#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xkt h ASN 2218N 0.00 0.00 0.31 -1.34 2.35 -2.02 -3.15 115.58 111.73 1xkt h ASN 2218Ca 0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 1xkt h ASN 2218Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1xkt h ASN 2218CO 0.00 0.03 -0.64 -0.07 -1.65 0.00 0.00 177.43 175.10 1xkt h LEU 2219N 0.00 0.37 -0.44 1.61 4.07 -2.00 -3.04 115.31 115.87 1xkt h LEU 2219Ca -0.00 -0.22 0.00 0.00 0.08 0.00 0.00 57.88 57.74 1xkt h LEU 2219Cb 0.52 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1xkt h LEU 2219CO 0.00 0.91 0.00 0.54 -1.08 0.00 0.00 178.44 178.82 1xkt n ARG 2220N -3.86 0.18 -0.20 1.13 1.74 -1.19 -1.67 116.66 112.80 1xkt n ARG 2220Ca -0.03 0.34 0.08 0.00 -0.77 0.00 0.00 57.85 57.47 1xkt n ARG 2220Cb 0.65 -1.80 0.22 0.00 -1.02 0.00 0.00 32.46 30.51 1xkt n ARG 2220CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1xkt n SER 2221N -2.13 2.28 -0.31 0.55 3.41 -1.15 -3.00 113.62 113.27 1xkt n SER 2221Ca 0.03 -1.95 0.07 0.00 -0.26 0.00 0.00 58.87 56.76 1xkt n SER 2221Cb 0.27 -0.26 -0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1xkt n SER 2221CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xkt n LEU 2222N 0.74 1.45 -4.46 1.04 4.77 -0.67 -4.74 117.00 115.13 1xkt n LEU 2222Ca 0.15 -0.77 -0.31 0.00 -0.03 0.00 0.00 56.01 55.05 1xkt n LEU 2222Cb 0.37 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.34 1xkt n LEU 2222CO 0.11 0.28 -0.48 -0.76 -1.33 0.00 0.00 177.39 175.21 1xkt s LEU 2223N -1.83 2.64 0.40 2.23 1.02 -1.16 -4.81 118.68 117.18 1xkt s LEU 2223Ca 0.11 -0.39 0.06 0.00 0.02 0.00 0.00 54.13 53.94 1xkt s LEU 2223Cb 0.11 -1.54 -0.08 0.00 0.02 0.00 0.00 46.19 44.70 1xkt s LEU 2223CO 0.33 0.27 0.02 0.68 0.02 0.00 0.00 176.35 177.66 1xkt s VAL 2224N -0.90 1.87 -0.44 -1.59 -7.23 -1.26 -4.88 120.40 105.97 1xkt s VAL 2224Ca 0.14 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.09 1xkt s VAL 2224Cb -0.11 -2.95 0.02 0.00 0.56 0.00 0.00 36.38 33.91 1xkt s VAL 2224CO 0.05 0.00 0.72 0.21 -0.31 0.00 0.00 175.10 175.77 1xkt s ASN 2225N -3.69 6.37 0.53 4.85 3.04 -1.26 -4.86 114.94 119.92 1xkt s ASN 2225Ca 0.34 -0.22 0.33 0.00 0.04 0.00 0.00 52.86 53.36 1xkt s ASN 2225Cb 0.10 -2.35 1.49 0.00 -1.54 0.00 0.00 41.25 38.95 1xkt s ASN 2225CO 0.17 -0.85 1.84 -0.65 -3.04 0.00 0.00 177.10 174.57 1xkt h PRO 2226N 8.93 0.03 -0.34 0.43 0.11 -1.93 0.65 132.00 139.87 1xkt h PRO 2226Ca -0.25 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1xkt h PRO 2226Cb 1.09 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1xkt h PRO 2226CO 0.93 0.02 0.00 0.39 -0.21 0.00 0.00 178.00 179.13 1xkt n GLU 2227N -4.24 2.38 -0.94 1.05 4.71 -1.26 -2.20 120.64 120.14 1xkt n GLU 2227Ca 0.23 -2.09 -0.29 0.00 -0.01 0.00 0.00 57.16 55.00 1xkt n GLU 2227Cb 1.11 -1.49 0.20 0.00 -1.01 0.00 0.00 31.44 30.24 1xkt n GLU 2227CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1xkt s GLY 2228N -1.51 1.57 0.42 0.62 0.00 0.23 -5.00 107.32 103.64 1xkt s GLY 2228Ca 0.37 -0.23 -0.22 0.00 0.00 0.00 0.00 44.72 44.65 1xkt s GLY 2228CO 0.31 0.41 0.96 2.56 0.00 0.00 0.00 173.10 177.34 1xkt s PRO 2229N -4.77 4.24 -0.03 2.90 0.04 -1.26 -4.93 135.00 131.19 1xkt s PRO 2229Ca 0.66 1.18 -0.25 0.00 0.04 0.00 0.00 61.00 62.64 1xkt s PRO 2229Cb -0.21 -2.27 -0.19 0.00 0.04 0.00 0.00 34.50 31.87 1xkt s PRO 2229CO 0.60 -0.02 1.14 1.15 0.04 0.00 0.00 177.00 179.91 1xkt h THR 2230N 1.99 1.20 -3.76 1.26 2.02 -1.94 -3.43 112.91 110.25 1xkt h THR 2230Ca -0.49 -1.15 -0.63 0.00 0.77 0.00 0.00 66.41 64.91 1xkt h THR 2230Cb 1.19 1.92 -0.16 0.00 -1.74 0.00 0.00 68.15 69.36 1xkt h THR 2230CO 0.61 0.28 -0.52 -0.22 0.37 0.00 0.00 175.52 176.04 1xkt s LEU 2231N -9.14 4.03 -0.03 2.58 2.96 -1.26 -1.62 118.68 116.20 1xkt s LEU 2231Ca -0.15 0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1xkt s LEU 2231Cb 0.01 -2.11 0.02 0.00 0.50 0.00 0.00 46.19 44.61 1xkt s LEU 2231CO 0.61 -0.00 -0.05 0.00 -1.32 0.00 0.00 176.35 175.60 1xkt s MET 2232N 1.46 0.69 0.33 1.98 0.23 -0.70 -4.98 119.30 118.29 1xkt s MET 2232Ca 0.07 -0.12 -0.29 0.00 -1.03 0.00 0.00 55.69 54.32 1xkt s MET 2232Cb -0.15 -0.70 -0.10 0.00 -1.53 0.00 0.00 34.83 32.34 1xkt s MET 2232CO 0.08 -0.02 1.39 0.50 -2.03 0.00 0.00 175.02 174.94 1xkt s ARG 2233N 0.62 4.26 0.00 3.16 3.52 -1.26 -0.68 118.95 128.57 1xkt s ARG 2233Ca -0.08 2.35 0.14 0.00 -0.13 0.00 0.00 55.73 58.00 1xkt s ARG 2233Cb -0.11 -3.05 -0.01 0.00 -1.56 0.00 0.00 34.95 30.22 1xkt s ARG 2233CO -0.00 -0.35 0.76 1.28 -0.81 0.00 0.00 175.30 176.18 1xkt n LEU 2234N 1.07 1.42 -3.50 -0.88 4.77 0.69 -4.83 117.00 115.73 1xkt n LEU 2234Ca 0.02 -0.75 -0.12 0.00 -0.03 0.00 0.00 56.01 55.13 1xkt n LEU 2234Cb 0.41 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 1xkt n LEU 2234CO 0.61 0.28 0.32 0.54 -1.33 0.00 0.00 177.39 177.81 1xkt s ASN 2235N -1.72 -0.47 0.06 -1.43 2.20 -1.23 -4.51 114.94 107.84 1xkt s ASN 2235Ca 0.11 -0.02 -0.32 0.00 -0.94 0.00 0.00 52.86 51.68 1xkt s ASN 2235Cb 0.11 0.55 -0.19 0.00 -2.00 0.00 0.00 41.25 39.72 1xkt s ASN 2235CO 0.36 -0.88 1.58 0.28 -2.94 0.00 0.00 177.10 175.49 1xkt h SER 2236N 2.26 -0.76 0.00 3.54 0.02 -1.94 -3.43 113.55 113.24 1xkt h SER 2236Ca -0.33 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1xkt h SER 2236Cb 1.27 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.01 1xkt h SER 2236CO 0.41 -0.52 0.00 0.52 -1.14 0.00 0.00 176.83 176.09 1xkt n VAL 2237N -5.47 0.00 1.57 2.27 0.31 -1.26 -4.74 118.33 111.01 1xkt n VAL 2237Ca -0.13 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.35 1xkt n VAL 2237Cb 0.37 0.00 0.81 0.00 -0.91 0.00 0.00 33.84 34.10 1xkt n VAL 2237CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xkt n GLN 2238N 0.20 0.58 -0.73 5.55 1.13 -1.26 -4.44 117.38 118.40 1xkt n GLN 2238Ca 0.00 0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 54.78 1xkt n GLN 2238Cb 0.00 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 28.87 1xkt n GLN 2238CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1xkt n SER 2239N -1.21 -2.19 -0.28 1.08 2.88 -1.26 -4.93 113.62 107.71 1xkt n SER 2239Ca 0.17 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.74 1xkt n SER 2239Cb 0.20 -0.37 0.04 0.00 -0.75 0.00 0.00 64.21 63.33 1xkt n SER 2239CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xkt n SER 2240N 2.57 1.75 -4.75 -3.46 3.41 -1.26 -4.92 113.62 106.96 1xkt n SER 2240Ca -0.01 -1.43 -0.31 0.00 -0.26 0.00 0.00 58.87 56.86 1xkt n SER 2240Cb 0.55 -0.03 0.11 0.00 -0.26 0.00 0.00 64.21 64.57 1xkt n SER 2240CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1xkt s GLU 2241N -0.63 1.98 0.27 4.33 2.02 -1.26 -4.96 118.70 120.45 1xkt s GLU 2241Ca 0.09 1.20 -0.30 0.00 0.02 0.00 0.00 54.97 55.98 1xkt s GLU 2241Cb 0.06 -1.86 -0.10 0.00 0.10 0.00 0.00 34.13 32.32 1xkt s GLU 2241CO 0.08 -1.85 1.46 1.03 0.02 0.00 0.00 175.26 176.01 1xkt s ARG 2242N -4.86 4.24 0.84 1.61 0.52 -1.26 -4.75 118.95 115.29 1xkt s ARG 2242Ca 0.62 2.36 -0.12 0.00 -0.52 0.00 0.00 55.73 58.08 1xkt s ARG 2242Cb -0.18 -3.08 0.10 0.00 0.52 0.00 0.00 34.95 32.30 1xkt s ARG 2242CO 0.56 -0.45 1.12 -2.14 0.02 0.00 0.00 175.30 174.41 1xkt s PRO 2243N -0.58 1.69 -0.23 3.54 0.02 -1.26 -4.73 135.00 133.46 1xkt s PRO 2243Ca 0.59 0.42 -0.04 0.00 0.02 0.00 0.00 61.00 61.98 1xkt s PRO 2243Cb -0.43 -1.89 -0.01 0.00 0.02 0.00 0.00 34.50 32.19 1xkt s PRO 2243CO 0.46 -1.84 -0.03 -1.17 -0.33 0.00 0.00 177.00 174.08 1xkt s LEU 2244N -5.85 2.98 -0.24 -5.54 2.96 -0.55 -4.02 118.68 108.42 1xkt s LEU 2244Ca 0.62 -0.40 -0.13 0.00 -0.22 0.00 0.00 54.13 54.00 1xkt s LEU 2244Cb -0.14 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1xkt s LEU 2244CO 0.53 -0.03 0.29 -0.36 -1.32 0.00 0.00 176.35 175.46 1xkt s PHE 2245N 1.49 3.31 -0.24 5.38 0.40 0.14 -0.83 117.98 127.64 1xkt s PHE 2245Ca 0.06 0.39 -0.10 0.00 -0.60 0.00 0.00 56.93 56.67 1xkt s PHE 2245Cb -0.14 -2.43 -0.05 0.00 0.51 0.00 0.00 43.02 40.91 1xkt s PHE 2245CO -0.03 -0.04 0.14 -0.51 0.70 0.00 0.00 175.22 175.49 1xkt s LEU 2246N 1.40 4.00 -0.27 -0.37 1.43 -0.08 -0.49 118.68 124.29 1xkt s LEU 2246Ca 0.13 0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.18 1xkt s LEU 2246Cb -0.15 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 1xkt s LEU 2246CO 0.07 0.06 0.21 -0.69 0.23 0.00 0.00 176.35 176.24 1xkt s VAL 2247N 1.07 5.30 0.79 -1.59 1.01 0.11 -0.20 120.40 126.88 1xkt s VAL 2247Ca 0.07 0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.12 1xkt s VAL 2247Cb -0.14 -3.55 -0.06 0.00 0.00 0.00 0.00 36.38 32.63 1xkt s VAL 2247CO 0.04 0.25 0.15 0.00 0.00 0.00 0.00 175.10 175.54 1xkt n HIS 2248N 5.01 -2.09 -1.21 5.22 1.44 -1.11 -1.65 115.22 120.83 1xkt n HIS 2248Ca -0.13 0.27 -0.12 0.00 -2.01 0.00 0.00 57.72 55.73 1xkt n HIS 2248Cb 0.52 -1.76 0.08 0.00 0.12 0.00 0.00 29.99 28.95 1xkt n HIS 2248CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1xkt n PRO 2249N 0.03 -0.81 -0.05 -1.40 -0.04 -1.25 -2.19 135.00 129.30 1xkt n PRO 2249Ca 