85 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 2k3j n GLU 85 Cb 0.00 -0.67 -0.16 0.00 0.27 0.00 0.00 31.44 30.88 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 -0.96 1.93 -0.78 6.31 1.09 -1.26 -5.06 121.20 122.47 2k3j s ILE 86 Ca 0.00 -1.03 -0.23 0.00 -1.10 0.00 0.00 60.65 58.29 2k3j s ILE 86 Cb 0.00 -1.62 -0.17 0.00 -1.06 0.00 0.00 42.46 39.62 2k3j s ILE 86 CO 0.00 0.54 2.40 0.29 -0.10 0.00 0.00 174.94 178.07 2k3j n LYS 87 N 2.65 0.51 -1.60 2.79 4.76 -1.26 -2.20 118.16 123.81 2k3j n LYS 87 Ca -0.16 -0.41 0.00 0.00 -2.87 0.00 0.00 58.31 54.87 2k3j n LYS 87 Cb 0.52 -2.92 0.00 0.00 -1.84 0.00 0.00 35.03 30.79 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 6.34 0.48 0.39 0.72 0.00 -1.26 -4.95 105.19 106.91 2k3j n GLY 88 Ca 0.50 -0.87 0.25 0.00 0.00 0.00 0.00 46.02 45.91 2k3j n GLY 88 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2k3j h SER 89 N 0.00 0.45 0.00 1.61 4.64 -1.87 -1.33 113.55 117.05 2k3j h SER 89 Ca 0.00 0.13 -0.35 0.00 -0.47 0.00 0.00 61.79 61.11 2k3j h SER 89 Cb 0.68 0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 62.78 2k3j h SER 89 CO 0.00 -0.03 -2.30 -0.90 -0.87 0.00 0.00 176.83 172.72 2k3j n ASP 90 N -4.79 0.93 0.00 4.97 5.75 -1.26 -4.62 116.55 117.53 2k3j n ASP 90 Ca 0.30 -0.04 0.01 0.00 -0.01 0.00 0.00 54.79 55.05 2k3j n ASP 90 Cb 1.01 0.55 0.08 0.00 -1.03 0.00 0.00 41.12 41.73 2k3j n ASP 90 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k3j n VAL 92 N -0.54 -0.40 0.25 0.00 0.31 -0.59 -1.49 118.33 115.86 2k3j n VAL 92 Ca 0.02 2.05 0.12 0.00 -0.01 0.00 0.00 64.34 66.52 2k3j n VAL 92 Cb 0.01 -3.11 0.66 0.00 -0.91 0.00 0.00 33.84 30.49 2k3j n VAL 92 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 2k3j h ASP 93 N 0.00 0.00 -0.10 4.52 2.03 -1.89 -0.13 116.42 120.84 2k3j h ASP 93 Ca 0.67 0.00 -0.18 0.00 -0.73 0.00 0.00 57.03 56.79 2k3j h ASP 93 Cb 1.54 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 40.05 2k3j h ASP 93 CO -0.84 0.15 -0.64 1.56 -1.03 0.00 0.00 179.24 178.43 2k3j h GLN 94 N 0.00 0.62 -0.20 4.15 7.50 -1.66 0.36 115.11 125.88 2k3j h GLN 94 Ca -0.00 -0.53 -0.06 0.00 0.50 0.00 0.00 58.65 58.57 2k3j h GLN 94 Cb 0.43 0.12 -0.01 0.00 0.05 0.00 0.00 27.48 28.07 2k3j h GLN 94 CO 0.02 1.15 -0.13 0.74 -1.50 0.00 0.00 178.83 179.11 2k3j h PHE 95 N 0.26 0.33 -0.10 2.96 -1.00 -1.44 -0.63 116.94 117.33 2k3j h PHE 95 Ca -0.05 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.67 2k3j h PHE 95 Cb 1.29 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 40.75 2k3j h PHE 95 CO 0.11 0.44 -0.01 -0.09 -1.61 0.00 0.00 178.31 177.15 2k3j h ARG 96 N 0.30 0.19 -0.30 1.51 2.43 -1.00 -3.03 114.38 114.47 2k3j h ARG 96 Ca 0.06 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2k3j h ARG 96 Cb 0.41 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2k3j h ARG 96 CO 0.02 0.48 0.17 0.00 -1.51 0.00 0.00 179.97 179.13 2k3j h ALA 97 N 0.70 0.38 -0.02 2.80 0.00 -0.46 0.03 119.26 122.69 2k3j h ALA 97 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2k3j