#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kk2 n ASN 2 N 0.00 -0.42 -0.09 2.98 5.15 -1.26 -4.83 115.26 116.79 2kk2 n ASN 2 Ca 0.00 0.00 0.25 0.00 -0.60 0.00 0.00 54.58 54.23 2kk2 n ASN 2 Cb 0.00 -0.21 0.71 0.00 -0.53 0.00 0.00 39.78 39.76 2kk2 n ASN 2 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2kk2 h PRO 3 N 0.00 0.00 0.00 1.20 0.11 -1.91 -0.73 132.00 130.67 2kk2 h PRO 3 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2kk2 h PRO 3 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2kk2 h PRO 3 CO 0.00 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.18 2kk2 n GLU 4 N -4.23 0.15 0.27 1.05 -0.58 -1.26 -1.18 120.64 114.85 2kk2 n GLU 4 Ca 0.14 0.62 0.10 0.00 -0.42 0.00 0.00 57.16 57.61 2kk2 n GLU 4 Cb 0.81 -1.96 0.71 0.00 -0.57 0.00 0.00 31.44 30.43 2kk2 n GLU 4 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2kk2 h ASP 5 N 0.00 0.00 -0.25 1.62 3.58 -1.45 -3.02 116.42 116.91 2kk2 h ASP 5 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kk2 h ASP 5 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 2kk2 h ASP 5 CO 0.00 0.04 0.00 0.47 -2.88 0.00 0.00 179.24 176.87 2kk2 n ASP 6 N -4.19 3.46 -4.67 2.28 8.00 -0.32 -5.02 116.55 116.08 2kk2 n ASP 6 Ca -0.03 -2.74 -0.42 0.00 0.71 0.00 0.00 54.79 52.31 2kk2 n ASP 6 Cb 0.13 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.76 2kk2 n ASP 6 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2kk2 s TYR 7 N -2.33 1.86 -0.95 1.24 5.04 -1.14 -2.75 117.35 118.31 2kk2 s TYR 7 Ca 0.35 -0.03 -0.04 0.00 -2.44 0.00 0.00 57.07 54.91 2kk2 s TYR 7 Cb 0.27 -4.08 0.24 0.00 0.35 0.00 0.00 41.96 38.74 2kk2 s TYR 7 CO 0.10 -4.59 0.87 0.95 -1.34 0.00 0.00 175.55 171.54 2kk2 s THR 8 N 3.68 4.86 0.43 4.34 -4.23 -0.65 -4.97 115.64 119.11 2kk2 s THR 8 Ca 0.80 -3.70 0.20 0.00 -1.18 0.00 0.00 61.69 57.81 2kk2 s THR 8 Cb -0.40 -3.98 0.23 0.00 1.34 0.00 0.00 72.50 69.69 2kk2 s THR 8 CO 0.35 -1.11 2.02 1.55 -0.54 0.00 0.00 174.62 176.89 2kk2 h PRO 9 N 6.25 0.00 -0.16 3.99 0.13 -1.88 -2.34 132.00 138.00 2kk2 h PRO 9 Ca 0.16 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.30 2kk2 h PRO 9 Cb 0.84 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 2kk2 h PRO 9 CO 0.90 0.16 0.08 -0.07 -0.23 0.00 0.00 178.00 178.85 2kk2 h LEU 10 N 0.00 0.13 0.00 1.56 -0.00 -1.93 -2.81 115.31 112.27 2kk2 h LEU 10 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2kk2 h LEU 10 Cb 0.34 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 2kk2 h LEU 10 CO 0.02 0.10 -0.29 0.71 -0.00 0.00 0.00 178.44 178.98 2kk2 h THR 11 N 0.18 0.00 -3.75 0.22 1.35 -1.67 -3.45 112.91 105.79 2kk2 h THR 11 Ca 0.06 -0.56 -0.63 0.00 -0.55 0.00 0.00 66.41 64.73 2kk2 h THR 11 Cb 0.00 1.38 -0.15 0.00 -1.73 0.00 0.00 68.15 67.65 2kk2 h THR 11 CO -0.04 0.00 -0.28 0.00 -0.25 0.00 0.00 175.52 