#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bt4 s SER 2203N 0.00 5.95 0.52 0.55 1.04 -1.26 -4.76 113.70 115.73 2bt4 s SER 2203Ca 0.00 -0.13 0.18 0.00 0.48 0.00 0.00 55.95 56.48 2bt4 s SER 2203Cb 0.00 -1.26 1.27 0.00 0.10 0.00 0.00 66.02 66.13 2bt4 s SER 2203CO 0.00 -0.47 2.11 -0.07 0.98 0.00 0.00 173.24 175.79 2bt4 h LEU 2204N 0.83 0.03 -1.16 2.42 4.07 -1.78 -2.25 115.31 117.46 2bt4 h LEU 2204Ca -0.46 -0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.42 2bt4 h LEU 2204Cb 1.26 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.98 2bt4 h LEU 2204CO 0.53 0.02 -0.39 0.00 -1.08 0.00 0.00 178.44 177.52 2bt4 h ALA 2205N 1.92 1.21 0.00 1.53 0.00 -1.93 -3.32 119.26 118.67 2bt4 h ALA 2205Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2bt4 h ALA 2205Cb 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2bt4 h ALA 2205CO -0.00 0.49 -0.65 0.09 0.00 0.00 0.00 179.25 179.17 2bt4 n ASN 2206N -3.87 0.70 -3.66 0.00 3.02 -0.88 -5.00 115.26 105.57 2bt4 n ASN 2206Ca -0.01 -0.72 -0.15 0.00 -0.03 0.00 0.00 54.58 53.67 2bt4 n ASN 2206Cb 0.45 1.05 -0.08 0.00 -0.61 0.00 0.00 39.78 40.59 2bt4 n ASN 2206CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bt4 s ALA 2207N -2.20 -1.27 0.74 5.41 0.00 -1.02 -4.98 121.76 118.44 2bt4 s ALA 2207Ca 0.04 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 2bt4 s ALA 2207Cb 0.09 -0.22 0.04 0.00 0.00 0.00 0.00 23.12 23.03 2bt4 s ALA 2207CO 0.50 -0.29 1.11 -1.25 0.00 0.00 0.00 175.76 175.82 2bt4 s PRO 2208N -0.82 2.37 -0.04 0.00 0.04 -1.26 -4.34 135.00 130.95 2bt4 s PRO 2208Ca -0.09 1.30 -0.26 0.00 0.04 0.00 0.00 61.00 61.99 2bt4 s PRO 2208Cb -0.03 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 2bt4 s PRO 2208CO 0.05 -1.57 0.79 0.42 0.04 0.00 0.00 177.00 176.74 2bt4 s ILE 2209N -2.65 4.97 -0.07 0.56 1.01 0.13 -1.12 121.20 124.04 2bt4 s ILE 2209Ca 0.64 1.65 -0.28 0.00 0.00 0.00 0.00 60.65 62.67 2bt4 s ILE 2209Cb -0.19 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 2bt4 s ILE 2209CO 0.50 0.23 0.90 -0.32 0.00 0.00 0.00 174.94 176.25 2bt4 s MET 2210N 0.82 4.45 -0.30 2.79 -2.45 -0.40 -0.85 119.30 123.37 2bt4 s MET 2210Ca 0.42 1.23 -0.02 0.00 -1.25 0.00 0.00 55.69 56.07 2bt4 s MET 2210Cb -0.19 -3.50 0.05 0.00 1.25 0.00 0.00 34.83 32.44 2bt4 s MET 2210CO 0.22 -0.15 0.00 0.42 1.05 0.00 0.00 175.02 176.56 2bt4 s ILE 2211N 1.43 3.03 -0.11 10.11 1.01 0.04 -0.66 121.20 136.05 2bt4 s ILE 2211Ca 0.46 -1.34 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 2bt4 s ILE 2211Cb -0.19 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.53 2bt4 s ILE 2211CO 0.20 -0.09 -0.06 -0.76 0.00 0.00 0.00 174.94 174.24 2bt4 s LEU 2212N 1.27 3.18 -0.07 2.97 1.43 0.39 -0.97 118.68 126.87 2bt4 s LEU 2212Ca -0.05 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 2bt4 s LEU 2212Cb -0.20 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.30 2bt4 s LEU 2212CO -0.01 0.26 -0.17 0.20 0.23 0.00 0.00 176.35 176.85 2bt4 s ASN 2213N -0.17 2.31 0.24 2.29 0.01 -0.47 -1.15 114.94 117.99 2bt4 s ASN 2213Ca 0.03 -0.40 0.00 0.00 -0.71 0.00 0.00 52.86 51.78 2bt4 s ASN 2213Cb -0.13 -0.95 0.00 0.00 0.41 0.00 0.00 41.25 40.58 2bt4 s ASN 2213CO 0.03 0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.33 2bt4 n GLY 2214N 3.54 0.16 3.76 0.66 0.00 -0.03 -1.41 105.19 111.87 2bt4 n GLY 2214Ca -0.20 -1.81 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 2bt4 n GLY 2214CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bt4 s PRO 2215N -0.29 3.45 0.00 1.61 0.04 -1.03 -3.07 135.00 135.70 2bt4 s PRO 2215Ca 0.00 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2bt4 s PRO 2215Cb 0.00 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.16 