0.07 -0.77 0.11 0.00 -0.04 0.00 0.00 63.50 62.87 1xkt n PRO 2249Cb 0.51 -0.56 0.51 0.00 -0.04 0.00 0.00 33.50 33.93 1xkt n PRO 2249CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1xkt h ILE 2250N -1.46 0.92 0.00 0.52 2.10 -1.92 -1.78 117.51 115.89 1xkt h ILE 2250Ca -0.17 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 65.64 1xkt h ILE 2250Cb 0.47 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 36.70 1xkt h ILE 2250CO 0.12 0.07 0.00 -1.84 -1.08 0.00 0.00 178.15 175.41 1xkt n GLU 2251N -4.47 0.30 -0.13 2.19 0.00 -1.26 -4.89 120.64 112.39 1xkt n GLU 2251Ca 0.08 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.33 1xkt n GLU 2251Cb 0.33 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.27 1xkt n GLU 2251CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xkt n GLY 2252N -0.12 2.53 3.95 -1.84 0.00 -0.67 -4.62 105.19 104.43 1xkt n GLY 2252Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1xkt n GLY 2252CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xkt s SER 2253N -3.73 6.33 -0.25 1.61 1.04 -1.26 -0.76 113.70 116.68 1xkt s SER 2253Ca 0.00 0.21 0.14 0.00 0.48 0.00 0.00 55.95 56.78 1xkt s SER 2253Cb 0.00 -1.92 0.71 0.00 0.10 0.00 0.00 66.02 64.91 1xkt s SER 2253CO 0.00 -0.10 1.67 0.35 0.98 0.00 0.00 173.24 176.14 1xkt n THR 2254N -1.26 2.68 -0.14 2.02 -2.24 -1.26 -4.04 114.28 110.05 1xkt n THR 2254Ca -0.07 -1.66 -0.08 0.00 -2.27 0.00 0.00 64.05 59.97 1xkt n THR 2254Cb 0.56 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1xkt n THR 2254CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1xkt h THR 2255N 2.95 1.13 -0.06 4.28 2.02 -1.95 -2.46 112.91 118.83 1xkt h THR 2255Ca 0.08 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 66.98 1xkt h THR 2255Cb 1.92 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.89 1xkt h THR 2255CO 0.48 0.13 0.18 -0.37 0.37 0.00 0.00 175.52 176.31 1xkt h VAL 2256N 0.56 0.15 -0.10 3.16 -1.51 -1.92 -0.51 116.25 116.08 1xkt h VAL 2256Ca 0.15 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.62 1xkt h VAL 2256Cb -0.01 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 29.99 1xkt h VAL 2256CO -0.03 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.80 1xkt n PHE 2257N -3.25 0.12 -0.01 5.19 0.99 -0.93 -4.36 117.46 115.21 1xkt n PHE 2257Ca -0.01 -0.06 -0.12 0.00 -0.00 0.00 0.00 57.45 57.26 1xkt n PHE 2257Cb 0.26 0.00 -0.07 0.00 -1.00 0.00 0.00 39.48 38.67 1xkt n PHE 2257CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1xkt h HIS 2258N 1.96 0.10 0.82 1.38 3.86 -1.17 -2.25 115.15 119.85 1xkt h HIS 2258Ca 0.00 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1xkt h HIS 2258Cb 0.43 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 1xkt h HIS 2258CO 0.06 0.28 -0.49 0.77 0.86 0.00 0.00 177.93 179.41 1xkt h SER 2259N -0.11 -1.23 -0.65 2.45 0.02 -1.81 -2.27 113.55 109.95 1xkt h SER 2259Ca 0.02 0.07 0.12 0.00 -0.84 0.00 0.00 61.79 61.16 1xkt h SER 2259Cb 0.23 0.36 -0.12 0.00 0.14 0.00 0.00 62.40 63.00 1xkt h SER 2259CO -0.00 -0.76 -0.28 0.25 -1.14 0.00 0.00 176.83 174.90 1xkt h LEU 2260N -1.22 -0.99 -0.67 5.07 5.85 -1.81 -2.31 115.31 119.23 1xkt h LEU 2260Ca -0.11 0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1xkt h LEU 2260Cb 0.97 0.54 -0.03 0.00 0.37 0.00 0.00 40.66 42.51 1xkt h LEU 2260CO 0.12 -0.28 0.36 0.00 -0.34 0.00 0.00 178.44 178.30 1xkt h ALA 2261N 1.27 0.86 -0.41 1.25 0.00 -1.36 -2.58 119.26 118.30 1xkt h ALA 2261Ca 0.28 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xkt h ALA 2261Cb 0.54 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1xkt h ALA 2261CO -0.71 0.39 0.27 0.66 0.00 0.00 0.00 179.25 179.86 1xkt h SER 2262N 0.92 0.44 -1.00 0.00 4.64 -0.85 -2.58 113.55 115.13 1xkt h SER 2262Ca 0.24 -0.01 -0.64 0.00 -0.47 0.00 0.00 61.79 60.90 1xkt h SER 2262Cb 0.06 -0.11 -0.29 0.00 -0.31 0.00 0.00 62.40 61.75 1xkt h SER 2262CO -0.04 0.32 0.82 -1.14 -0.87 0.00 0.00 176.83 175.92 1xkt n ARG 2263N -4.48 2.60 -4.94 4.77 0.63 -0.98 -4.94 116.66 109.33 1xkt n ARG 2263Ca 0.04 -3.24 -0.27 0.00 -0.92 0.00 0.00 57.85 53.46 1xkt n ARG 2263Cb 0.09 -2.27 -0.15 0.00 0.45 0.00 0.00 32.46 30.58 1xkt n ARG 2263CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1xkt s LEU 2264N -3.72 2.07 0.00 6.15 2.96 -0.97 -5.00 118.68 120.17 1xkt s LEU 2264Ca 0.63 -0.42 0.24 0.00 -0.22 0.00 0.00 54.13 54.36 1xkt s LEU 2264Cb 0.50 -1.06 1.01 0.00 0.50 0.00 0.00 46.19 47.14 1xkt s LEU 2264CO 0.02 0.24 1.70 -1.54 -1.32 0.00 0.00 176.35 175.44 1xkt n SER 2265N 2.37 1.20 -4.52 3.68 3.41 -1.26 -4.86 113.62 113.64 1xkt n SER 2265Ca -0.16 -1.53 -0.25 0.00 -0.26 0.00 0.00 58.87 56.67 1xkt n SER 2265Cb 0.53 -0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 1xkt n SER 2265CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1xkt s ILE 2266N -1.91 2.83 -0.02 -1.33 -4.36 -1.26 -4.87 121.20 110.28 1xkt s ILE 2266Ca 0.35 -2.07 -0.30 0.00 -0.26 0.00 0.00 60.65 58.37 1xkt s ILE 2266Cb 0.18 -2.45 -0.06 0.00 1.25 0.00 0.00 42.46 41.38 1xkt s ILE 2266CO 0.29 -0.28 1.58 -2.16 0.24 0.00 0.00 174.94 174.60 1xkt s PRO 2267N -3.26 4.21 -0.02 0.37 0.04 -1.26 -4.86 135.00 130.22 1xkt s PRO 2267Ca 0.28 2.15 0.07 0.00 0.04 0.00 0.00 61.00 63.54 1xkt s PRO 2267Cb -0.07 -3.79 -0.02 0.00 0.04 0.00 0.00 34.50 30.67 1xkt s PRO 2267CO 0.15 -0.75 -0.24 0.95 0.04 0.00 0.00 177.00 177.15 1xkt s THR 2268N 3.31 1.90 0.39 1.26 -4.23 -1.26 -1.48 115.64 115.53 1xkt s THR 2268Ca 0.70 -1.02 0.08 0.00 -1.18 0.00 0.00 61.69 60.27 1xkt s THR 2268Cb -0.34 -1.58 -0.06 0.00 1.34 0.00 0.00 72.50 71.86 1xkt s THR 2268CO 0.29 0.54 0.10 -0.31 -0.54 0.00 0.00 174.62 174.69 1xkt s TYR 2269N -0.53 2.57 0.04 3.99 1.51 -0.01 -0.22 117.35 124.71 1xkt s TYR 2269Ca 0.08 -0.56 0.05 0.00 -1.01 0.00 0.00 57.07 55.63 1xkt s TYR 2269Cb -0.10 -1.79 -0.02 0.00 -0.11 0.00 0.00 41.96 39.94 1xkt s TYR 2269CO -0.01 0.33 -0.15 0.20 -1.11 0.00 0.00 175.55 174.81 1xkt s GLY 2270N -3.81 0.83 -0.22 0.71 0.00 0.14 -0.91 107.32 104.07 1xkt s GLY 2270Ca 0.38 -0.86 -0.02 0.00 0.00 0.00 0.00 44.72 44.22 1xkt s GLY 2270CO 0.21 -0.84 -0.09 1.08 0.00 0.00 0.00 173.10 173.45 1xkt s LEU 2271N -1.20 2.79 0.14 0.66 1.43 0.71 -1.73 118.68 121.49 1xkt s LEU 2271Ca 0.02 -0.63 0.06 0.00 -1.03 0.00 0.00 54.13 52.55 1xkt s LEU 2271Cb -0.08 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1xkt s LEU 2271CO 0.01 -0.05 0.01 0.00 0.23 0.00 0.00 176.35 176.56 1xkt s GLN 2272N 1.37 2.50 -0.45 1.70 -2.07 -0.64 -2.73 119.66 119.34 1xkt s GLN 2272Ca 0.04 -0.99 -0.19 0.00 -1.82 0.00 0.00 55.36 52.40 1xkt s GLN 2272Cb -0.15 -2.45 0.03 0.00 -1.09 0.00 0.00 33.01 29.35 1xkt s GLN 2272CO -0.06 0.49 0.58 0.00 -1.32 0.00 0.00 175.29 174.97 1xkt n THR 2274N 5.67 0.00 0.33 0.00 -2.24 -1.26 -4.82 114.28 111.96 1xkt n THR 2274Ca -0.05 -1.24 0.23 0.00 -2.27 0.00 0.00 64.05 60.72 1xkt n THR 2274Cb 0.47 -0.10 1.19 0.00 -2.10 0.00 0.00 70.33 69.79 1xkt n THR 2274CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1xkt h ARG 2275N 0.00 0.00 -0.15 -0.78 2.43 -1.74 -2.12 114.38 112.02 1xkt h ARG 2275Ca -0.20 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.85 1xkt h ARG 2275Cb 0.71 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1xkt h ARG 2275CO 0.33 0.00 -0.42 0.00 -1.51 0.00 0.00 179.97 178.36 1xkt h ALA 2276N 2.00 1.00 -2.53 2.80 0.00 -1.94 -3.45 119.26 117.15 1xkt h ALA 2276Ca 0.00 -0.43 -0.53 0.00 0.00 0.00 0.00 54.91 53.95 1xkt h ALA 2276Cb 0.04 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.75 1xkt h ALA 2276CO 0.00 0.62 0.71 0.00 0.00 0.00 0.00 179.25 180.58 1xkt s ALA 2277N -4.14 3.57 0.01 0.00 0.00 -0.80 -5.00 121.76 115.39 1xkt s ALA 2277Ca -0.05 1.07 -0.30 0.00 0.00 0.00 0.00 51.96 52.68 1xkt s ALA 2277Cb 0.13 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1xkt s ALA 2277CO 0.79 -0.61 1.12 -1.25 0.00 0.00 0.00 175.76 175.81 1xkt s PRO 2278N 1.17 4.45 -0.15 0.00 0.04 -1.26 -4.93 135.00 134.32 1xkt s PRO 2278Ca 0.64 1.62 0.16 0.00 0.04 0.00 0.00 61.00 63.45 1xkt s PRO 2278Cb -0.36 -3.44 0.49 0.00 0.04 0.00 0.00 34.50 31.23 1xkt s PRO 2278CO 0.30 -0.24 1.39 1.28 0.04 0.00 0.00 177.00 179.77 1xkt n LEU 2279N 4.25 3.69 0.26 -3.56 4.32 -1.26 -3.47 117.00 121.24 1xkt n LEU 2279Ca 0.08 -2.87 0.12 0.00 -0.02 0.00 0.00 56.01 53.33 1xkt n LEU 2279Cb 0.48 -0.49 0.71 0.00 -1.62 0.00 0.00 43.42 42.50 1xkt n LEU 2279CO 0.54 0.68 0.97 -2.24 -1.22 0.00 0.00 177.39 176.12 1xkt h ASP 2280N 1.76 0.00 -4.37 -1.43 3.04 -1.91 -3.42 116.42 110.10 1xkt h ASP 2280Ca 0.00 0.00 0.19 0.00 -3.24 0.00 0.00 57.03 53.98 1xkt h ASP 2280Cb 1.32 0.00 -0.18 0.00 -1.04 0.00 0.00 39.33 39.44 1xkt h ASP 2280CO 0.18 0.12 0.68 -0.94 -2.04 0.00 0.00 179.24 177.25 1xkt s SER 2281N -6.17 -0.23 0.37 4.15 1.04 -1.26 -4.75 113.70 106.84 1xkt s SER 2281Ca -0.03 0.02 0.04 0.00 0.48 0.00 0.00 55.95 56.46 1xkt s SER 2281Cb 0.13 0.24 0.71 0.00 0.10 0.00 0.00 66.02 67.19 1xkt s SER 2281CO 0.59 -0.38 2.02 0.40 0.98 0.00 0.00 173.24 176.85 1xkt h