#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2brq n GLY 2237N 0.00 0.68 0.30 -0.02 0.00 -1.26 -4.80 105.19 100.09 2brq n GLY 2237Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2brq n GLY 2237CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2brq h ALA 2238N 0.00 1.59 0.00 4.61 0.00 -1.88 -1.99 119.26 121.59 2brq h ALA 2238Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2brq h ALA 2238Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2brq h ALA 2238CO 0.00 0.34 0.00 1.12 0.00 0.00 0.00 179.25 180.71 2brq h HIS 2239N 0.57 0.00 -0.02 0.00 2.07 -1.93 -2.30 115.15 113.54 2brq h HIS 2239Ca 0.15 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.67 2brq h HIS 2239Cb 0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.03 2brq h HIS 2239CO 0.00 0.00 -0.04 1.63 -3.07 0.00 0.00 177.93 176.45 2brq n LYS 2240N -2.63 1.63 -4.10 5.12 5.02 -0.75 -4.83 118.16 117.63 2brq n LYS 2240Ca -0.00 -1.02 -0.35 0.00 -2.02 0.00 0.00 58.31 54.91 2brq n LYS 2240Cb 0.16 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.60 2brq n LYS 2240CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2brq s VAL 2241N -2.08 4.83 0.03 -0.18 1.01 -0.86 -4.50 120.40 118.65 2brq s VAL 2241Ca 0.35 -0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.35 2brq s VAL 2241Cb 0.21 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 2brq s VAL 2241CO 0.36 0.56 -0.19 -0.13 0.00 0.00 0.00 175.10 175.70 2brq s ARG 2242N -0.46 1.35 -0.00 2.72 1.81 -1.11 -4.21 118.95 119.05 2brq s ARG 2242Ca 0.10 -0.83 0.05 0.00 -1.72 0.00 0.00 55.73 53.33 2brq s ARG 2242Cb -0.12 -1.40 -0.01 0.00 -0.45 0.00 0.00 34.95 32.97 2brq s ARG 2242CO 0.02 0.36 -0.16 0.00 -0.68 0.00 0.00 175.30 174.85 2brq s ALA 2243N -0.70 1.32 0.19 2.13 0.00 -1.26 0.54 121.76 123.98 2brq s ALA 2243Ca 0.06 -0.72 -0.23 0.00 0.00 0.00 0.00 51.96 51.08 2brq s ALA 2243Cb -0.08 -0.31 0.05 0.00 0.00 0.00 0.00 23.12 22.78 2brq s ALA 2243CO 0.01 0.31 0.67 0.20 0.00 0.00 0.00 175.76 176.95 2brq s GLY 2244N -0.52 -0.41 0.00 0.00 0.00 -0.73 -5.00 107.32 100.67 2brq s GLY 2244Ca 0.06 0.22 0.00 0.00 0.00 0.00 0.00 44.72 45.00 2brq s GLY 2244CO -0.00 0.08 0.00 0.61 0.00 0.00 0.00 173.10 173.78 2brq n GLY 2245N -0.40 3.65 0.37 0.20 0.00 -1.26 -0.91 105.19 106.84 2brq n GLY 2245Ca -0.12 -1.71 0.15 0.00 0.00 0.00 0.00 46.02 44.34 2brq n GLY 2245CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2brq h PRO 2246N 0.00 0.65 0.00 1.61 0.13 -1.92 -1.82 132.00 130.64 2brq h PRO 2246Ca 0.00 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2brq h PRO 2246Cb 0.00 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 30.98 2brq h PRO 2246CO 0.00 0.43 0.00 0.41 -0.23 0.00 0.00 178.00 178.61 2brq n GLY 2247N -1.39 -0.90 0.62 1.56 0.00 0.66 -1.32 105.19 104.42 2brq n GLY 2247Ca 0.22 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2brq n GLY 2247CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2brq n LEU 2248N -1.46 2.20 -0.07 0.99 4.77 -0.69 -4.52 117.00 118.22 2brq n LEU 2248Ca 0.04 -0.76 -0.12 0.00 -0.03 0.00 0.00 56.01 55.13 2brq n LEU 2248Cb 0.14 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2brq