174.95 2kk2 n PRO 13 N 5.29 0.57 -4.52 0.00 -0.04 -1.26 -4.78 135.00 130.27 2kk2 n PRO 13 Ca -0.09 0.01 -0.29 0.00 -0.04 0.00 0.00 63.50 63.08 2kk2 n PRO 13 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 2kk2 n PRO 13 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2kk2 s HIS 14 N -2.03 2.36 0.55 0.54 3.76 -1.26 -5.14 115.29 114.08 2kk2 s HIS 14 Ca 0.28 -0.36 -0.03 0.00 -0.15 0.00 0.00 55.06 54.80 2kk2 s HIS 14 Cb 0.13 -1.31 0.02 0.00 1.11 0.00 0.00 32.58 32.52 2kk2 s HIS 14 CO 0.22 0.29 0.82 0.95 -0.85 0.00 0.00 174.74 176.17 2kk2 s THR 15 N -1.00 3.41 -0.58 1.30 -4.23 -1.26 -4.86 115.64 108.42 2kk2 s THR 15 Ca 0.14 -0.30 0.15 0.00 -1.18 0.00 0.00 61.69 60.50 2kk2 s THR 15 Cb -0.10 -3.32 0.15 0.00 1.34 0.00 0.00 72.50 70.56 2kk2 s THR 15 CO 0.06 -0.28 1.46 0.00 -0.54 0.00 0.00 174.62 175.31 2kk2 n ILE 16 N -2.43 1.26 -0.16 2.99 3.06 -1.26 -0.85 119.36 121.97 2kk2 n ILE 16 Ca 0.05 0.51 -0.09 0.00 -2.50 0.00 0.00 62.75 60.71 2kk2 n ILE 16 Cb 0.58 -1.46 0.00 0.00 0.54 0.00 0.00 39.64 39.31 2kk2 n ILE 16 CO 0.00 0.00 0.00 -1.28 -2.50 0.00 0.00 176.55 172.77 2kk2 h SER 17 N 0.00 0.63 -1.62 9.51 0.87 -2.06 -3.41 113.55 117.48 2kk2 h SER 17 Ca 0.00 -0.18 -0.47 0.00 -1.23 0.00 0.00 61.79 59.91 2kk2 h SER 17 Cb 0.11 -0.17 -0.32 0.00 -0.44 0.00 0.00 62.40 61.58 2kk2 h SER 17 CO 0.00 0.64 -0.92 1.33 -0.53 0.00 0.00 176.83 177.35 2kk2 n VAL 18 N -4.58 -0.62 0.00 2.23 0.24 -0.03 -4.92 118.33 110.64 2kk2 n VAL 18 Ca 0.01 -3.18 0.00 0.00 -2.04 0.00 0.00 64.34 59.13 2kk2 n VAL 18 Cb 0.16 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.52 2kk2 n VAL 18 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 2kk2 n VAL 19 N 1.87 0.00 0.00 3.34 3.14 -1.07 -4.18 118.33 121.43 2kk2 n VAL 19 Ca 0.20 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.58 2kk2 n VAL 19 Cb 0.54 -1.09 0.00 0.00 -1.06 0.00 0.00 33.84 32.23 2kk2 n VAL 19 CO 0.00 0.00 0.00 1.87 -6.46 0.00 0.00 176.83 172.24 2kk2 n TRP 20 N -2.77 0.00 -0.31 1.45 -0.00 -1.26 -2.23 117.44 112.31 2kk2 n TRP 20 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 57.50 57.67 2kk2 n TRP 20 Cb 0.45 -0.25 0.35 0.00 -0.00 0.00 0.00 31.31 31.87 2kk2 n TRP 20 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 177.69 176.77 2kk2 h TYR 21 N 0.00 0.50 -0.15 5.87 5.03 -1.93 0.51 116.97 126.80 2kk2 h TYR 21 Ca 0.00 0.05 -0.11 0.00 2.58 0.00 0.00 58.73 61.25 2kk2 h TYR 21 Cb 0.00 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.20 2kk2 h TYR 21 CO -0.01 -0.22 -0.40 1.05 -1.32 0.00 0.00 178.16 177.26 2kk2 h GLU 22 N 0.22 0.33 -0.17 1.82 -0.00 -1.75 0.61 114.58 115.64 2kk2 h GLU 22 Ca 0.61 -0.16 0.00 0.00 -0.00 0.00 0.00 59.36 59.82 2kk2 h GLU 22 Cb 1.31 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.06 2kk2 h GLU 22 CO -0.66 0.68 0.00 0.00 -0.00 