ILE 2282N 2.02 1.15 0.02 -1.02 1.08 -1.88 -0.70 117.51 118.18 1xkt h ILE 2282Ca -0.14 -0.28 0.01 0.00 -0.39 0.00 0.00 64.86 64.05 1xkt h ILE 2282Cb 1.19 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 1xkt h ILE 2282CO 0.26 0.14 -0.05 0.45 -0.69 0.00 0.00 178.15 178.27 1xkt h HIS 2283N 0.75 -0.12 -0.42 1.37 3.86 -1.95 0.22 115.15 118.86 1xkt h HIS 2283Ca 0.20 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.39 1xkt h HIS 2283Cb -0.07 0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 1xkt h HIS 2283CO 0.00 -0.08 0.18 0.77 0.86 0.00 0.00 177.93 179.67 1xkt h SER 2284N -0.10 0.56 -0.82 2.45 0.02 -1.75 -1.13 113.55 112.79 1xkt h SER 2284Ca 0.01 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 60.83 1xkt h SER 2284Cb 0.11 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1xkt h SER 2284CO -0.03 0.55 0.54 0.25 -1.14 0.00 0.00 176.83 177.00 1xkt h LEU 2285N 0.53 0.92 -0.02 5.07 5.85 -0.88 -1.77 115.31 125.01 1xkt h LEU 2285Ca 0.14 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1xkt h LEU 2285Cb 0.15 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 1xkt h LEU 2285CO -0.01 0.66 -0.03 0.00 -0.34 0.00 0.00 178.44 178.71 1xkt h ALA 2286N 1.50 0.04 -0.95 1.25 0.00 -0.63 -2.38 119.26 118.08 1xkt h ALA 2286Ca 0.31 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 55.08 1xkt h ALA 2286Cb -0.08 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 1xkt h ALA 2286CO -0.07 -0.19 0.61 0.00 0.00 0.00 0.00 179.25 179.59 1xkt h ALA 2287N 0.51 1.65 -0.33 0.00 0.00 -0.94 0.13 119.26 120.28 1xkt h ALA 2287Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1xkt h ALA 2287Cb 0.54 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1xkt h ALA 2287CO 0.01 0.11 -0.34 -0.92 0.00 0.00 0.00 179.25 178.11 1xkt h TYR 2288N 0.87 0.97 -0.21 0.00 3.20 -1.33 -2.62 116.97 117.85 1xkt h TYR 2288Ca 0.47 -0.30 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1xkt h TYR 2288Cb 0.57 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1xkt h TYR 2288CO -0.00 1.08 -0.22 1.88 -1.64 0.00 0.00 178.16 179.26 1xkt h TYR 2289N 0.59 0.42 -0.51 -3.82 0.99 -0.67 -1.98 116.97 111.98 1xkt h TYR 2289Ca 0.05 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1xkt h TYR 2289Cb 0.92 -0.11 -0.02 0.00 1.00 0.00 0.00 36.73 38.52 1xkt h TYR 2289CO 0.07 0.58 0.27 0.82 -0.00 0.00 0.00 178.16 179.90 1xkt h ILE 2290N 0.34 1.18 -0.89 -2.88 2.04 -0.68 -1.06 117.51 115.56 1xkt h ILE 2290Ca 0.06 -0.47 0.02 0.00 1.00 0.00 0.00 64.86 65.47 1xkt h ILE 2290Cb 0.59 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.18 1xkt h ILE 2290CO 0.04 0.19 0.59 0.44 0.00 0.00 0.00 178.15 179.41 1xkt h ASP 2291N 0.68 1.00 -0.01 1.72 3.32 -1.03 -0.19 116.42 121.90 1xkt h ASP 2291Ca 0.18 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1xkt h ASP 2291Cb 0.07 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1xkt h ASP 2291CO -0.03 0.71 -0.29 0.00 -1.72 0.00 0.00 179.24 177.91 1xkt h ILE 2293N 0.39 0.46 0.00 0.00 2.04 0.04 -3.07 117.51 117.37 1xkt h ILE 2293Ca 0.05 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1xkt h ILE 2293Cb 0.70 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1xkt h ILE 2293CO 0.05 0.07 0.22 0.54 0.00 0.00 0.00 178.15 179.03 1xkt n ARG 2294N -5.24 0.00 0.07 2.37 1.74 -0.21 -0.09 116.66 115.31 1xkt n ARG 2294Ca -0.10 0.23 -0.20 0.00 -0.77 0.00 0.00 57.85 57.01 1xkt n ARG 2294Cb 0.30 -1.72 -0.15 0.00 -1.02 0.00 0.00 32.46 29.87 1xkt n ARG 2294CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1xkt h GLN 2295N 0.00 0.32 0.08 5.56 4.20 -1.57 -3.02 115.11 120.69 1xkt h GLN 2295Ca 0.00 -0.55 -0.28 0.00 0.06 0.00 0.00 58.65 57.87 1xkt h GLN 2295Cb 0.44 0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1xkt h GLN 2295CO 0.00 1.21 -1.44 0.28 -0.67 0.00 0.00 178.83 178.21 1xkt h VAL 2296N 0.09 1.24 -2.68 -0.54 2.07 -0.62 -3.42 116.25 112.39 1xkt h VAL 2296Ca -0.28 -2.92 -0.55 0.00 0.82 0.00 0.00 66.70 63.77 1xkt h VAL 2296Cb 2.06 2.74 -0.39 0.00 -1.52 0.00 0.00 31.29 34.18 1xkt h VAL 2296CO 0.18 0.81 -0.81 -1.58 0.02 0.00 0.00 177.57 176.18 1xkt s GLN 2297N -2.63 0.36 0.42 1.57 0.74 -0.45 -5.03 119.66 114.65 1xkt s GLN 2297Ca -0.06 -0.90 0.09 0.00 0.05 0.00 0.00 55.36 54.53 1xkt s GLN 2297Cb 0.08 -1.21 0.92 0.00 1.10 0.00 0.00 33.01 33.89 1xkt s GLN 2297CO 0.85 -1.11 2.06 -1.35 -0.55 0.00 0.00 175.29 175.18 1xkt h PRO 2298N 7.74 0.48 -6.46 1.67 0.11 -1.78 -3.35 132.00 130.41 1xkt h PRO 2298Ca -0.07 -0.03 -0.54 0.00 0.11 0.00 0.00 66.00 65.47 1xkt h PRO 2298Cb 0.99 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.96 1xkt h PRO 2298CO 0.35 0.32 0.12 -1.21 -0.21 0.00 0.00 178.00 177.37 1xkt s GLU 2299N -5.45 4.46 0.16 1.05 8.01 -1.26 -4.94 118.70 120.74 1xkt s GLU 2299Ca -0.08 1.04 -0.08 0.00 0.01 0.00 0.00 54.97 55.86 1xkt s GLU 2299Cb 0.18 -3.23 0.23 0.00 -4.31 0.00 0.00 34.13 27.00 1xkt s GLU 2299CO 0.73 0.58 0.98 0.41 0.01 0.00 0.00 175.26 177.97 1xkt n GLY 2300N 1.56 -1.16 3.57 -1.39 0.00 -1.26 -4.57 105.19 101.94 1xkt n GLY 2300Ca -0.07 0.69 -0.39 0.00 0.00 0.00 0.00 46.02 46.25 1xkt n GLY 2300CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xkt s PRO 2301N -5.71 2.62 0.01 1.61 0.04 -1.26 -4.92 135.00 127.39 1xkt s PRO 2301Ca -0.09 1.29 0.04 0.00 0.04 0.00 0.00 61.00 62.28 1xkt s PRO 2301Cb 0.15 -4.43 -0.03 0.00 0.04 0.00 0.00 34.50 30.23 1xkt s PRO 2301CO 0.47 -2.70 -0.09 0.71 0.04 0.00 0.00 177.00 175.43 1xkt s TYR 2302N 9.82 2.82 -0.35 0.56 1.51 -1.26 -5.00 117.35 125.44 1xkt s TYR 2302Ca 0.87 -0.08 -0.04 0.00 -1.01 0.00 0.00 57.07 56.80 1xkt s TYR 2302Cb -0.19 -1.59 0.06 0.00 -0.11 0.00 0.00 41.96 40.13 1xkt s TYR 2302CO 0.27 0.34 0.11 1.03 -1.11 0.00 0.00 175.55 176.19 1xkt s ARG 2303N -1.37 2.42 -0.01 -0.62 0.52 -1.26 -1.23 118.95 117.40 1xkt s ARG 2303Ca 0.16 -1.39 0.03 0.00 -0.52 0.00 0.00 55.73 54.02 1xkt s ARG 2303Cb -0.11 -3.44 -0.01 0.00 0.52 0.00 0.00 34.95 31.92 1xkt s ARG 2303CO 0.07 -0.78 -0.11 0.54 0.02 0.00 0.00 175.30 175.04 1xkt s VAL 2304N 1.30 0.87 0.08 3.52 0.11 -0.52 -0.68 120.40 125.07 1xkt s VAL 2304Ca -0.00 -0.45 0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1xkt s VAL 2304Cb -0.21 -0.74 -0.03 0.00 -1.53 0.00 0.00 36.38 33.88 1xkt s VAL 2304CO -0.00 0.25 -0.17 0.00 -3.33 0.00 0.00 175.10 171.85 1xkt s ALA 2305N -0.13 1.47 -0.03 1.54 0.00 0.36 -1.44 121.76 123.52 1xkt s ALA 2305Ca 0.02 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1xkt s ALA 2305Cb -0.06 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.91 1xkt s ALA 2305CO -0.00 0.26 -0.02 0.20 0.00 0.00 0.00 175.76 176.20 1xkt s GLY 2306N -1.74 0.31 -0.23 0.00 0.00 -0.11 0.06 107.32 105.61 1xkt s GLY 2306Ca 0.02 0.05 -0.13 0.00 0.00 0.00 0.00 44.72 44.67 1xkt s GLY 2306CO 0.03 0.45 0.27 -0.47 0.00 0.00 0.00 173.10 173.38 1xkt s TYR 2307N 0.84 3.32 0.00 1.90 5.04 -0.66 -1.16 117.35 126.63 1xkt s TYR 2307Ca -0.10 0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.91 1xkt s TYR 2307Cb -0.13 -2.40 0.00 0.00 0.35 0.00 0.00 41.96 39.78 1xkt s TYR 2307CO -0.01 -0.02 0.00 0.45 -1.34 0.00 0.00 175.55 174.63 1xkt n SER 2308N 4.55 0.00 -0.34 4.32 2.88 -0.20 -0.67 113.62 124.16 1xkt n SER 2308Ca -0.12 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 1xkt n SER 2308Cb 0.52 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.14 1xkt n SER 2308CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1xkt h TYR 2309N 0.00 1.17 0.00 0.66 3.20 -1.82 -1.05 116.97 119.12 1xkt h TYR 2309Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1xkt h TYR 2309Cb 0.00 -0.39 -0.00 0.00 1.54 0.00 0.00 36.73 37.88 1xkt h TYR 2309CO 0.00 0.68 -0.07 0.78 -1.64 0.00 0.00 178.16 177.91 1xkt h GLY 2310N 1.21 0.00 0.22 1.82 0.00 -0.39 -2.62 103.07 103.30 1xkt h GLY 2310Ca 0.37 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.75 1xkt h GLY 2310CO -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 176.54 176.12 1xkt h ALA 2311N 1.93 -0.37 -0.67 3.60 0.00 -1.07 0.61 119.26 123.28 1xkt h ALA 2311Ca -0.00 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1xkt h ALA 2311Cb 0.15 0.57 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1xkt h ALA 2311CO 0.01 -0.79 0.31 0.00 0.00 0.00 0.00 179.25 178.78 1xkt h VAL 2313N 0.54 1.26 -0.83 0.00 2.07 -1.28 -1.80 116.25 116.21 1xkt h VAL 2313Ca 0.33 -0.92 0.11 0.00 0.82 0.00 0.00 66.70 67.04 1xkt h VAL 2313Cb 0.36 1.43 -0.08 0.00 -1.52 0.00 0.00 31.29 31.48 1xkt h VAL 2313CO -0.28 0.28 0.47 0.00 0.02 0.00 0.00 177.57 178.07 1xkt h ALA 2314N 0.79 1.20 0.25 1.67 0.00 0.84 -0.36 119.26 123.65 1xkt h ALA 2314Ca 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xkt h ALA 2314Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xkt h ALA 2314CO 0.01 0.06 -0.12 0.35 0.00 0.00 0.00 179.25 179.55 1xkt h PHE 2315N 0.76 -0.31 -0.42 0.00 3.57 -0.78 -1.99 116.94 117.76 1xkt h PHE 2315Ca 0.41 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.96 1xkt h PHE 2315Cb 0.43 