n LEU 2248CO 0.12 0.39 -0.95 -0.62 -1.33 0.00 0.00 177.39 175.00 2brq n GLU 2249N 0.37 0.30 -3.48 3.23 1.02 -0.43 -4.74 120.64 116.91 2brq n GLU 2249Ca 0.12 0.10 -0.14 0.00 -0.02 0.00 0.00 57.16 57.22 2brq n GLU 2249Cb 0.49 -1.11 -0.04 0.00 -0.02 0.00 0.00 31.44 30.76 2brq n GLU 2249CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2brq s ARG 2250N -2.25 1.10 0.22 3.49 1.70 -0.72 -4.30 118.95 118.19 2brq s ARG 2250Ca -0.18 -0.10 -0.07 0.00 -0.47 0.00 0.00 55.73 54.91 2brq s ARG 2250Cb 0.06 0.51 -0.02 0.00 -0.57 0.00 0.00 34.95 34.93 2brq s ARG 2250CO 0.27 -0.42 0.30 0.00 -1.08 0.00 0.00 175.30 174.36 2brq s ALA 2251N -2.43 0.47 0.04 7.88 0.00 -0.98 -4.25 121.76 122.49 2brq s ALA 2251Ca -0.04 -1.29 0.08 0.00 0.00 0.00 0.00 51.96 50.71 2brq s ALA 2251Cb -0.01 1.23 -0.03 0.00 0.00 0.00 0.00 23.12 24.31 2brq s ALA 2251CO -0.02 -0.72 -0.23 -1.21 0.00 0.00 0.00 175.76 173.58 2brq s GLU 2252N -4.09 1.60 0.10 0.00 2.02 -1.26 -1.23 118.70 115.84 2brq s GLU 2252Ca 0.31 -1.00 -0.33 0.00 0.02 0.00 0.00 54.97 53.97 2brq s GLU 2252Cb 0.03 -1.73 -0.12 0.00 0.10 0.00 0.00 34.13 32.41 2brq s GLU 2252CO 0.10 0.45 1.74 0.00 0.02 0.00 0.00 175.26 177.57 2brq n ALA 2253N 1.88 1.70 -0.53 5.21 0.00 0.33 -1.99 120.51 127.11 2brq n ALA 2253Ca -0.17 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2brq n ALA 2253Cb 0.53 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.50 2brq n ALA 2253CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2brq n GLY 2254N 3.95 1.36 3.51 0.00 0.00 0.65 -4.43 105.19 110.22 2brq n GLY 2254Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2brq n GLY 2254CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2brq s VAL 2255N -3.31 4.25 0.16 1.61 1.01 -0.84 -4.95 120.40 118.32 2brq s VAL 2255Ca 0.00 -0.21 -0.34 0.00 0.00 0.00 0.00 61.98 61.43 2brq s VAL 2255Cb 0.00 -2.93 -0.14 0.00 0.00 0.00 0.00 36.38 33.32 2brq s VAL 2255CO 0.00 0.43 1.61 -2.65 0.00 0.00 0.00 175.10 174.49 2brq n PRO 2256N 4.05 2.24 -4.46 2.72 -0.02 -1.26 -4.52 135.00 133.75 2brq n PRO 2256Ca -0.17 0.81 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 2brq n PRO 2256Cb 0.52 -2.59 -0.12 0.00 -0.02 0.00 0.00 33.50 31.29 2brq n PRO 2256CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2brq s ALA 2257N 1.04 2.95 -0.00 3.55 0.00 0.72 -4.93 121.76 125.09 2brq s ALA 2257Ca 0.79 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 52.00 2brq s ALA 2257Cb -0.66 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 2brq s ALA 2257CO 0.37 0.23 -0.25 -1.21 0.00 0.00 0.00 175.76 174.90 2brq s GLU 2258N 0.33 1.95 0.33 0.00 2.02 -1.26 -1.04 118.70 121.04 2brq s GLU 2258Ca -0.05 -0.95 -0.06 0.00 0.02 0.00 0.00 54.97 53.93 2brq s GLU 2258Cb -0.14 -1.95 0.01 0.00 0.10 0.00 0.00 34.13 32.14 2brq s GLU 2258CO 0.03 0.53 0.52 -0.59 0.02 0.00 0.00 175.26 175.77 2brq s PHE 2259N -0.65 0.81 0.09 1.61 -0.71 -0.56 -0.25 117.98 118.32 2brq s PHE 2259Ca 0.10 -1.13 0.06 0.00 -1.04 0.00 0.00 56.93 54.92 2brq s PHE 2259Cb -0.10 0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.78 2brq s PHE 2259CO -0.00 -1.18 -0.15 -1.12 -1.34 0.00 0.00 175.22 171.43 2brq s SER 2260N -3.18 1.91 -0.13 1.98 0.01 -0.08 -1.13 113.70 113.08 2brq s SER 2260Ca 0.27 -0.69 -0.00 0.00 1.31 0.00 0.00 55.95 56.84 2brq s SER 2260Cb -0.01 -0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.18 2brq s SER 2260CO 0.17 -0.08 -0.10 -0.63 0.41 0.00 0.00 173.24 173.01 2brq s ILE 2261N -1.54 1.25 -0.50 1.44 1.01 0.79 -1.76 121.20 121.89 2brq s ILE 2261Ca 0.03 -0.46 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 2brq s ILE 2261Cb -0.08 -1.24 0.03 0.00 0.01 0.00 0.00 42.46 41.17 2brq s ILE 2261CO 0.03 0.37 1.15 0.86 0.00 0.00 0.00 174.94 177.35 2brq s TRP 2262N 1.61 2.77 -0.18 3.97 -0.11 0.19 -0.36 118.94 126.83 2brq s TRP 2262Ca 0.04 0.65 0.07 0.00 1.22 0.00 0.00 56.10 58.08 2brq s TRP 2262Cb -0.13 -4.46 -0.08 0.00 -1.50 0.00 0.00 33.47 27.30 2brq s TRP 2262CO -0.09 -1.34 0.22 0.25 -4.62 0.00 0.00 176.95 171.37 2brq n THR 2263N 6.82 0.00 -0.21 5.86 -2.24 -1.26 -2.76 114.28 120.48 2brq n THR 2263Ca 0.11 -0.27 0.25 0.00 -2.27 0.00 0.00 64.05 61.88 2brq n THR 2263Cb 0.49 0.73 0.64 0.00 -2.10 0.00 0.00 70.33 70.08 2brq n THR 2263CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2brq h ARG 2264N 0.00 0.16 0.00 -0.78 2.43 -1.89 -2.30 114.38 112.00 2brq h ARG 2264Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2brq h ARG 2264Cb 0.22 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2brq h ARG 2264CO 0.00 0.11 -0.85 0.39 -1.51 0.00 0.00 179.97 178.11 2brq n GLU 2265N -4.38 0.08 0.10 0.20 1.02 -1.26 -4.49 120.64 111.91 2brq n GLU 2265Ca 0.19 -0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 2brq n GLU 2265Cb 0.87 -1.52 0.31 0.00 -0.02 0.00 0.00 31.44 31.09 2brq n GLU 2265CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2brq h ALA 2266N 2.88 0.87 -0.30 0.62 0.00 -1.64 -3.48 119.26 118.22 2brq h ALA 2266Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2brq h ALA 2266Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2brq h ALA 2266CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2brq n GLY 2267N 1.30 -0.35 3.80 0.00 0.00 -1.26 -4.74 105.19 103.94 2brq n GLY 2267Ca 0.05 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 2brq n GLY 2267CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2brq s ALA 2268N -1.30 3.47 0.00 4.61 0.00 -1.26 -5.03 121.76 122.26 2brq s ALA 2268Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2brq s ALA 2268Cb 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.30 2brq s ALA 2268CO 0.00 0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.51 2brq n GLY 2269N 1.27 -0.32 3.61 0.00 0.00 -1.26 -4.98 105.19 103.52 2brq n GLY 2269Ca -0.05 -1.12 -0.39 0.00 0.00 0.00 0.00 46.02 44.45 2brq n GLY 2269CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2brq s GLY 2270N 0.00 1.90 -0.36 -0.02 0.00 -1.26 -4.91 107.32 102.66 2brq s GLY 2270Ca 0.00 -0.79 -0.10 0.00 0.00 0.00 0.00 44.72 43.82 2brq s GLY 2270CO 0.00 0.96 0.19 -2.27 0.00 0.00 0.00 173.10 171.99 2brq s LEU 2271N 2.00 4.57 -0.13 0.66 2.96 -1.26 -0.99 118.68 126.49 2brq s LEU 2271Ca 0.15 -0.90 0.01 0.00 -0.22 0.00 0.00 54.13 53.17 2brq s LEU 2271Cb -0.16 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 2brq s LEU 