0.00 0.00 179.01 179.03 2kk2 n THR 24 N 1.13 0.00 0.07 0.00 -2.24 -0.01 -3.14 114.28 110.10 2kk2 n THR 24 Ca 0.14 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2kk2 n THR 24 Cb 0.50 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 2kk2 n THR 24 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2kk2 n GLU 25 N -0.60 0.00 -1.70 -0.78 0.00 0.18 -4.00 120.64 113.74 2kk2 n GLU 25 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.82 2kk2 n GLU 25 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 31.44 31.20 2kk2 n GLU 25 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2kk2 s ASN 26 N -5.29 4.60 0.58 4.31 2.47 -1.15 -4.82 114.94 115.64 2kk2 s ASN 26 Ca 0.00 0.71 0.28 0.00 0.42 0.00 0.00 52.86 54.27 2kk2 s ASN 26 Cb 0.00 -2.52 1.56 0.00 -1.45 0.00 0.00 41.25 38.84 2kk2 s ASN 26 CO 0.00 -2.87 2.03 0.71 -3.72 0.00 0.00 177.10 173.25 2kk2 h THR 27 N 7.48 0.50 0.00 -5.21 1.35 -1.94 0.61 112.91 115.70 2kk2 h THR 27 Ca -0.20 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.64 2kk2 h THR 27 Cb 1.20 0.77 -0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2kk2 h THR 27 CO 1.16 0.00 -0.07 0.00 -0.25 0.00 0.00 175.52 176.36 2kk2 h ALA 28 N 1.69 1.16 0.00 6.62 0.00 -1.94 -3.38 119.26 123.40 2kk2 h ALA 28 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2kk2 h ALA 28 Cb 0.74 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2kk2 h ALA 28 CO -0.00 0.08 -0.87 0.09 0.00 0.00 0.00 179.25 178.56 2kk2 n ASN 29 N -3.40 0.36 -3.89 0.00 4.13 0.11 -5.11 115.26 107.46 2kk2 n ASN 29 Ca -0.02 0.00 -0.28 0.00 1.68 0.00 0.00 54.58 55.96 2kk2 n ASN 29 Cb 0.22 0.00 0.25 0.00 -1.54 0.00 0.00 39.78 38.70 2kk2 n ASN 29 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kk2 n GLY 31 N 1.70 1.49 0.18 0.00 0.00 -1.19 -4.29 105.19 103.09 2kk2 n GLY 31 Ca 0.06 -2.25 -0.04 0.00 0.00 0.00 0.00 46.02 43.80 2kk2 n GLY 31 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2kk2 h THR 32 N 0.18 0.78 -0.10 2.61 2.02 -1.69 -0.56 112.91 116.14 2kk2 h THR 32 Ca 0.00 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 2kk2 h THR 32 Cb 0.00 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 2kk2 h THR 32 CO 0.00 0.04 0.06 0.00 0.37 0.00 0.00 175.52 175.99 2kk2 h ALA 33 N 1.33 1.91 0.08 6.16 0.00 -1.90 -1.19 119.26 125.65 2kk2 h ALA 33 Ca 0.21 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2kk2 h ALA 33 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2kk2 h ALA 33 CO -0.27 0.08 -0.04 0.00 0.00 0.00 0.00 179.25 179.02 2kk2 h ASP 36 N 0.02 0.00 1.46 0.00 3.58 -1.35 0.89 116.42 121.02 2kk2 h ASP 36 Ca 0.17 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 2kk2 h ASP 36 Cb 0.26 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.31 2kk2 h ASP 36 CO -0.35 0.00 -0.01 0.28 -2.88 0.00 0.00 179.24 176.28 