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1xkt h PHE 2315CO -0.07 -0.18 0.29 1.49 -2.23 0.00 0.00 178.31 177.61 1xkt h GLU 2316N -0.36 0.36 0.36 1.11 4.57 -0.76 0.18 114.58 120.04 1xkt h GLU 2316Ca -0.03 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1xkt h GLU 2316Cb 0.27 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 1xkt h GLU 2316CO 0.06 0.24 -0.17 0.52 -1.18 0.00 0.00 179.01 178.47 1xkt h MET 2317N 0.37 -0.46 0.00 1.92 2.86 -0.69 -0.59 114.93 118.35 1xkt h MET 2317Ca 0.18 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.82 1xkt h MET 2317Cb 0.26 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 1xkt h MET 2317CO -0.04 -0.15 -0.14 0.00 1.06 0.00 0.00 176.91 177.64 1xkt h SER 2319N 0.00 0.94 0.37 0.00 0.87 -0.42 -1.38 113.55 113.93 1xkt h SER 2319Ca -0.00 -0.24 -0.26 0.00 -1.23 0.00 0.00 61.79 60.06 1xkt h SER 2319Cb 0.26 -0.25 0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1xkt h SER 2319CO 0.02 0.98 -1.10 1.56 -0.53 0.00 0.00 176.83 177.75 1xkt h GLN 2320N 0.90 0.43 -0.01 2.24 4.20 -0.06 -2.80 115.11 120.00 1xkt h GLN 2320Ca 0.17 -0.55 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 1xkt h GLN 2320Cb 0.49 0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 1xkt h GLN 2320CO 0.02 1.21 -0.09 -0.07 -0.67 0.00 0.00 178.83 179.23 1xkt h LEU 2321N 0.20 0.02 0.32 1.46 3.38 -0.93 -0.88 115.31 118.88 1xkt h LEU 2321Ca -0.12 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1xkt h LEU 2321Cb 1.77 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.52 1xkt h LEU 2321CO 0.19 0.11 -0.15 -0.61 0.09 0.00 0.00 178.44 178.07 1xkt h GLN 2322N 0.02 -0.42 -0.11 1.13 4.15 -1.15 -3.12 115.11 115.61 1xkt h GLN 2322Ca 0.00 0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.48 1xkt h GLN 2322Cb 0.18 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.96 1xkt h GLN 2322CO 0.01 -0.28 0.36 0.00 -1.93 0.00 0.00 178.83 176.99 1xkt h ALA 2323N -1.60 1.55 0.00 3.38 0.00 -1.36 -3.52 119.26 117.72 1xkt h ALA 2323Ca -0.04 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 1xkt h ALA 2323Cb 0.33 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1xkt h ALA 2323CO 0.07 -0.42 -2.02 1.04 0.00 0.00 0.00 179.25 177.92 1xkt n GLN 2324N -3.13 0.92 -1.14 0.00 6.02 -0.35 -5.10 117.38 114.61 1xkt n GLN 2324Ca 0.01 -0.08 -0.05 0.00 -0.01 0.00 0.00 57.00 56.87 1xkt n GLN 2324Cb 0.44 -1.44 -0.02 0.00 1.02 0.00 0.00 30.24 30.25 1xkt n GLN 2324CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 177.06 173.66 1xkt n HIS 2331N -2.41 0.00 -3.94 1.08 1.44 -1.26 -5.03 115.22 105.10 1xkt n HIS 2331Ca -0.17 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.27 1xkt n HIS 2331Cb 0.80 -1.17 -0.03 0.00 0.12 0.00 0.00 29.99 29.70 1xkt n HIS 2331CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1xkt s ASN 2332N -2.80 6.35 -0.10 4.39 0.01 -1.26 -4.67 114.94 116.85 1xkt s ASN 2332Ca 0.00 0.20 -0.18 0.00 -0.71 0.00 0.00 52.86 52.17 1xkt s ASN 2332Cb 0.00 -1.93 -0.04 0.00 0.41 0.00 0.00 41.25 39.69 1xkt s ASN 2332CO 0.00 0.09 0.49 -0.44 -1.51 0.00 0.00 177.10 175.72 1xkt s SER 2333N -3.02 6.72 -0.20 -1.22 0.01 -0.37 -4.52 113.70 111.10 1xkt s SER 2333Ca 0.35 0.86 0.00 0.00 1.31 0.00 0.00 55.95 58.47 1xkt s SER 2333Cb -0.12 -2.29 0.05 0.00 0.21 0.00 0.00 66.02 63.87 1xkt s SER 2333CO 0.28 0.03 -0.06 -0.22 0.41 0.00 0.00 173.24 173.68 1xkt s LEU 2334N 0.45 2.15 -0.14 2.44 2.96 -1.24 -1.44 118.68 123.85 1xkt s LEU 2334Ca 0.26 -0.94 -0.02 0.00 -0.22 0.00 0.00 54.13 53.21 1xkt s LEU 2334Cb -0.16 -1.09 -0.02 0.00 0.50 0.00 0.00 46.19 45.42 1xkt s LEU 2334CO 0.11 -0.20 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.51 1xkt s PHE 2335N 1.49 2.95 -0.29 5.38 0.40 -0.52 -1.78 117.98 125.61 1xkt s PHE 2335Ca -0.03 -0.39 -0.02 0.00 -0.60 0.00 0.00 56.93 55.89 1xkt s PHE 2335Cb -0.17 -1.91 0.04 0.00 0.51 0.00 0.00 43.02 41.49 1xkt s PHE 2335CO -0.07 -0.08 -0.00 -0.51 0.70 0.00 0.00 175.22 175.26 1xkt s LEU 2336N 0.30 3.81 -0.68 -0.37 1.43 -0.21 -0.93 118.68 122.04 1xkt s LEU 2336Ca -0.06 -1.19 -0.23 0.00 -1.03 0.00 0.00 54.13 51.62 1xkt s LEU 2336Cb -0.15 -1.72 0.07 0.00 0.03 0.00 0.00 46.19 44.42 1xkt s LEU 2336CO 0.04 -0.24 1.02 -0.36 0.23 0.00 0.00 176.35 177.04 1xkt s PHE 2337N 1.28 2.62 -1.10 0.29 2.99 -0.31 -0.42 117.98 123.33 1xkt s PHE 2337Ca -0.04 -0.50 -0.22 0.00 0.00 0.00 0.00 56.93 56.17 1xkt s PHE 2337Cb -0.19 -4.35 0.01 0.00 0.00 0.00 0.00 43.02 38.49 1xkt s PHE 2337CO -0.01 -1.71 0.72 -3.47 -0.00 0.00 0.00 175.22 170.75 1xkt n ASP 2338N 7.94 -4.94 -3.59 1.36 2.03 0.78 -1.04 116.55 119.09 1xkt n ASP 2338Ca -0.02 -1.07 0.02 0.00 0.52 0.00 0.00 54.79 54.24 1xkt n ASP 2338Cb 0.46 -2.56 -0.00 0.00 -0.72 0.00 0.00 41.12 38.29 1xkt n ASP 2338CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1xkt s GLY 2339N -3.39 -0.45 0.13 0.27 0.00 -1.26 -3.80 107.32 98.82 1xkt s GLY 2339Ca 0.39 0.88 -0.24 0.00 0.00 0.00 0.00 44.72 45.75 1xkt s GLY 2339CO 0.90 0.17 1.11 -1.35 0.00 0.00 0.00 173.10 173.94 1xkt s SER 2340N -2.94 0.01 0.36 1.64 1.04 -1.22 -4.82 113.70 107.77 1xkt s SER 2340Ca 0.14 -0.55 0.24 0.00 0.48 0.00 0.00 55.95 56.27 1xkt s SER 2340Cb 0.06 0.40 1.30 0.00 0.10 0.00 0.00 66.02 67.88 1xkt s SER 2340CO -0.05 -0.80 1.73 -0.65 0.98 0.00 0.00 173.24 174.45 1xkt h PRO 2341N 2.00 0.00 0.00 4.02 0.11 -1.86 -2.32 132.00 133.95 1xkt h PRO 2341Ca -0.26 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.52 1xkt h PRO 2341Cb 1.21 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 1xkt h PRO 2341CO 0.35 0.00 -2.23 2.41 -0.21 0.00 0.00 178.00 178.32 1xkt n THR 2342N -2.35 1.24 -2.80 -1.15 -1.04 -1.26 -4.91 114.28 102.00 1xkt n THR 2342Ca -0.02 -0.52 -0.43 0.00 -2.04 0.00 0.00 64.05 61.05 1xkt n THR 2342Cb 0.05 -1.16 0.01 0.00 -1.82 0.00 0.00 70.33 67.41 1xkt n THR 2342CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xkt n TYR 2343N -3.06 3.21 0.00 -1.42 9.36 -0.87 -5.11 117.16 119.27 1xkt n TYR 2343Ca -0.37 -2.92 0.00 0.00 3.32 0.00 0.00 57.90 57.93 1xkt n TYR 2343Cb 0.93 -1.68 0.00 0.00 -0.63 0.00 0.00 39.34 37.97 1xkt n TYR 2343CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1xkt n PRO 2357N 2.93 0.00 0.00 2.98 -0.02 -1.26 -3.43 135.00 136.20 1xkt n PRO 2357Ca 0.32 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1xkt n PRO 2357Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.84 1xkt n PRO 2357CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xkt n GLY 2358N 0.00 0.99 0.12 -1.23 0.00 -1.26 -4.94 105.19 98.88 1xkt n GLY 2358Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1xkt n GLY 2358CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xkt h GLU 2360N 0.07 -0.07 -0.28 0.00 4.57 -1.99 -1.76 114.58 115.12 1xkt h GLU 2360Ca -0.00 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.24 1xkt h GLU 2360Cb 1.02 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.57 1xkt h GLU 2360CO 0.00 -0.04 -0.07 0.00 -1.18 0.00 0.00 179.01 177.71 1xkt h ALA 2361N 1.41 0.18 -0.49 2.92 0.00 -1.98 0.13 119.26 121.44 1xkt h ALA 2361Ca 0.30 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.23 1xkt h ALA 2361Cb 0.55 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1xkt h ALA 2361CO -0.75 -0.47 -0.05 1.49 0.00 0.00 0.00 179.25 179.47 1xkt h GLU 2362N -0.01 0.90 0.24 0.00 4.81 -1.82 -1.03 114.58 117.67 1xkt h GLU 2362Ca 0.14 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1xkt h GLU 2362Cb 0.21 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1xkt h GLU 2362CO -0.29 0.96 -0.17 0.00 -0.73 0.00 0.00 179.01 178.77 1xkt h ALA 2363N 0.91 -0.40 -0.46 2.92 0.00 -0.99 0.42 119.26 121.66 1xkt h ALA 2363Ca 0.13 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xkt h ALA 2363Cb 0.59 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1xkt h ALA 2363CO 0.04 -0.74 0.29 0.93 0.00 0.00 0.00 179.25 179.77 1xkt h GLU 2364N -0.42 0.57 -0.44 0.00 5.08 -0.96 0.44 114.58 118.85 1xkt h GLU 2364Ca -0.02 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1xkt h GLU 2364Cb 0.36 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1xkt h GLU 2364CO -0.00 0.38 0.22 1.15 -1.00 0.00 0.00 179.01 179.76 1xkt h THR 2365N 0.59 1.17 -0.16 1.13 2.02 -0.97 0.57 112.91 117.27 1xkt h THR 2365Ca 0.18 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1xkt h THR 2365Cb -0.03 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1xkt h THR 2365CO -0.06 0.18 0.01 -0.08 0.37 0.00 0.00 175.52 175.95 1xkt h GLU 2366N 0.57 0.26 0.42 6.66 4.57 -0.61 0.33 114.58 126.78 1xkt h GLU 2366Ca 0.15 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1xkt h GLU 2366Cb 0.09 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 1xkt h GLU 2366CO -0.02 0.46 -0.38 0.00 -1.18 0.00 0.00 179.01 177.89 1xkt h ALA 2367N 0.79 -0.84 0.00 2.92 0.00 -0.77 0.37 119.26 121.73 1xkt h ALA 2367Ca 0.05 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1xkt h ALA 2367Cb 0.33 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1xkt