2271CO 0.10 -0.34 -0.15 0.00 -1.32 0.00 0.00 176.35 174.63 2brq s ALA 2272N 1.56 2.53 -0.07 5.97 0.00 0.04 -4.98 121.76 126.81 2brq s ALA 2272Ca 0.02 -0.92 0.04 0.00 0.00 0.00 0.00 51.96 51.10 2brq s ALA 2272Cb -0.19 -1.15 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 2brq s ALA 2272CO 0.06 0.22 -0.18 0.42 0.00 0.00 0.00 175.76 176.29 2brq s ILE 2273N 0.40 2.71 -0.00 0.00 1.09 -1.26 -1.07 121.20 123.07 2brq s ILE 2273Ca -0.12 -0.83 -0.01 0.00 -1.10 0.00 0.00 60.65 58.59 2brq s ILE 2273Cb -0.16 -2.05 -0.00 0.00 -1.06 0.00 0.00 42.46 39.18 2brq s ILE 2273CO 0.06 0.57 0.02 0.00 -0.10 0.00 0.00 174.94 175.49 2brq s ALA 2274N -0.33 -0.04 -0.09 9.38 0.00 -0.42 -4.98 121.76 125.29 2brq s ALA 2274Ca 0.02 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 51.87 2brq s ALA 2274Cb -0.13 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.03 2brq s ALA 2274CO 0.02 -0.07 -0.14 0.08 0.00 0.00 0.00 175.76 175.65 2brq s VAL 2275N -0.53 1.36 -0.03 0.00 1.01 -1.26 -0.46 120.40 120.50 2brq s VAL 2275Ca -0.06 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.37 2brq s VAL 2275Cb -0.04 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 2brq s VAL 2275CO -0.00 0.41 -0.14 -0.70 0.00 0.00 0.00 175.10 174.67 2brq s GLU 2276N 0.77 1.33 0.00 2.72 2.12 -0.10 -4.84 118.70 120.70 2brq s GLU 2276Ca -0.12 -0.48 0.00 0.00 0.36 0.00 0.00 54.97 54.73 2brq s GLU 2276Cb -0.16 -1.21 0.00 0.00 0.26 0.00 0.00 34.13 33.02 2brq s GLU 2276CO 0.02 0.22 0.00 0.41 -0.54 0.00 0.00 175.26 175.37 2brq n GLY 2277N 3.07 -1.06 0.15 -1.50 0.00 -1.26 -0.23 105.19 104.36 2brq n GLY 2277Ca -0.17 -1.03 0.11 0.00 0.00 0.00 0.00 46.02 44.94 2brq n GLY 2277CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2brq n PRO 2278N 0.00 0.16 -4.05 1.61 -0.04 -1.26 -4.76 135.00 126.66 2brq n PRO 2278Ca 0.00 0.56 -0.09 0.00 -0.04 0.00 0.00 63.50 63.93 2brq n PRO 2278Cb 0.00 -1.93 -0.09 0.00 -0.04 0.00 0.00 33.50 31.44 2brq n PRO 2278CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2brq s SER 2279N -4.13 0.27 0.53 3.54 1.04 -1.26 -4.97 113.70 108.71 2brq s SER 2279Ca 0.00 -1.01 -0.22 0.00 0.48 0.00 0.00 55.95 55.20 2brq s SER 2279Cb 0.07 0.31 -0.06 0.00 0.10 0.00 0.00 66.02 66.45 2brq s SER 2279CO 0.27 -0.73 1.36 0.29 0.98 0.00 0.00 173.24 175.41 2brq n LYS 2280N -0.07 1.77 -4.57 4.02 5.02 -1.26 -4.76 118.16 118.31 2brq n LYS 2280Ca -0.09 0.65 -0.25 0.00 -2.02 0.00 0.00 58.31 56.60 2brq n LYS 2280Cb 0.63 -2.57 -0.14 0.00 -0.02 0.00 0.00 35.03 32.93 2brq n LYS 2280CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2brq s ALA 2281N -1.27 1.68 -0.14 7.82 0.00 -1.26 -3.14 121.76 125.45 2brq s ALA 2281Ca 0.70 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 51.62 2brq s ALA 2281Cb -0.43 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 2brq s ALA 2281CO 0.51 0.37 -0.16 -1.21 0.00 0.00 0.00 175.76 175.27 2brq s GLU 2282N -1.24 3.24 -0.05 0.00 2.02 -0.44 -4.97 118.70 117.27 2brq s GLU 2282Ca 0.07 -0.75 0.05 0.00 0.02 0.00 0.00 54.97 54.35 2brq s GLU 2282Cb -0.09 -2.57 -0.00 0.00 0.10 0.00 0.00 34.13 31.56 2brq s GLU 2282CO 0.02 0.11 -0.19 0.42 0.02 0.00 0.00 175.26 175.64 