h ALA 97 Cb 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2k3j h ALA 97 CO 0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 179.25 179.09 2k3j h MET 98 N 0.37 0.03 0.02 0.00 -0.00 -1.23 -0.74 114.93 113.38 2k3j h MET 98 Ca 0.11 -0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.72 2k3j h MET 98 Cb 0.03 -0.01 0.01 0.00 -0.00 0.00 0.00 31.60 31.63 2k3j h MET 98 CO -0.02 0.08 -0.35 0.37 -0.00 0.00 0.00 176.91 176.99 2k3j h GLN 99 N 0.03 0.20 -0.38 -0.10 4.15 -1.26 -2.53 115.11 115.21 2k3j h GLN 99 Ca 0.01 -0.24 -0.04 0.00 0.77 0.00 0.00 58.65 59.14 2k3j h GLN 99 Cb 0.11 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.86 2k3j h GLN 99 CO 0.01 1.00 0.07 1.05 -1.93 0.00 0.00 178.83 179.03 2k3j h GLU 100 N -0.50 0.57 0.16 1.69 -0.00 -0.90 -2.71 114.58 112.89 2k3j h GLU 100 Ca -0.05 -0.10 -0.01 0.00 -0.00 0.00 0.00 59.36 59.20 2k3j h GLU 100 Cb 1.14 -0.09 0.00 0.00 -0.00 0.00 0.00 28.75 29.80 2k3j h GLU 100 CO 0.07 0.54 -0.08 0.00 -0.00 0.00 0.00 179.01 179.55 2k3j h MET 102 N -0.54 0.00 0.00 0.00 2.86 -1.37 -2.38 114.93 113.49 2k3j h MET 102 Ca -0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2k3j h MET 102 Cb 0.42 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 2k3j h MET 102 CO 0.04 0.30 -0.10 -0.56 1.06 0.00 0.00 176.91 177.64 2k3j h GLN 103 N 0.00 0.00 0.00 1.72 3.07 -1.60 -2.65 115.11 115.65 2k3j h GLN 103 Ca -0.00 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.59 2k3j h GLN 103 Cb 0.95 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.49 2k3j h GLN 103 CO 0.04 0.10 -1.15 0.87 0.09 0.00 0.00 178.83 178.78 2k3j h LYS 104 N 0.00 0.00 -2.47 0.06 1.57 -1.55 -3.42 116.57 110.77 2k3j h LYS 104 Ca -0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 2k3j h LYS 104 Cb 0.53 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.43 2k3j h LYS 104 CO 0.01 0.34 -0.50 0.66 -0.57 0.00 0.00 179.45 179.39 2k3j n TYR 105 N -2.97 3.53 -0.01 -1.35 4.01 -0.93 -4.98 117.16 114.46 2k3j n TYR 105 Ca -0.06 -4.12 -0.16 0.00 -0.16 0.00 0.00 57.90 53.39 2k3j n TYR 105 Cb 0.80 -0.63 -0.12 0.00 -0.31 0.00 0.00 39.34 39.08 2k3j n TYR 105 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2k3j h PRO 106 N 4.56 0.20 0.00 -0.72 0.13 -1.80 -3.44 132.00 130.93 2k3j h PRO 106 Ca 0.19 -0.25 -0.11 0.00 -0.87 0.00 0.00 66.00 64.96 2k3j h PRO 106 Cb 0.68 0.08 -0.11 0.00 0.13 0.00 0.00 31.00 31.79 2k3j h PRO 106 CO 0.84 1.02 -0.23 -3.47 -0.23 0.00 0.00 178.00 175.93 2k3j n ASP 107 N -4.41 -0.85 0.00 1.44 -0.08 -1.26 -4.98 116.55 106.40 2k3j n ASP 107 Ca -0.11 -1.65 0.13 0.00 -1.51 0.00 0.00 54.79 51.65 2k3j n ASP 107 Cb 0.59 0.28 0.76 0.00 2.34 0.00 0.00 41.12 45.09 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 -0.16 0.00 -0.86 -2.67 -0.00 -1.26 -5.33 117.00 106.72 2k3j n LEU 108 Ca -0.21 0.03 0.12 0.00 -0.00 0.00 0.00 56.01 55.95 2k3j n LEU 108 Cb 0.64 -0.03 0.19 0.00 -0.00 0.00 0.00 43.42 44.22 2k3j n LEU 108 CO -0.11 -0.01 0.68 0.00 -0.00 0.00 0.00 177.39 177.95