h ALA 2367CO 0.01 -1.01 -0.25 0.82 0.00 0.00 0.00 179.25 178.82 1xkt h ILE 2368N -0.80 0.95 -0.00 0.00 5.03 -0.88 -0.44 117.51 121.36 1xkt h ILE 2368Ca -0.04 -0.93 -0.00 0.00 -0.12 0.00 0.00 64.86 63.77 1xkt h ILE 2368Cb 0.71 1.54 -0.00 0.00 -3.03 0.00 0.00 36.82 36.03 1xkt h ILE 2368CO -0.04 0.24 0.00 0.00 -0.68 0.00 0.00 178.15 177.68 1xkt h PHE 2370N -0.13 -0.32 -0.76 0.00 3.57 -0.19 -1.79 116.94 117.32 1xkt h PHE 2370Ca 0.00 0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.66 1xkt h PHE 2370Cb 0.14 0.15 -0.10 0.00 2.79 0.00 0.00 35.95 38.93 1xkt h PHE 2370CO -0.03 -0.19 0.28 0.35 -2.23 0.00 0.00 178.31 176.49 1xkt h PHE 2371N -0.19 0.47 -0.85 0.41 3.57 -0.92 -0.46 116.94 118.97 1xkt h PHE 2371Ca 0.06 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1xkt h PHE 2371Cb 0.27 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 1xkt h PHE 2371CO -0.21 0.02 0.55 0.28 -2.23 0.00 0.00 178.31 176.72 1xkt h VAL 2372N 0.40 1.22 0.00 1.41 2.07 -0.27 -2.27 116.25 118.82 1xkt h VAL 2372Ca 0.42 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1xkt h VAL 2372Cb 0.67 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1xkt h VAL 2372CO -0.43 0.22 -0.03 1.56 0.02 0.00 0.00 177.57 178.91 1xkt h GLN 2373N 1.15 0.00 0.00 1.57 4.20 -0.49 -1.78 115.11 119.77 1xkt h GLN 2373Ca 0.31 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.97 1xkt h GLN 2373Cb -0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1xkt h GLN 2373CO -0.06 0.03 -0.25 1.96 -0.67 0.00 0.00 178.83 179.83 1xkt h GLN 2374N 0.00 0.00 0.00 1.46 1.08 -1.10 -3.27 115.11 113.27 1xkt h GLN 2374Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1xkt h GLN 2374Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1xkt h GLN 2374CO 0.00 0.25 -1.75 1.19 -0.95 0.00 0.00 178.83 177.58 1xkt n PHE 2375N -3.33 0.00 -3.83 2.96 3.01 -0.94 -4.98 117.46 110.36 1xkt n PHE 2375Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1xkt n PHE 2375Cb 0.49 -0.38 0.00 0.00 -0.01 0.00 0.00 39.48 39.58 1xkt n PHE 2375CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1xkt n THR 2376N -2.07 0.00 -0.02 4.37 -2.24 -0.71 -4.94 114.28 108.66 1xkt n THR 2376Ca -0.03 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.77 1xkt n THR 2376Cb 0.45 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.59 1xkt n THR 2376CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xkt n ASP 2377N -1.77 2.49 -1.15 3.42 2.03 -1.26 -4.67 116.55 115.64 1xkt n ASP 2377Ca 0.00 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 1xkt n ASP 2377Cb 0.00 1.22 -0.01 0.00 -0.72 0.00 0.00 41.12 41.61 1xkt n ASP 2377CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1xkt n MET 2378N -2.07 0.00 -2.54 -0.67 2.81 -1.26 -4.86 117.12 108.53 1xkt n MET 2378Ca -0.07 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.44 1xkt n MET 2378Cb 0.49 -0.26 -0.04 0.00 -0.71 0.00 0.00 33.22 32.70 1xkt n MET 2378CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1xkt s GLU 2379N -0.26 4.38 0.16 0.03 0.41 -1.26 -4.88 118.70 117.28 1xkt s GLU 2379Ca 0.17 1.60 -0.28 0.00 -0.41 0.00 0.00 54.97 56.05 1xkt s GLU 2379Cb -0.24 -2.81 -0.01 0.00 -1.78 0.00 0.00 34.13 29.29 1xkt s GLU 2379CO 0.15 0.03 1.56 1.25 -0.49 0.00 0.00 175.26 177.76 1xkt h HIS 2380N 3.05 -1.45 -0.81 1.61 6.17 -1.97 -1.58 115.15 120.18 1xkt h HIS 2380Ca -0.47 0.09 0.12 0.00 0.71 0.00 0.00 60.37 60.81 1xkt h HIS 2380Cb 1.21 0.72 -0.08 0.00 2.52 0.00 0.00 27.41 31.77 1xkt h HIS 2380CO 0.58 -0.44 0.42 -0.91 0.71 0.00 0.00 177.93 178.30 1xkt h ASN 2381N -0.24 0.53 -0.33 3.26 2.35 -1.97 0.60 115.58 119.78 1xkt h ASN 2381Ca 0.15 0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.92 1xkt h ASN 2381Cb 0.56 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 1xkt h ASN 2381CO -0.70 0.26 -0.03 -0.09 -1.65 0.00 0.00 177.43 175.23 1xkt h ARG 2382N 0.65 0.60 -0.31 0.81 2.43 -1.71 -0.98 114.38 115.87 1xkt h ARG 2382Ca 0.42 -0.21 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1xkt h ARG 2382Cb 0.52 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1xkt h ARG 2382CO -0.32 0.75 -0.19 0.28 -1.51 0.00 0.00 179.97 178.98 1xkt h VAL 2383N 0.39 1.29 -1.00 0.20 2.07 -0.85 -2.90 116.25 115.46 1xkt h VAL 2383Ca 0.09 -1.31 0.07 0.00 0.82 0.00 0.00 66.70 66.37 1xkt h VAL 2383Cb 0.50 1.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.66 1xkt h VAL 2383CO 0.02 0.42 0.64 0.25 0.02 0.00 0.00 177.57 178.93 1xkt h LEU 2384N 0.44 1.01 -1.14 2.57 7.12 0.28 -1.56 115.31 124.04 1xkt h LEU 2384Ca 0.07 0.01 -0.08 0.00 0.13 0.00 0.00 57.88 58.01 1xkt h LEU 2384Cb 0.73 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.65 1xkt h LEU 2384CO 0.05 0.63 -0.21 -0.33 -0.13 0.00 0.00 178.44 178.45 1xkt h GLU 2385N 1.14 0.35 0.00 1.25 4.39 -1.05 -1.73 114.58 118.93 1xkt h GLU 2385Ca 0.44 -0.11 -0.18 0.00 0.34 0.00 0.00 59.36 59.85 1xkt h GLU 2385Cb 0.21 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 1xkt h GLU 2385CO -0.18 0.55 -0.88 0.00 -1.16 0.00 0.00 179.01 177.34 1xkt h ALA 2386N 1.47 0.48 0.00 3.43 0.00 -1.12 -3.37 119.26 120.15 1xkt h ALA 2386Ca 0.05 -0.78 -0.21 0.00 0.00 0.00 0.00 54.91 53.97 1xkt h ALA 2386Cb 0.56 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1xkt h ALA 2386CO 0.04 1.05 -1.80 1.28 0.00 0.00 0.00 179.25 179.82 1xkt n LEU 2387N -3.29 0.49 -0.05 0.00 4.77 -0.77 -4.56 117.00 113.59 1xkt n LEU 2387Ca -0.00 0.22 -0.10 0.00 -0.03 0.00 0.00 56.01 56.10 1xkt n LEU 2387Cb 0.88 0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 42.12 1xkt n LEU 2387CO 0.45 0.24 0.96 0.25 -1.33 0.00 0.00 177.39 177.95 1xkt h LEU 2388N 0.00 0.25 0.00 2.23 5.85 -1.48 -2.98 115.31 119.19 1xkt h LEU 2388Ca -0.26 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1xkt h LEU 2388Cb 1.71 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.68 1xkt h LEU 2388CO 0.04 0.20 0.00 -0.81 -0.34 0.00 0.00 178.44 177.52 1xkt n PRO 2389N -4.93 0.92 -1.74 5.25 -0.04 -1.26 -4.89 135.00 128.31 1xkt n PRO 2389Ca -0.03 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.10 1xkt n PRO 2389Cb 0.03 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.04 1xkt n PRO 2389CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xkt s LEU 2390N -2.00 3.40 0.13 1.53 1.43 -1.13 -4.97 118.68 117.08 1xkt s LEU 2390Ca 0.44 2.07 -0.20 0.00 -1.03 0.00 0.00 54.13 55.41 1xkt s LEU 2390Cb 0.20 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.85 1xkt s LEU 2390CO 0.34 -1.71 1.69 0.50 0.23 0.00 0.00 176.35 177.41 1xkt h LYS 2391N 0.05 -0.04 0.00 1.70 3.64 -1.90 -3.48 116.57 116.54 1xkt h LYS 2391Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1xkt h LYS 2391Cb 1.26 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1xkt h LYS 2391CO 0.54 -0.03 0.00 0.41 -2.27 0.00 0.00 179.45 178.10 1xkt n GLY 2392N -1.23 1.81 0.40 5.01 0.00 -1.26 -5.04 105.19 104.88 1xkt n GLY 2392Ca -0.02 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 1xkt n GLY 2392CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xkt h LEU 2393N 0.00 -1.39 -1.57 0.99 5.85 -1.97 -1.28 115.31 115.94 1xkt h LEU 2393Ca 0.00 0.19 0.14 0.00 0.84 0.00 0.00 57.88 59.06 1xkt h LEU 2393Cb 0.00 0.58 -0.05 0.00 0.37 0.00 0.00 40.66 41.56 1xkt h LEU 2393CO 0.00 -0.41 0.50 -0.33 -0.34 0.00 0.00 178.44 177.86 1xkt h GLU 2394N -0.43 0.42 -0.19 1.25 3.07 -1.98 0.52 114.58 117.23 1xkt h GLU 2394Ca 0.10 -0.03 -0.20 0.00 -0.50 0.00 0.00 59.36 58.73 1xkt h GLU 2394Cb 0.61 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1xkt h GLU 2394CO -0.47 0.28 -0.68 0.93 -1.40 0.00 0.00 179.01 177.67 1xkt h GLU 2395N 0.43 0.74 -0.21 2.33 3.07 -1.78 -0.61 114.58 118.55 1xkt h GLU 2395Ca 0.37 -0.54 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1xkt h GLU 2395Cb 0.81 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.81 1xkt h GLU 2395CO -0.12 1.16 0.03 0.00 -1.40 0.00 0.00 179.01 178.68 1xkt h ARG 2396N 0.53 0.35 0.11 2.33 3.08 0.00 -0.08 114.38 120.70 1xkt h ARG 2396Ca -0.02 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1xkt h ARG 2396Cb 1.28 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 1xkt h ARG 2396CO 0.14 0.51 -0.06 0.28 -1.07 0.00 0.00 179.97 179.76 1xkt h VAL 2397N 0.14 0.88 -0.58 2.04 2.07 -0.02 0.93 116.25 121.71 1xkt h VAL 2397Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.63 1xkt h VAL 2397Cb 0.33 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1xkt h VAL 2397CO 0.01 0.00 0.32 0.00 0.02 0.00 0.00 177.57 177.91 1xkt h ALA 2398N 0.73 0.75 -0.49 1.67 0.00 -1.04 0.32 119.26 121.20 1xkt h ALA 2398Ca -0.01 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1xkt h ALA 2398Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1xkt h ALA 2398CO 0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 179.25 179.22 1xkt h ALA 2399N 1.29 1.00 -0.05 0.00 0.00 -0.82 -2.14 119.26 118.53 1xkt h ALA 2399Ca 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xkt h ALA 2399Cb 