2brq s ILE 2283N 0.59 1.59 0.10 -1.63 1.01 -1.26 -1.54 121.20 120.05 2brq s ILE 2283Ca -0.09 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.78 2brq s ILE 2283Cb -0.16 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2brq s ILE 2283CO 0.03 0.45 -0.09 -0.94 0.00 0.00 0.00 174.94 174.40 2brq s SER 2284N -0.01 1.34 0.12 3.58 1.04 0.06 -5.01 113.70 114.82 2brq s SER 2284Ca -0.04 -0.86 -0.13 0.00 0.48 0.00 0.00 55.95 55.41 2brq s SER 2284Cb -0.12 0.03 -0.06 0.00 0.10 0.00 0.00 66.02 65.97 2brq s SER 2284CO 0.03 -0.32 0.49 -0.36 0.98 0.00 0.00 173.24 174.06 2brq s PHE 2285N -2.73 3.60 0.12 5.02 0.08 -1.26 -1.54 117.98 121.27 2brq s PHE 2285Ca 0.07 0.96 -0.01 0.00 0.12 0.00 0.00 56.93 58.06 2brq s PHE 2285Cb -0.01 -2.29 -0.04 0.00 -0.57 0.00 0.00 43.02 40.11 2brq s PHE 2285CO -0.01 0.46 0.05 -1.21 -0.10 0.00 0.00 175.22 174.41 2brq s GLU 2286N -1.94 0.89 0.40 0.44 2.02 0.24 -4.92 118.70 115.83 2brq s GLU 2286Ca 0.36 -1.40 -0.23 0.00 0.02 0.00 0.00 54.97 53.72 2brq s GLU 2286Cb -0.15 0.24 -0.10 0.00 0.10 0.00 0.00 34.13 34.23 2brq s GLU 2286CO 0.19 -0.24 0.98 -0.51 0.02 0.00 0.00 175.26 175.69 2brq s ASP 2287N -3.03 6.94 0.01 -0.19 1.01 -1.26 -0.89 116.67 119.25 2brq s ASP 2287Ca 0.21 1.84 0.06 0.00 0.71 0.00 0.00 52.55 55.37 2brq s ASP 2287Cb 0.07 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 2brq s ASP 2287CO 0.00 -0.36 -0.18 -0.13 0.21 0.00 0.00 175.17 174.72 2brq s ARG 2288N -2.71 1.33 0.33 8.23 1.81 -1.25 -4.62 118.95 122.08 2brq s ARG 2288Ca 0.58 -0.70 0.05 0.00 -1.72 0.00 0.00 55.73 53.94 2brq s ARG 2288Cb -0.16 -1.33 0.68 0.00 -0.45 0.00 0.00 34.95 33.69 2brq s ARG 2288CO 0.20 0.36 1.89 -0.22 -0.68 0.00 0.00 175.30 176.85 2brq h LYS 2289N 5.43 0.83 0.00 3.54 3.64 -1.98 -2.56 116.57 125.47 2brq h LYS 2289Ca -0.38 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2brq h LYS 2289Cb 1.16 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2brq h LYS 2289CO 0.47 0.55 0.00 -0.40 -2.27 0.00 0.00 179.45 177.80 2brq n ASP 2290N -4.53 0.00 0.00 4.20 5.68 -1.26 -4.86 116.55 115.78 2brq n ASP 2290Ca 0.15 -0.38 0.00 0.00 -0.50 0.00 0.00 54.79 54.06 2brq n ASP 2290Cb 0.32 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 2brq n ASP 2290CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2brq n GLY 2291N 0.63 1.14 3.72 6.12 0.00 -0.96 -5.04 105.19 110.80 2brq n GLY 2291Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2brq n GLY 2291CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2brq s SER 2292N -3.09 3.34 -0.29 1.61 1.04 -1.26 -4.84 113.70 110.21 2brq s SER 2292Ca 0.00 1.31 -0.21 0.00 0.48 0.00 0.00 55.95 57.52 2brq s SER 2292Cb 0.00 -1.98 -0.01 0.00 0.10 0.00 0.00 66.02 64.13 2brq s SER 2292CO 0.00 -2.70 0.67 0.00 0.98 0.00 0.00 173.24 172.19 2brq s GLY 2294N 1.58 2.78 -0.04 0.00 0.00 -0.07 -0.15 107.32 111.43 2brq s GLY 2294Ca 0.27 0.25 0.05 0.00 0.00 0.00 0.00 44.72 45.29 2brq s GLY 2294CO 0.11 0.69 -0.20 0.14 0.00 0.00 0.00 173.10 173.85 2brq s VAL 2295N -1.26 1.60 -0.03 1.40 1.01 -0.28 0.82 120.40 123.65 2brq s VAL 2295Ca 0.37 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.57 2brq s VAL 2295Cb -0.20 