2kk2 h SER 37 N 0.00 0.00 0.00 2.28 0.02 -1.58 -3.38 113.55 110.88 2kk2 h SER 37 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2kk2 h SER 37 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2kk2 h SER 37 CO 0.00 0.01 -0.37 0.00 -1.14 0.00 0.00 176.83 175.33 2kk2 s PHE 39 N -1.12 -0.32 0.38 0.00 0.08 0.12 -1.64 117.98 115.47 2kk2 s PHE 39 Ca 0.00 0.78 0.08 0.00 0.12 0.00 0.00 56.93 57.91 2kk2 s PHE 39 Cb 0.00 0.10 -0.06 0.00 -0.57 0.00 0.00 43.02 42.50 2kk2 s PHE 39 CO 0.00 -0.17 0.07 -1.21 -0.10 0.00 0.00 175.22 173.81 2kk2 s GLU 40 N 0.36 2.11 2.42 0.44 0.41 -1.11 -4.01 118.70 119.32 2kk2 s GLU 40 Ca -0.02 -1.85 0.00 0.00 -0.41 0.00 0.00 54.97 52.69 2kk2 s GLU 40 Cb -0.03 -1.89 0.00 0.00 -1.78 0.00 0.00 34.13 30.43 2kk2 s GLU 40 CO -0.01 0.01 0.00 1.28 -0.49 0.00 0.00 175.26 176.05 2kk2 n LEU 41 N -1.06 0.00 -0.22 1.80 4.77 -1.26 -0.55 117.00 120.48 2kk2 n LEU 41 Ca -0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.87 2kk2 n LEU 41 Cb 0.64 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.76 2kk2 n LEU 41 CO 0.45 0.00 0.94 0.74 -1.33 0.00 0.00 177.39 178.19 2kk2 h THR 42 N 0.00 1.25 -0.88 -5.08 2.02 -1.98 -1.94 112.91 106.30 2kk2 h THR 42 Ca 0.00 -0.86 0.10 0.00 0.77 0.00 0.00 66.41 66.42 2kk2 h THR 42 Cb 0.00 0.65 -0.13 0.00 -1.74 0.00 0.00 68.15 66.93 2kk2 h THR 42 CO 0.00 0.33 -0.51 1.23 0.37 0.00 0.00 175.52 176.94 2kk2 h GLY 43 N 0.88 -0.55 0.70 2.16 0.00 -1.10 -0.77 103.07 104.39 2kk2 h GLY 43 Ca 0.20 0.68 -0.01 0.00 0.00 0.00 0.00 47.33 48.19 2kk2 h GLY 43 CO -0.00 -0.07 -0.38 -0.57 0.00 0.00 0.00 176.54 175.52 2kk2 h ASN 44 N -0.07 -1.00 -0.96 0.19 -0.73 -0.38 -1.45 115.58 111.17 2kk2 h ASN 44 Ca 0.21 0.07 0.02 0.00 1.87 0.00 0.00 56.30 58.47 2kk2 h ASN 44 Cb 0.50 0.32 -0.05 0.00 0.27 0.00 0.00 38.32 39.36 2kk2 h ASN 44 CO -0.88 -0.55 0.63 0.74 -0.37 0.00 0.00 177.43 177.00 2kk2 h THR 45 N -0.85 1.21 -0.66 -3.57 2.02 -1.08 0.26 112.91 110.25 2kk2 h THR 45 Ca -0.05 -0.43 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 2kk2 h THR 45 Cb 0.73 -0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 2kk2 h THR 45 CO -0.01 0.23 0.26 0.24 0.37 0.00 0.00 175.52 176.61 2kk2 h MET 46 N 1.26 0.98 -0.11 6.66 2.86 -0.88 -0.51 114.93 125.19 2kk2 h MET 46 Ca 0.37 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2kk2 h MET 46 Cb -0.08 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.42 2kk2 h MET 46 CO -0.10 0.82 0.07 0.00 1.06 0.00 0.00 176.91 178.77 2kk2 h LEU 48 N 0.13 -0.23 -0.40 0.00 3.38 -0.86 -0.20 115.31 117.15 2kk2 h LEU 48 Ca 0.04 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2kk2 h LEU 48 Cb 0.01 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2kk2 h LEU 48 CO -0.01 -0.08 0.22 -0.07 0.09 0.00 0.00 178.44 178.59 2kk2 h LEU 49 N 0.04 0.34 -0.23 1.67 4.07 -0.73 0.19 115.31 120.65 2kk2 h LEU 49 Ca 0.16 0.01 -0.21 0.00 0.08 0.00 0.00 57.88 57.91 2kk2 h LEU 49 Cb 0.23 -0.06 0.01 0.00 1.08 0.00 0.00 40.66 41.91 2kk2 h LEU 49 CO -0.30 0.25 -0.79 -0.61 -1.08 0.00 0.00 178.44 175.91 2kk2 h GLN 50 N 0.44 0.64 0.48 1.13 5.75 -0.73 -0.71 115.11 122.12 2kk2 h GLN 50 Ca 0.16 -0.54 -0.02 0.00 -0.15 0.00 0.00 58.65 58.10 2kk2 h GLN 50 Cb 0.04 0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.71 2kk2 h GLN 50 CO -0.09 1.16 -0.23 0.00 -2.65 0.00 0.00 178.83 177.02 2kk2 h ALA 51 N 0.68 -1.00 -0.01 3.38 0.00 -0.98 -3.37 119.26 117.97 2kk2 h ALA 51 Ca -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2kk2 h ALA 51 Cb 1.40 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2kk2 h ALA 51 CO 0.15 -0.96 -0.00 0.41 0.00 0.00 0.00 179.25 178.85 2kk2 n GLY 52 N -0.83 -0.37 1.12 0.00 0.00 0.67 -4.56 105.19 101.22 2kk2 n GLY 52 Ca -0.08 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2kk2 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kk2 n ALA 53 N -0.27 0.00 -2.22 4.61 0.00 -0.27 -4.03 120.51 118.34 2kk2 n ALA 53 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.52 2kk2 n ALA 53 Cb 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 2kk2 n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kk2 s ALA 54 N -0.13 1.22 -0.05 0.00 0.00 -1.26 -5.04 121.76 116.50 2kk2 s ALA 54 Ca 0.00 -1.60 -0.04 0.00 0.00 0.00 0.00 51.96 50.32 2kk2 s ALA 54 Cb 0.00 0.79 -0.17 0.00 0.00 0.00 0.00 23.12 23.74 2kk2 s ALA 54 CO 0.00 -0.42 2.56 0.41 0.00 0.00 0.00 175.76 178.31 2kk2 n GLY 55 N -0.22 2.38 2.89 0.00 0.00 -1.26 -4.24 105.19 104.73 2kk2 n GLY 55 Ca -0.05 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.06 2kk2 n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kk2 s SER 56 N 2.38 0.59 0.00 1.61 0.01 -1.26 -5.02 113.70 112.00 2kk2 s SER 56 Ca 0.44 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.32 2kk2 s SER 56 Cb 0.21 1.01 0.00 0.00 0.21 0.00 0.00 66.02 67.44 2kk2 s SER 56 CO -0.00 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 173.90 2kk2 n GLY 57 N 5.35 0.87 1.37 3.44 0.00 -1.26 -5.00 105.19 109.96 2kk2 n GLY 57 Ca -0.00 -0.37 0.17 0.00 0.00 0.00 0.00 46.02 45.82 2kk2 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kk2 s ASP 59 N -6.84 7.06 -0.04 0.00 2.15 -1.26 -4.84 116.67 112.90 2kk2 s ASP 59 Ca 0.00 1.35 -0.02 0.00 0.43 0.00 0.00 52.55 54.32 2kk2 s ASP 59 Cb 0.00 -2.39 0.03 0.00 -0.30 0.00 0.00 42.92 40.26 2kk2 s ASP 59 CO 0.00 0.11 0.05 0.00 -0.17 0.00 0.00 175.17 175.16 2kk2 s MET 60 N -1.72 -0.05 0.00 4.34 0.23 -1.26 -1.76 119.30 119.08 2kk2 s MET 60 Ca 0.39 0.35 0.32 0.00 -1.03 0.00 0.00 55.69 55.71 2kk2 s MET 60 Cb -0.18 -0.50 1.91 0.00 -1.53 0.00 0.00 34.83 34.54 2kk2 s MET 60 CO 0.21 -0.31 2.23 0.39 -2.03 0.00 0.00 175.02 175.51