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1xkt h ALA 2399CO -0.15 0.61 -0.00 0.00 0.00 0.00 0.00 179.25 179.70 1xkt h ALA 2400N 1.16 0.07 -0.78 0.00 0.00 -0.03 -1.30 119.26 118.37 1xkt h ALA 2400Ca 0.14 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1xkt h ALA 2400Cb 0.53 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.21 1xkt h ALA 2400CO 0.03 -0.25 0.37 0.28 0.00 0.00 0.00 179.25 179.68 1xkt h VAL 2401N -0.22 0.73 0.04 0.00 2.07 -0.29 -0.25 116.25 118.33 1xkt h VAL 2401Ca 0.01 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1xkt h VAL 2401Cb 0.35 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1xkt h VAL 2401CO 0.00 0.10 -0.02 0.44 0.02 0.00 0.00 177.57 178.12 1xkt h ASP 2402N 0.55 -0.04 -0.92 0.57 3.32 -1.16 -0.72 116.42 118.01 1xkt h ASP 2402Ca 0.42 -0.09 0.12 0.00 0.02 0.00 0.00 57.03 57.49 1xkt h ASP 2402Cb 0.58 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 40.06 1xkt h ASP 2402CO -0.36 0.06 0.55 -0.07 -1.72 0.00 0.00 179.24 177.70 1xkt h LEU 2403N -0.15 0.79 -0.04 1.55 3.38 -0.26 -1.54 115.31 119.04 1xkt h LEU 2403Ca -0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1xkt h LEU 2403Cb 0.13 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1xkt h LEU 2403CO 0.01 0.42 -0.00 0.40 0.09 0.00 0.00 178.44 179.35 1xkt h ILE 2404N 0.87 1.27 -0.59 1.22 2.04 -0.76 -3.05 117.51 118.51 1xkt h ILE 2404Ca 0.46 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.55 1xkt h ILE 2404Cb 0.47 1.74 -0.03 0.00 -0.74 0.00 0.00 36.82 38.26 1xkt h ILE 2404CO -0.27 0.22 0.39 0.40 0.00 0.00 0.00 178.15 178.89 1xkt h ILE 2405N -0.25 1.05 0.00 -0.67 1.08 -0.78 0.23 117.51 118.18 1xkt h ILE 2405Ca 0.01 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1xkt h ILE 2405Cb 0.35 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 34.44 1xkt h ILE 2405CO 0.00 0.12 0.00 0.29 -0.69 0.00 0.00 178.15 177.87 1xkt n LYS 2406N -4.47 0.33 0.00 2.37 5.02 -0.61 -1.51 118.16 119.29 1xkt n LYS 2406Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1xkt n LYS 2406Cb 0.17 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.16 1xkt n LYS 2406CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1xkt n SER 2407N -0.43 1.29 -3.14 4.39 7.64 -0.00 -4.95 113.62 118.41 1xkt n SER 2407Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 1xkt n SER 2407Cb 0.01 0.22 -0.06 0.00 -1.01 0.00 0.00 64.21 63.37 1xkt n SER 2407CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1xkt n HIS 2408N -0.55 -2.06 -0.03 1.43 8.25 -0.57 -5.02 115.22 116.67 1xkt n HIS 2408Ca 0.00 -2.55 0.23 0.00 -0.26 0.00 0.00 57.72 55.14 1xkt n HIS 2408Cb 0.04 0.74 0.72 0.00 1.12 0.00 0.00 29.99 32.61 1xkt n HIS 2408CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1xkt h GLN 2409N 5.36 0.00 0.00 -0.41 1.08 -1.72 -2.41 115.11 117.01 1xkt h GLN 2409Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1xkt h GLN 2409Cb 0.99 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.42 1xkt h GLN 2409CO 0.23 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.52 1xkt n GLY 2410N -1.61 -1.37 3.74 3.46 0.00 -1.26 -4.84 105.19 103.30 1xkt n GLY 2410Ca 0.12 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1xkt n GLY 2410CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xkt s LEU 2411N -2.76 4.42 -0.01 0.99 1.43 -0.91 -4.93 118.68 116.91 1xkt s LEU 2411Ca 0.22 2.40 -0.30 0.00 -1.03 0.00 0.00 54.13 55.42 1xkt s LEU 2411Cb 0.20 -3.61 -0.07 0.00 0.03 0.00 0.00 46.19 42.74 1xkt s LEU 2411CO 0.49 -0.52 1.68 -0.62 0.23 0.00 0.00 176.35 177.61 1xkt s ASP 2412N 0.31 6.63 0.39 2.29 2.15 -1.26 -4.87 116.67 122.31 1xkt s ASP 2412Ca 0.56 2.34 0.08 0.00 0.43 0.00 0.00 52.55 55.96 1xkt s ASP 2412Cb -0.36 -2.54 0.80 0.00 -0.30 0.00 0.00 42.92 40.51 1xkt s ASP 2412CO 0.38 -0.92 1.97 0.03 -0.17 0.00 0.00 175.17 176.46 1xkt h ARG 2413N 9.30 0.41 -0.06 4.34 3.08 -1.93 -2.14 114.38 127.36 1xkt h ARG 2413Ca -0.41 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.49 1xkt h ARG 2413Cb 1.19 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 1xkt h ARG 2413CO 0.94 0.39 -0.36 1.96 -1.07 0.00 0.00 179.97 181.83 1xkt h GLN 2414N 0.40 0.13 -0.00 0.04 1.08 -1.99 -1.27 115.11 113.50 1xkt h GLN 2414Ca 0.10 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1xkt h GLN 2414Cb 0.18 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1xkt h GLN 2414CO -0.00 0.48 -0.01 0.93 -0.95 0.00 0.00 178.83 179.28 1xkt h GLU 2415N 0.11 0.01 -0.60 1.46 5.08 -1.76 -2.55 114.58 116.32 1xkt h GLU 2415Ca 0.01 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1xkt h GLU 2415Cb 0.70 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 1xkt h GLU 2415CO 0.05 0.74 0.26 -0.07 -1.00 0.00 0.00 179.01 178.99 1xkt h LEU 2416N -0.72 0.31 -1.11 1.33 3.38 -1.37 0.44 115.31 117.57 1xkt h LEU 2416Ca -0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xkt h LEU 2416Cb 0.74 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1xkt h LEU 2416CO 0.00 0.19 0.57 -1.28 0.09 0.00 0.00 178.44 178.02 1xkt h SER 2417N 0.47 1.02 0.00 -0.43 0.87 -1.29 0.11 113.55 114.31 1xkt h SER 2417Ca 0.29 -0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.65 1xkt h SER 2417Cb 0.30 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1xkt h SER 2417CO -0.26 0.75 -0.66 0.15 -0.53 0.00 0.00 176.83 176.29 1xkt h PHE 2418N 1.20 0.66 0.17 2.24 3.57 -0.82 -3.08 116.94 120.88 1xkt h PHE 2418Ca 0.32 -0.36 0.01 0.00 3.53 0.00 0.00 57.97 61.47 1xkt h PHE 2418Cb -0.12 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 1xkt h PHE 2418CO 0.00 1.18 -0.21 0.00 -2.23 0.00 0.00 178.31 177.06 1xkt h ALA 2419N 0.32 -0.39 -0.51 2.41 0.00 0.21 -0.19 119.26 121.11 1xkt h ALA 2419Ca -0.08 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1xkt h ALA 2419Cb 1.37 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 1xkt h ALA 2419CO 0.13 -0.75 0.29 0.00 0.00 0.00 0.00 179.25 178.92 1xkt h ALA 2420N 0.33 0.65 -0.07 0.00 0.00 -0.92 0.16 119.26 119.41 1xkt h ALA 2420Ca 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xkt h ALA 2420Cb 0.42 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1xkt h ALA 2420CO -0.08 -0.02 -0.00 -0.09 0.00 0.00 0.00 179.25 179.06 1xkt h ARG 2421N 0.58 0.13 0.00 0.00 2.43 -1.43 -2.99 114.38 113.10 1xkt h ARG 2421Ca 0.21 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.28 1xkt h ARG 2421Cb 0.05 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1xkt h ARG 2421CO -0.11 0.40 -0.27 0.66 -1.51 0.00 0.00 179.97 179.14 1xkt h SER 2422N -0.16 0.00 -0.39 -3.80 4.64 -0.87 -2.68 113.55 110.30 1xkt h SER 2422Ca 0.02 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.36 1xkt h SER 2422Cb 0.34 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 1xkt h SER 2422CO 0.00 0.27 0.21 0.15 -0.87 0.00 0.00 176.83 176.60 1xkt h PHE 2423N 0.00 0.39 -0.64 4.77 3.04 -0.53 0.19 116.94 124.16 1xkt h PHE 2423Ca -0.00 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.92 1xkt h PHE 2423Cb 0.62 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.98 1xkt h PHE 2423CO 0.00 0.22 0.25 -0.92 -2.02 0.00 0.00 178.31 175.84 1xkt h TYR 2424N 0.43 0.97 -0.19 0.41 3.20 -1.38 -2.17 116.97 118.23 1xkt h TYR 2424Ca 0.16 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 1xkt h TYR 2424Cb 0.04 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 1xkt h TYR 2424CO -0.09 0.77 -0.22 1.88 -1.64 0.00 0.00 178.16 178.86 1xkt h TYR 2425N 0.89 0.36 -0.38 -3.82 0.99 -1.17 -2.01 116.97 111.83 1xkt h TYR 2425Ca 0.21 -0.06 -0.09 0.00 2.00 0.00 0.00 58.73 60.79 1xkt h TYR 2425Cb 0.21 -0.09 -0.01 0.00 1.00 0.00 0.00 36.73 37.83 1xkt h TYR 2425CO 0.01 0.53 -0.12 0.87 -0.00 0.00 0.00 178.16 179.45 1xkt h LYS 2426N 0.30 0.75 0.28 4.88 1.57 -0.28 -1.41 116.57 122.67 1xkt h LYS 2426Ca 0.05 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1xkt h LYS 2426Cb 0.56 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1xkt h LYS 2426CO 0.04 0.91 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.62 1xkt h LEU 2427N 0.56 -0.32 0.13 2.94 3.38 -1.21 -1.16 115.31 119.63 1xkt h LEU 2427Ca 0.09 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1xkt h LEU 2427Cb 0.65 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 1xkt h LEU 2427CO 0.04 -0.21 -0.42 -0.09 0.09 0.00 0.00 178.44 177.85 1xkt h ARG 2428N -0.40 -0.64 -0.96 1.13 2.43 -1.31 0.28 114.38 114.90 1xkt h ARG 2428Ca -0.04 0.04 0.16 0.00 -0.81 0.00 0.00 59.98 59.33 1xkt h ARG 2428Cb 0.30 0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 29.92 1xkt h ARG 2428CO 0.06 -0.43 0.61 0.00 -1.51 0.00 0.00 179.97 178.70 1xkt h ALA 2429N -0.21 1.73 0.03 2.80 0.00 -1.18 -2.40 119.26 120.04 1xkt h ALA 2429Ca 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xkt h ALA 2429Cb 0.69 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1xkt h ALA 2429CO -0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 179.25 178.98 1xkt h ALA 2430N 1.60 -0.04 0.00 0.00 0.00 -0.46 -2.81 119.26 