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 2brq s VAL 2295CO 0.23 0.45 -0.19 0.00 0.00 0.00 0.00 175.10 175.59 2brq s ALA 2296N -0.15 1.67 0.10 5.51 0.00 -0.59 -1.49 121.76 126.81 2brq s ALA 2296Ca -0.00 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2brq s ALA 2296Cb -0.11 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 2brq s ALA 2296CO 0.02 0.35 -0.11 1.52 0.00 0.00 0.00 175.76 177.53 2brq s TYR 2297N -0.19 1.16 -0.04 0.00 1.13 -0.20 -0.76 117.35 118.44 2brq s TYR 2297Ca 0.01 -0.61 0.02 0.00 -1.41 0.00 0.00 57.07 55.08 2brq s TYR 2297Cb -0.10 -0.63 0.01 0.00 -1.10 0.00 0.00 41.96 40.14 2brq s TYR 2297CO 0.01 0.05 -0.09 0.08 -2.51 0.00 0.00 175.55 173.09 2brq s VAL 2298N -2.26 0.83 0.17 -3.49 1.01 -0.59 -0.20 120.40 115.86 2brq s VAL 2298Ca 0.06 -0.33 0.09 0.00 0.00 0.00 0.00 61.98 61.80 2brq s VAL 2298Cb -0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 2brq s VAL 2298CO 0.01 0.28 -0.14 0.68 0.00 0.00 0.00 175.10 175.93 2brq s VAL 2299N 0.57 2.97 -0.06 2.92 -7.23 -1.26 -1.33 120.40 116.98 2brq s VAL 2299Ca -0.10 -1.70 0.06 0.00 -1.81 0.00 0.00 61.98 58.43 2brq s VAL 2299Cb -0.13 -2.44 -0.24 0.00 0.56 0.00 0.00 36.38 34.13 2brq s VAL 2299CO 0.02 -0.07 0.59 1.56 -0.31 0.00 0.00 175.10 176.89 2brq h GLN 2300N 3.12 0.09 -6.65 4.82 1.08 -1.84 0.19 115.11 115.92 2brq h GLN 2300Ca -0.47 -0.16 -0.67 0.00 -1.45 0.00 0.00 58.65 55.90 2brq h GLN 2300Cb 1.20 0.06 -0.17 0.00 -0.05 0.00 0.00 27.48 28.51 2brq h GLN 2300CO 0.51 0.75 -0.78 -1.21 -0.95 0.00 0.00 178.83 177.15 2brq s GLU 2301N -2.59 1.86 0.84 1.46 0.41 -1.26 -4.42 118.70 114.99 2brq s GLU 2301Ca -0.10 -1.19 -0.11 0.00 -0.41 0.00 0.00 54.97 53.16 2brq s GLU 2301Cb 0.08 -2.13 0.10 0.00 -1.78 0.00 0.00 34.13 30.39 2brq s GLU 2301CO 0.81 0.47 1.12 -1.25 -0.49 0.00 0.00 175.26 175.93 2brq s PRO 2302N -2.30 1.64 0.00 0.39 0.04 -1.26 -4.78 135.00 128.73 2brq s PRO 2302Ca 0.20 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2brq s PRO 2302Cb -0.10 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2brq s PRO 2302CO 0.11 -2.14 0.00 0.41 0.04 0.00 0.00 177.00 175.42 2brq n GLY 2303N -0.42 -0.01 3.70 0.56 0.00 -0.21 -4.90 105.19 103.93 2brq n GLY 2303Ca 0.11 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 44.12 2brq n GLY 2303CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2brq s ASP 2304N -3.38 5.84 0.15 1.61 1.01 -1.26 -0.35 116.67 120.29 2brq s ASP 2304Ca 0.00 0.19 0.10 0.00 0.71 0.00 0.00 52.55 53.55 2brq s ASP 2304Cb 0.00 -1.95 -0.04 0.00 1.01 0.00 0.00 42.92 41.94 2brq s ASP 2304CO 0.00 0.24 -0.23 -0.31 0.21 0.00 0.00 175.17 175.08 2brq s TYR 2305N -0.04 2.08 -0.18 4.23 1.51 -0.74 -4.47 117.35 119.76 2brq s TYR 2305Ca 0.07 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.70 2brq s TYR 2305Cb -0.12 -1.08 -0.02 0.00 -0.11 0.00 0.00 41.96 40.63 2brq s TYR 2305CO 0.01 0.35 -0.05 -1.21 -1.11 0.00 0.00 175.55 173.54 2brq s GLU 2306N -2.35 3.52 -0.28 -0.62 2.02 0.68 -0.55 118.70 121.12 2brq s GLU 2306Ca 0.14 -0.58 -0.06 0.00 0.02 0.00 0.00 54.97 54.49 2brq s GLU 2306Cb -0.09 -2.91 0.01 0.00 0.10 0.00 0.00 34.13 31.24 2brq s GLU 2306CO 0.07 