117.55 1xkt h ALA 2430Ca 0.51 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1xkt h ALA 2430Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1xkt h ALA 2430CO -0.27 -0.18 0.00 0.39 0.00 0.00 0.00 179.25 179.18 1xkt n GLU 2431N -4.79 0.58 0.00 0.00 -0.58 0.91 -1.52 120.64 115.24 1xkt n GLU 2431Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1xkt n GLU 2431Cb 0.32 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 30.00 1xkt n GLU 2431CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1xkt n GLN 2432N -0.04 -0.17 -3.34 3.49 7.27 -0.94 -5.01 117.38 118.64 1xkt n GLN 2432Ca 0.00 -0.10 -0.34 0.00 0.07 0.00 0.00 57.00 56.63 1xkt n GLN 2432Cb 0.09 -0.59 -0.06 0.00 2.41 0.00 0.00 30.24 32.10 1xkt n GLN 2432CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 1xkt s TYR 2433N -0.01 3.54 -0.28 3.69 5.04 -0.57 -5.04 117.35 123.72 1xkt s TYR 2433Ca 0.00 1.04 -0.06 0.00 -2.44 0.00 0.00 57.07 55.61 1xkt s TYR 2433Cb 0.00 -2.37 0.14 0.00 0.35 0.00 0.00 41.96 40.08 1xkt s TYR 2433CO 0.00 0.36 0.59 0.95 -1.34 0.00 0.00 175.55 176.10 1xkt s THR 2434N -1.60 -0.93 0.15 4.34 -4.23 -1.26 -5.04 115.64 107.07 1xkt s THR 2434Ca 0.42 0.02 -0.32 0.00 -1.18 0.00 0.00 61.69 60.62 1xkt s THR 2434Cb -0.14 -0.94 -0.17 0.00 1.34 0.00 0.00 72.50 72.59 1xkt s THR 2434CO 0.20 0.00 0.87 -2.65 -0.54 0.00 0.00 174.62 172.50 1xkt n PRO 2435N 5.43 0.43 0.18 3.99 -0.02 -1.26 -4.91 135.00 138.84 1xkt n PRO 2435Ca -0.08 0.15 -0.13 0.00 -2.02 0.00 0.00 63.50 61.43 1xkt n PRO 2435Cb 0.50 -1.44 -0.07 0.00 -0.02 0.00 0.00 33.50 32.46 1xkt n PRO 2435CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1xkt h LYS 2436N 2.22 -0.47 0.00 -0.52 6.56 -2.00 -3.47 116.57 118.88 1xkt h LYS 2436Ca -0.39 0.03 -0.63 0.00 -1.06 0.00 0.00 60.65 58.60 1xkt h LYS 2436Cb 1.40 0.11 -0.13 0.00 -0.57 0.00 0.00 32.23 33.04 1xkt h LYS 2436CO 0.63 -0.15 -0.49 0.00 -2.06 0.00 0.00 179.45 177.37 1xkt n ALA 2437N -2.55 0.52 -1.98 3.86 0.00 -1.26 -5.13 120.51 113.97 1xkt n ALA 2437Ca -0.09 -2.27 -0.39 0.00 0.00 0.00 0.00 53.44 50.69 1xkt n ALA 2437Cb 0.28 1.38 -0.06 0.00 0.00 0.00 0.00 19.45 21.04 1xkt n ALA 2437CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xkt s LYS 2438N -3.76 4.59 -0.22 0.00 -0.14 -1.26 -4.99 119.74 113.96 1xkt s LYS 2438Ca 0.11 1.18 -0.20 0.00 -1.36 0.00 0.00 55.97 55.70 1xkt s LYS 2438Cb 0.01 -3.27 -0.02 0.00 -1.68 0.00 0.00 37.83 32.86 1xkt s LYS 2438CO 0.08 0.56 0.60 -0.47 -0.76 0.00 0.00 175.35 175.35 1xkt s TYR 2439N -1.11 3.33 -2.64 3.18 5.04 0.16 -4.91 117.35 120.41 1xkt s TYR 2439Ca 0.36 0.83 0.24 0.00 -2.44 0.00 0.00 57.07 56.06 1xkt s TYR 2439Cb -0.23 -2.78 0.43 0.00 0.35 0.00 0.00 41.96 39.73 1xkt s TYR 2439CO 0.27 -0.22 1.40 0.66 -1.34 0.00 0.00 175.55 176.31 1xkt n TYR 2440N 5.27 0.26 -2.12 4.97 4.02 -1.26 -0.22 117.16 128.07 1xkt n TYR 2440Ca -0.02 -0.13 -0.27 0.00 -0.01 0.00 0.00 57.90 57.47 1xkt n TYR 2440Cb 0.50 0.00 0.10 0.00 -0.02 0.00 0.00 39.34 39.92 1xkt n TYR 2440CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1xkt s GLY 2441N -1.71 1.70 -0.18 2.72 0.00 -1.26 -4.00 107.32 104.58 1xkt s GLY 2441Ca 0.34 -1.01 -0.20 0.00 0.00 0.00 0.00 44.72 43.85 1xkt s GLY 2441CO 0.31 -0.50 0.57 -1.31 0.00 0.00 0.00 173.10 172.18 1xkt s ASN 2442N -4.63 6.66 0.09 1.64 0.01 -1.26 -4.18 114.94 113.28 1xkt s ASN 2442Ca 0.64 0.80 0.07 0.00 -0.71 0.00 0.00 52.86 53.67 1xkt s ASN 2442Cb -0.09 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.21 1xkt s ASN 2442CO 0.47 -0.19 -0.14 0.68 -1.51 0.00 0.00 177.10 176.42 1xkt s VAL 2443N 1.55 3.14 -0.17 1.60 -7.23 -0.76 -3.70 120.40 114.83 1xkt s VAL 2443Ca 0.27 -1.31 -0.01 0.00 -1.81 0.00 0.00 61.98 59.13 1xkt s VAL 2443Cb -0.16 -2.43 0.04 0.00 0.56 0.00 0.00 36.38 34.39 1xkt s VAL 2443CO 0.11 0.15 -0.05 -0.32 -0.31 0.00 0.00 175.10 174.68 1xkt s MET 2444N -2.04 1.39 -0.43 4.82 1.75 -0.73 -2.37 119.30 121.69 1xkt s MET 2444Ca 0.19 -0.55 -0.18 0.00 -1.25 0.00 0.00 55.69 53.91 1xkt s MET 2444Cb -0.11 -2.06 0.03 0.00 2.84 0.00 0.00 34.83 35.53 1xkt s MET 2444CO 0.11 -0.46 0.47 -1.17 -0.65 0.00 0.00 175.02 173.32 1xkt s LEU 2445N 1.63 4.85 -0.73 4.11 0.20 -0.77 -1.04 118.68 126.94 1xkt s LEU 2445Ca 0.00 -0.67 -0.19 0.00 0.69 0.00 0.00 54.13 53.96 1xkt s LEU 2445Cb -0.16 -2.42 0.11 0.00 -0.43 0.00 0.00 46.19 43.30 1xkt s LEU 2445CO -0.08 -0.62 0.89 -0.76 -0.29 0.00 0.00 176.35 175.49 1xkt s LEU 2446N 2.22 5.18 0.22 -0.68 1.02 0.44 -1.10 118.68 125.98 1xkt s LEU 2446Ca 0.13 -1.62 -0.16 0.00 0.02 0.00 0.00 54.13 52.50 1xkt s LEU 2446Cb -0.17 -2.35 -0.08 0.00 0.02 0.00 0.00 46.19 43.61 1xkt s LEU 2446CO 0.14 -1.13 0.66 -0.60 0.02 0.00 0.00 176.35 175.44 1xkt s ARG 2447N 2.78 4.09 0.57 1.70 3.52 -0.06 -0.16 118.95 131.40 1xkt s ARG 2447Ca 0.21 0.68 -0.18 0.00 -0.13 0.00 0.00 55.73 56.30 1xkt s ARG 2447Cb -0.16 -2.80 -0.05 0.00 -1.56 0.00 0.00 34.95 30.39 1xkt s ARG 2447CO 0.01 0.37 1.11 0.00 -0.81 0.00 0.00 175.30 175.98 1xkt s ALA 2448N -1.61 2.67 -0.04 6.12 0.00 -1.26 0.70 121.76 128.34 1xkt s ALA 2448Ca 0.44 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.90 1xkt s ALA 2448Cb -0.15 -3.32 -0.32 0.00 0.00 0.00 0.00 23.12 19.33 1xkt s ALA 2448CO 0.20 -0.82 0.84 -0.22 0.00 0.00 0.00 175.76 175.76 1xkt h LYS 2449N 0.91 0.36 -5.62 0.00 3.64 0.61 -3.43 116.57 113.04 1xkt h LYS 2449Ca -0.49 -0.61 -0.59 0.00 -1.27 0.00 0.00 60.65 57.69 1xkt h LYS 2449Cb 1.25 0.23 -0.09 0.00 -0.41 0.00 0.00 32.23 33.21 1xkt h LYS 2449CO 0.57 1.29 -0.26 0.99 -2.27 0.00 0.00 179.45 179.77 1xkt s THR 2450N -2.49 5.25 0.00 1.00 2.01 -0.50 -4.98 115.64 115.93 1xkt s THR 2450Ca -0.14 0.69 0.00 0.00 0.31 0.00 0.00 61.69 62.55 1xkt s THR 2450Cb 0.03 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.85 1xkt s THR 2450CO 0.85 0.39 0.00 0.61 -0.69 0.00 0.00 174.62 175.78 1xkt n GLY 2451N 3.17 2.03 0.00 4.40 0.00 -1.26 -4.29 105.19 109.23 1xkt n GLY 2451Ca -0.11 -2.06 0.06 0.00 0.00 0.00 0.00 46.02 43.92 1xkt n GLY 2451CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xkt n LEU 2458N 0.00 0.00 -4.26 0.99 4.77 -1.26 -5.00 117.00 112.24 1xkt n LEU 2458Ca 0.00 0.26 -0.44 0.00 -0.03 0.00 0.00 56.01 55.81 1xkt n LEU 2458Cb 0.00 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 40.77 1xkt n LEU 2458CO 0.00 -0.15 0.13 -0.83 -1.33 0.00 0.00 177.39 175.21 1xkt s GLY 2459N -2.52 2.20 -0.61 -0.72 0.00 -1.26 -4.55 107.32 99.86 1xkt s GLY 2459Ca 0.13 -2.73 -0.07 0.00 0.00 0.00 0.00 44.72 42.04 1xkt s GLY 2459CO 0.19 1.17 0.19 0.00 0.00 0.00 0.00 173.10 174.66 1xkt n ALA 2460N 4.78 -1.06 0.00 3.20 0.00 -1.26 -4.34 120.51 121.83 1xkt n ALA 2460Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1xkt n ALA 2460Cb 0.41 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1xkt n ALA 2460CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xkt n ASP 2461N -1.81 0.00 -3.45 0.00 2.03 -1.26 -4.89 116.55 107.17 1xkt n ASP 2461Ca 0.04 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.09 1xkt n ASP 2461Cb 0.49 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.90 1xkt n ASP 2461CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1xkt n TYR 2462N -0.00 -1.93 -1.28 -0.67 0.53 -1.26 -0.46 117.16 112.08 1xkt n TYR 2462Ca 0.00 0.58 -0.10 0.00 -1.02 0.00 0.00 57.90 57.37 1xkt n TYR 2462Cb 0.00 -3.45 -0.04 0.00 -1.03 0.00 0.00 39.34 34.82 1xkt n TYR 2462CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1xkt n ASN 2463N -2.46 -5.26 -0.32 7.72 4.05 -1.26 -4.44 115.26 113.28 1xkt n ASN 2463Ca -0.02 0.24 0.08 0.00 0.45 0.00 0.00 54.58 55.33 1xkt n ASN 2463Cb 0.55 -3.61 0.24 0.00 1.23 0.00 0.00 39.78 38.19 1xkt n ASN 2463CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1xkt h LEU 2464N 0.00 0.71 -1.91 1.20 3.38 -1.19 -0.80 115.31 116.71 1xkt h LEU 2464Ca -0.20 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1xkt h LEU 2464Cb 1.