0.07 0.06 0.08 0.02 0.00 0.00 175.26 175.56 2brq s VAL 2307N 0.78 3.87 0.06 2.63 1.01 0.40 -0.92 120.40 128.23 2brq s VAL 2307Ca -0.02 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.31 2brq s VAL 2307Cb -0.15 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 2brq s VAL 2307CO 0.02 0.12 0.08 -0.94 0.00 0.00 0.00 175.10 174.38 2brq s SER 2308N 1.49 5.59 -0.13 3.32 1.04 0.39 -0.80 113.70 124.60 2brq s SER 2308Ca 0.03 0.04 -0.01 0.00 0.48 0.00 0.00 55.95 56.48 2brq s SER 2308Cb -0.17 -1.53 0.04 0.00 0.10 0.00 0.00 66.02 64.46 2brq s SER 2308CO 0.02 0.20 -0.01 -0.69 0.98 0.00 0.00 173.24 173.73 2brq s VAL 2309N -1.34 0.64 0.10 5.02 1.01 -1.26 -1.30 120.40 123.26 2brq s VAL 2309Ca 0.28 -0.27 0.09 0.00 0.00 0.00 0.00 61.98 62.08 2brq s VAL 2309Cb -0.12 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 2brq s VAL 2309CO 0.20 0.11 -0.24 -0.54 0.00 0.00 0.00 175.10 174.63 2brq s LYS 2310N 1.84 1.35 -0.10 2.72 1.02 -0.23 -1.41 119.74 124.94 2brq s LYS 2310Ca 0.02 -1.20 -0.01 0.00 0.02 0.00 0.00 55.97 54.81 2brq s LYS 2310Cb -0.14 -1.68 0.03 0.00 -0.52 0.00 0.00 37.83 35.51 2brq s LYS 2310CO -0.07 0.40 -0.05 0.12 -0.92 0.00 0.00 175.35 174.83 2brq s PHE 2311N -1.03 1.22 -1.55 3.18 5.36 0.34 -0.78 117.98 124.73 2brq s PHE 2311Ca 0.10 -0.55 -0.13 0.00 -0.96 0.00 0.00 56.93 55.39 2brq s PHE 2311Cb -0.10 -1.09 0.09 0.00 -0.34 0.00 0.00 43.02 41.59 2brq s PHE 2311CO 0.04 -0.44 0.88 0.09 -1.46 0.00 0.00 175.22 174.33 2brq n ASN 2312N 4.94 -3.88 -0.67 6.13 3.02 -0.16 -2.54 115.26 122.09 2brq n ASN 2312Ca -0.12 -0.85 -0.08 0.00 -0.03 0.00 0.00 54.58 53.50 2brq n ASN 2312Cb 0.50 -3.59 -0.03 0.00 -0.61 0.00 0.00 39.78 36.05 2brq n ASN 2312CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2brq n GLU 2313N -4.57 -0.58 -5.01 3.52 1.02 -1.26 -4.86 120.64 108.89 2brq n GLU 2313Ca -0.00 0.73 -0.29 0.00 -0.02 0.00 0.00 57.16 57.58 2brq n GLU 2313Cb 0.54 -4.59 -0.17 0.00 -0.02 0.00 0.00 31.44 27.20 2brq n GLU 2313CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2brq s GLU 2314N -2.95 2.44 0.26 3.49 0.41 -1.05 -5.06 118.70 116.24 2brq s GLU 2314Ca 0.00 -0.73 -0.31 0.00 -0.41 0.00 0.00 54.97 53.52 2brq s GLU 2314Cb 0.00 -1.94 -0.13 0.00 -1.78 0.00 0.00 34.13 30.28 2brq s GLU 2314CO 0.00 0.19 1.50 0.72 -0.49 0.00 0.00 175.26 177.17 2brq n HIS 2315N 3.44 2.48 -1.69 1.61 8.25 -1.26 -0.50 115.22 127.54 2brq n HIS 2315Ca -0.20 0.34 -0.29 0.00 -0.26 0.00 0.00 57.72 57.32 2brq n HIS 2315Cb 0.53 -2.53 0.11 0.00 1.12 0.00 0.00 29.99 29.22 2brq n HIS 2315CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2brq s ILE 2316N 0.00 2.31 0.27 1.59 -4.36 -0.50 -4.73 121.20 115.79 2brq s ILE 2316Ca 0.67 0.10 -0.30 0.00 -0.26 0.00 0.00 60.65 60.86 2brq s ILE 2316Cb -0.58 -2.95 -0.13 0.00 1.25 0.00 0.00 42.46 40.05 2brq s ILE 2316CO 0.49 -0.13 1.37 -2.65 0.24 0.00 0.00 174.94 174.26 2brq n PRO 2317N -3.50 2.07 -0.61 0.37 -0.02 -1.26 -1.90 135.00 130.15 2brq n PRO 2317Ca 0.07 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2brq n PRO 2317Cb 0.59 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2brq n PRO 2317CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2brq