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1xkt h LEU 2464CO 0.29 0.33 -0.03 0.77 0.09 0.00 0.00 178.44 179.89 1xkt h SER 2465N 0.78 0.02 -0.17 -0.43 4.64 -1.85 -0.69 113.55 115.85 1xkt h SER 2465Ca 0.49 -0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.85 1xkt h SER 2465Cb 0.62 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1xkt h SER 2465CO -0.32 0.05 0.14 -0.61 -0.87 0.00 0.00 176.83 175.21 1xkt h GLN 2466N 0.02 0.00 0.00 4.77 5.75 -1.53 -3.14 115.11 120.97 1xkt h GLN 2466Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1xkt h GLN 2466Cb 0.07 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.62 1xkt h GLN 2466CO 0.00 0.00 0.00 1.33 -2.65 0.00 0.00 178.83 177.51 1xkt n VAL 2467N -4.23 0.00 -4.23 2.39 0.24 -0.69 -5.05 118.33 106.76 1xkt n VAL 2467Ca 0.01 -0.44 -0.28 0.00 -2.04 0.00 0.00 64.34 61.59 1xkt n VAL 2467Cb 0.26 1.07 -0.09 0.00 -1.47 0.00 0.00 33.84 33.62 1xkt n VAL 2467CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xkt n ASP 2469N 0.21 3.81 -2.96 0.00 8.00 0.69 -4.73 116.55 121.57 1xkt n ASP 2469Ca -0.11 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.38 1xkt n ASP 2469Cb 0.54 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 1xkt n ASP 2469CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xkt n GLY 2470N 3.41 -2.87 3.72 0.44 0.00 -1.21 -4.90 105.19 103.77 1xkt n GLY 2470Ca -0.03 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1xkt n GLY 2470CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xkt s LYS 2471N -2.22 4.20 -0.23 1.61 1.02 -1.26 -4.92 119.74 117.94 1xkt s LYS 2471Ca 0.00 2.41 0.02 0.00 0.02 0.00 0.00 55.97 58.42 1xkt s LYS 2471Cb 0.00 -3.17 0.05 0.00 -0.52 0.00 0.00 37.83 34.20 1xkt s LYS 2471CO 0.00 -0.64 -0.09 0.08 -0.92 0.00 0.00 175.35 173.77 1xkt s VAL 2472N 1.24 1.81 -0.19 3.17 1.01 -1.26 -1.83 120.40 124.36 1xkt s VAL 2472Ca 0.71 -1.31 0.01 0.00 0.00 0.00 0.00 61.98 61.39 1xkt s VAL 2472Cb -0.45 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.00 1xkt s VAL 2472CO 0.31 0.01 -0.18 -0.94 0.00 0.00 0.00 175.10 174.30 1xkt s SER 2473N 1.28 3.31 -0.14 3.32 1.04 -1.00 -5.03 113.70 116.49 1xkt s SER 2473Ca -0.06 -0.71 -0.03 0.00 0.48 0.00 0.00 55.95 55.64 1xkt s SER 2473Cb -0.18 -1.50 -0.03 0.00 0.10 0.00 0.00 66.02 64.41 1xkt s SER 2473CO -0.06 -0.02 -0.04 0.68 0.98 0.00 0.00 173.24 174.78 1xkt s VAL 2474N 1.28 3.89 -0.12 5.02 -7.23 -1.26 -1.84 120.40 120.14 1xkt s VAL 2474Ca 0.04 -0.37 -0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1xkt s VAL 2474Cb -0.14 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.09 1xkt s VAL 2474CO -0.12 0.52 -0.06 -1.00 -0.31 0.00 0.00 175.10 174.13 1xkt s HIS 2475N 0.12 2.97 -0.34 2.82 3.76 -0.26 -4.96 115.29 119.40 1xkt s HIS 2475Ca -0.01 -0.22 -0.22 0.00 -0.15 0.00 0.00 55.06 54.46 1xkt s HIS 2475Cb -0.14 -1.86 0.00 0.00 1.11 0.00 0.00 32.58 31.70 1xkt s HIS 2475CO 0.03 0.08 0.70 0.08 -0.85 0.00 0.00 174.74 174.78 1xkt s VAL 2476N -0.07 4.84 0.23 -0.90 1.01 -1.26 -0.88 120.40 123.36 1xkt s VAL 2476Ca 0.01 0.81 -0.04 0.00 0.00 0.00 0.00 61.98 62.75 1xkt s VAL 2476Cb -0.13 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 1xkt s VAL 2476CO 0.03 -0.31 0.47 -0.63 0.00 0.00 0.00 175.10 174.66 1xkt s ILE 2477N 2.84 5.09 0.01 2.22 -1.09 0.22 -4.87 121.20 125.62 1xkt s ILE 2477Ca 0.28 -0.01 -0.30 0.00 -2.23 0.00 0.00 60.65 58.38 1xkt s ILE 2477Cb -0.14 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 1xkt s ILE 2477CO 0.15 -0.18 1.25 -1.61 -1.23 0.00 0.00 174.94 173.32 1xkt s GLU 2478N -3.21 4.37 0.00 2.79 8.01 -1.26 -0.31 118.70 129.08 1xkt s GLU 2478Ca 0.42 1.80 0.00 0.00 0.01 0.00 0.00 54.97 57.20 1xkt s GLU 2478Cb -0.11 -3.46 0.00 0.00 -4.31 0.00 0.00 34.13 26.25 1xkt s GLU 2478CO 0.28 -0.40 0.00 0.41 0.01 0.00 0.00 175.26 175.56 1xkt n GLY 2479N 3.37 0.55 1.48 -1.39 0.00 -1.26 -3.75 105.19 104.20 1xkt n GLY 2479Ca 0.11 -2.32 -0.08 0.00 0.00 0.00 0.00 46.02 43.73 1xkt n GLY 2479CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xkt n ASP 2480N 0.00 0.95 -0.34 1.61 5.68 -1.26 -1.36 116.55 121.82 1xkt n ASP 2480Ca 0.00 -1.61 0.22 0.00 -0.50 0.00 0.00 54.79 52.90 1xkt n ASP 2480Cb 0.00 -0.14 0.46 0.00 -1.14 0.00 0.00 41.12 40.31 1xkt n ASP 2480CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1xkt h HIS 2481N 0.12 0.82 0.03 2.11 -0.00 -1.95 -1.24 115.15 115.05 1xkt h HIS 2481Ca -0.11 0.03 -0.34 0.00 -0.00 0.00 0.00 60.37 59.95 1xkt h HIS 2481Cb 0.48 -0.23 -0.05 0.00 -0.00 0.00 0.00 27.41 27.61 1xkt h HIS 2481CO 0.00 0.02 -2.05 0.54 -0.00 0.00 0.00 177.93 176.44 1xkt n ARG 2482N -4.78 0.68 0.15 5.26 5.12 -1.26 -4.39 116.66 117.44 1xkt n ARG 2482Ca 0.27 0.20 0.05 0.00 -1.93 0.00 0.00 57.85 56.44 1xkt n ARG 2482Cb 0.87 -1.67 0.05 0.00 -1.16 0.00 0.00 32.46 30.55 1xkt n ARG 2482CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 1xkt h THR 2483N 0.02 0.61 -0.95 0.55 1.35 -1.89 -3.36 112.91 109.25 1xkt h THR 2483Ca -0.42 -1.89 0.27 0.00 -0.55 0.00 0.00 66.41 63.82 1xkt h THR 2483Cb 2.05 2.27 -0.17 0.00 -1.73 0.00 0.00 68.15 70.57 1xkt h THR 2483CO 0.05 0.35 0.15 0.25 -0.25 0.00 0.00 175.52 176.06 1xkt h LEU 2484N 0.00 -0.24 -0.91 3.87 6.46 -1.41 0.60 115.31 123.69 1xkt h LEU 2484Ca -0.02 0.25 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 1xkt h LEU 2484Cb 1.30 0.39 0.00 0.00 -0.73 0.00 0.00 40.66 41.62 1xkt h LEU 2484CO 0.05 -0.30 0.00 0.18 -0.62 0.00 0.00 178.44 177.75 1xkt n LEU 2485N -5.38 1.32 0.00 2.25 4.77 -1.26 -2.80 117.00 115.90 1xkt n LEU 2485Ca 0.24 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1xkt n LEU 2485Cb 0.79 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1xkt n LEU 2485CO -0.02 0.32 -0.13 1.21 -1.33 0.00 0.00 177.39 177.44 1xkt n GLU 2486N 0.19 3.76 -3.86 3.23 4.07 0.21 -4.58 120.64 123.66 1xkt n GLU 2486Ca 0.08 0.00 -0.30 0.00 -0.06 0.00 0.00 57.16 56.88 1xkt n GLU 2486Cb 0.21 -0.54 -0.15 0.00 -0.06 0.00 0.00 31.44 30.90 1xkt n GLU 2486CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1xkt s SER 2488N -0.98 4.32 0.38 4.31 0.15 -1.26 -2.89 113.70 117.73 1xkt s SER 2488Ca 0.00 -1.83 0.28 0.00 0.70 0.00 0.00 55.95 55.10 1xkt s SER 2488Cb 0.00 -1.19 1.16 0.00 -1.71 0.00 0.00 66.02 64.28 1xkt s SER 2488CO 0.00 -0.39 1.83 1.23 1.20 0.00 0.00 173.24 177.11 1xkt h GLY 2489N 7.89 0.00 1.11 9.45 0.00 -1.72 -2.57 103.07 117.22 1xkt h GLY 2489Ca -0.10 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 1xkt h GLY 2489CO 0.49 0.00 0.14 -2.00 0.00 0.00 0.00 176.54 175.16 1xkt h LEU 2490N 0.00 1.04 -0.58 3.11 5.85 -1.38 -2.44 115.31 120.91 1xkt h LEU 2490Ca 0.00 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.50 1xkt h LEU 2490Cb 0.41 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1xkt h LEU 2490CO 0.00 1.02 0.37 -0.33 -0.34 0.00 0.00 178.44 179.16 1xkt h GLU 2491N 1.03 0.73 -0.12 1.25 4.39 -1.77 0.17 114.58 120.25 1xkt h GLU 2491Ca 0.21 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1xkt h GLU 2491Cb 0.40 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1xkt h GLU 2491CO 0.01 0.48 0.08 0.77 -1.16 0.00 0.00 179.01 179.19 1xkt h SER 2492N 0.75 0.15 -0.89 1.42 0.02 -1.63 -1.26 113.55 112.11 1xkt h SER 2492Ca 0.22 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1xkt h SER 2492Cb -0.04 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 1xkt h SER 2492CO -0.07 0.13 0.53 0.40 -1.14 0.00 0.00 176.83 176.68 1xkt h ILE 2493N 0.15 1.25 -0.16 3.27 2.04 -1.04 -0.04 117.51 122.97 1xkt h ILE 2493Ca 0.05 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 1xkt h ILE 2493Cb 0.00 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 1xkt h ILE 2493CO -0.01 0.26 -0.16 0.40 0.00 0.00 0.00 178.15 178.64 1xkt h ILE 2494N 1.22 1.20 0.05 -0.67 2.04 -0.34 -0.68 117.51 120.34 1xkt h ILE 2494Ca 0.32 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1xkt h ILE 2494Cb -0.04 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1xkt h ILE 2494CO -0.06 0.28 -0.02 0.28 0.00 0.00 0.00 178.15 178.63 1xkt h SER 2495N 0.25 -0.06 -0.41 1.72 0.02 -0.48 -2.55 113.55 112.04 1xkt h SER 2495Ca 0.05 -0.59 0.07 0.00 -0.84 0.00 0.00 61.79 60.47 1xkt h SER 2495Cb 0.44 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.94 1xkt h SER 2495CO 0.03 0.61 0.07 0.40 -1.14 0.00 0.00 176.83 176.80 1xkt h ILE 2496N -0.79 0.76 -0.21 3.27 2.04 -0.90 0.43 117.51 122.12 1xkt h ILE 2496Ca -0.01 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1xkt h ILE 2496Cb 0.64 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1xkt h ILE 2496CO 0.01 0.03 0.08 0.40 0.00 0.00 0.00 178.15 178.68 1xkt h ILE 2497N 0.19 1.17 -0.07 -0.67 2.04 -1.24 0.22 117.51 119.15 1xkt h ILE 2497Ca 0.20 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.58 1xkt h ILE 2497Cb 0.25 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1xkt h ILE 2497CO -0.28 0.17 -0.11 0.45 0.00 0.00 0.00 178.15 178.38 1xkt h HIS 2498N 0.19 -0.27 0.00 1.37 3.86 -0.98 -1.82 115.15 117.50 1xkt h HIS 2498Ca 0.07 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1xkt h HIS 2498Cb 0.18 0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.78 1xkt h HIS 2498CO -0.01 -0.16 -0.11 0.66 0.86 0.00 0.00 177.93 179.17 1xkt h SER 2499N -0.15 0.00 0.00 2.45 4.64 0.02 -3.36 113.55 117.16 1xkt h SER 2499Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1xkt h SER 2499Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1xkt h SER 2499CO -0.16 0.11 0.00 -1.20 -0.87 0.00 0.00 176.83 174.71 1xkt n SER 2500N -4.03 0.00 -3.55 4.97 7.64 0.05 -4.54 113.62 114.16 1xkt n SER 2500Ca -0.02 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.63 1xkt n SER 2500Cb 0.20 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.24 1xkt n SER 2500CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1xkt n LEU 2501N 0.00 -0.66 0.00 -3.43 4.77 -1.00 -5.08 117.00 111.60 1xkt n LEU 2501Ca 0.00 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1xkt n LEU 2501Cb 0.00 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 1xkt n LEU 2501CO 0.00 -0.93 0.00 0.00 -1.33 0.00 0.00 177.39 175.13