n ASP 2318N 1.78 0.00 -4.82 2.55 8.00 -1.26 -4.77 116.55 118.04 2brq n ASP 2318Ca 0.10 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.23 2brq n ASP 2318Cb 0.33 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 2brq n ASP 2318CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2brq s SER 2319N -3.03 7.05 0.58 -2.24 0.15 -0.80 -3.78 113.70 111.63 2brq s SER 2319Ca 0.00 1.34 -0.15 0.00 0.70 0.00 0.00 55.95 57.84 2brq s SER 2319Cb 0.00 -2.39 -0.05 0.00 -1.71 0.00 0.00 66.02 61.87 2brq s SER 2319CO 0.00 0.13 1.02 -2.16 1.20 0.00 0.00 173.24 173.43 2brq s PRO 2320N -1.67 3.58 -0.19 5.44 0.04 -1.26 -4.73 135.00 136.22 2brq s PRO 2320Ca 0.38 0.99 -0.10 0.00 0.04 0.00 0.00 61.00 62.31 2brq s PRO 2320Cb -0.18 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 2brq s PRO 2320CO 0.21 -0.58 0.13 -0.06 0.04 0.00 0.00 177.00 176.74 2brq s PHE 2321N -2.73 3.44 -0.22 0.56 0.40 0.02 -4.92 117.98 114.53 2brq s PHE 2321Ca 0.59 0.36 -0.20 0.00 -0.60 0.00 0.00 56.93 57.08 2brq s PHE 2321Cb -0.12 -2.13 -0.03 0.00 0.51 0.00 0.00 43.02 41.25 2brq s PHE 2321CO 0.40 0.35 0.59 0.08 0.70 0.00 0.00 175.22 177.34 2brq s VAL 2322N 0.17 5.04 -0.22 -0.44 1.01 -1.26 -0.45 120.40 124.24 2brq s VAL 2322Ca 0.09 1.08 0.02 0.00 0.00 0.00 0.00 61.98 63.17 2brq s VAL 2322Cb -0.11 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.41 2brq s VAL 2322CO -0.01 0.11 -0.14 -0.69 0.00 0.00 0.00 175.10 174.36 2brq s VAL 2323N 1.99 2.06 0.06 2.92 1.01 0.29 -4.87 120.40 123.86 2brq s VAL 2323Ca 0.26 -1.29 -0.30 0.00 0.00 0.00 0.00 61.98 60.65 2brq s VAL 2323Cb -0.16 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 2brq s VAL 2323CO 0.10 0.22 1.11 -2.16 0.00 0.00 0.00 175.10 174.37 2brq s PRO 2324N 1.21 4.50 -0.19 2.72 0.04 -1.26 -1.79 135.00 140.23 2brq s PRO 2324Ca -0.03 1.65 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 2brq s PRO 2324Cb -0.17 -3.37 -0.00 0.00 0.04 0.00 0.00 34.50 31.00 2brq s PRO 2324CO -0.09 -0.13 -0.10 0.08 0.04 0.00 0.00 177.00 176.80 2brq s VAL 2325N 0.80 2.95 0.27 -0.36 1.01 0.53 -2.32 120.40 123.27 2brq s VAL 2325Ca 0.55 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.91 2brq s VAL 2325Cb -0.27 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 2brq s VAL 2325CO 0.30 0.47 0.42 0.00 0.00 0.00 0.00 175.10 176.29 2brq s ALA 2326N 1.21 3.86 0.47 5.51 0.00 -0.37 -1.04 121.76 131.40 2brq s ALA 2326Ca 0.02 -1.11 -0.24 0.00 0.00 0.00 0.00 51.96 50.63 2brq s ALA 2326Cb -0.14 -1.86 -0.08 0.00 0.00 0.00 0.00 23.12 21.04 2brq s ALA 2326CO -0.04 0.17 1.35 0.43 0.00 0.00 0.00 175.76 177.68 2brq n SER 2327N -1.48 2.87 -4.77 0.00 7.64 -1.26 -0.51 113.62 116.10 2brq n SER 2327Ca -0.08 1.07 -0.41 0.00 1.01 0.00 0.00 58.87 60.47 2brq n SER 2327Cb 0.57 -1.56 -0.00 0.00 -1.01 0.00 0.00 64.21 62.20 2brq n SER 2327CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2brq s PRO 2328N -2.49 4.11 0.00 1.43 0.04 -1.26 -4.75 135.00 132.08 2brq s PRO 2328Ca 0.64 2.57 0.32 0.00 0.04 0.00 0.00 61.00 64.57 2brq s PRO 2328Cb -0.46 -2.98 1.81 0.00 0.04 0.00 0.00 34.50 32.91 2brq s PRO 2328CO 0.55 -0.55 2.18 0.43 0.04 0.00 0.00 177.00 179.65