2bt4 s PRO 2215CO 0.00 -0.91 0.00 0.09 0.04 0.00 0.00 177.00 176.22 2bt4 n ASN 2216N -0.69 0.00 0.19 6.66 3.02 -1.26 -4.56 115.26 118.62 2bt4 n ASN 2216Ca 0.08 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.77 2bt4 n ASN 2216Cb 0.45 -0.08 0.62 0.00 -0.61 0.00 0.00 39.78 40.17 2bt4 n ASN 2216CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2bt4 h LEU 2217N 0.00 0.00 -2.16 3.41 3.38 -1.91 -1.60 115.31 116.42 2bt4 h LEU 2217Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2bt4 h LEU 2217Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2bt4 h LEU 2217CO 0.00 0.00 0.28 -0.55 0.09 0.00 0.00 178.44 178.26 2bt4 h ASN 2218N 0.00 0.00 -0.44 -0.43 -1.07 -1.88 -2.10 115.58 109.67 2bt4 h ASN 2218Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2bt4 h ASN 2218Cb 0.31 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.56 2bt4 h ASN 2218CO 0.00 0.00 0.00 0.18 0.07 0.00 0.00 177.43 177.68 2bt4 n LEU 2219N -3.56 2.68 -4.71 6.14 4.77 -0.60 -4.69 117.00 117.02 2bt4 n LEU 2219Ca 0.02 -1.28 -0.43 0.00 -0.03 0.00 0.00 56.01 54.30 2bt4 n LEU 2219Cb 0.40 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2bt4 n LEU 2219CO 0.24 0.64 1.00 -0.11 -1.33 0.00 0.00 177.39 177.83 2bt4 n LEU 2220N 0.97 3.78 0.00 2.23 7.94 -0.79 -1.65 117.00 129.47 2bt4 n LEU 2220Ca 0.17 1.19 0.00 0.00 -1.11 0.00 0.00 56.01 56.27 2bt4 n LEU 2220Cb 0.44 -1.51 0.00 0.00 0.53 0.00 0.00 43.42 42.88 2bt4 n LEU 2220CO 0.13 -0.31 0.00 0.61 -1.11 0.00 0.00 177.39 176.71 2bt4 n GLY 2221N 1.08 3.48 0.09 -3.96 0.00 -1.17 -3.95 105.19 100.77 2bt4 n GLY 2221Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2bt4 n GLY 2221CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bt4 n GLN 2222N -2.00 0.34 -3.72 1.61 6.02 -0.66 -4.79 117.38 114.18 2bt4 n GLN 2222Ca 0.00 -0.18 -0.04 0.00 -0.01 0.00 0.00 57.00 56.77 2bt4 n GLN 2222Cb 0.00 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.75 2bt4 n GLN 2222CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2bt4 s ARG 2223N -2.78 1.15 -1.47 -1.09 1.70 -1.26 -5.01 118.95 110.18 2bt4 s ARG 2223Ca 0.17 -0.62 -0.00 0.00 -0.47 0.00 0.00 55.73 54.82 2bt4 s ARG 2223Cb 0.18 0.40 0.00 0.00 -0.57 0.00 0.00 34.95 34.97 2bt4 s ARG 2223CO 0.61 -0.52 0.22 1.04 -1.08 0.00 0.00 175.30 175.56 2bt4 n GLN 2224N -0.45 -2.18 0.27 3.89 6.02 -1.26 -4.79 117.38 118.88 2bt4 n GLN 2224Ca -0.06 0.26 0.13 0.00 -0.01 0.00 0.00 57.00 57.31 2bt4 n GLN 2224Cb 0.61 -4.08 0.78 0.00 1.02 0.00 0.00 30.24 28.57 2bt4 n GLN 2224CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2bt4 h PRO 2225N -1.82 0.00 0.00 -1.09 0.13 -1.92 -0.45 132.00 126.86 2bt4 h PRO 2225Ca -0.64 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.46 2bt4 h PRO 2225Cb 1.39 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 2bt4 h PRO 2225CO 0.66 0.07 -0.13 0.93 -0.23 0.00 0.00 178.00 179.31 2bt4 h GLU 2226N 0.00 0.00 0.03 0.86 3.07 -1.89 0.04 114.58 116.69 2bt4 h GLU 2226Ca -0.00 0.00 -0.39 0.00 -0.50 0.00 0.00 59.36 58.47 2bt4 h GLU 2226Cb 0.19 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.04 2bt4 h GLU 2226CO 0.01 0.13 -2.29 -0.89 -1.40 0.00 0.00 179.01 174.57 2bt4 n ILE 2227N -4.20 1.57 0.10 3.13 5.41 -0.38 -4.76 119.36 120.22 2bt4 n ILE 2227Ca -0.02 -0.52 0.01 0.00 1.00 0.00 0.00 62.75 63.22 2bt4 n ILE 2227Cb 0.21 -1.62 -0.00 0.00 -0.71 0.00 0.00 39.64 37.51 2bt4 n ILE 2227CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2bt4 n TYR 2228N -3.57 0.00 0.00 1.39 4.02 -0.32 -4.54 117.16 114.14 2bt4 n TYR 2228Ca -0.43 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.46 2bt4 n TYR 2228Cb 0.96 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.28 2bt4 n TYR 2228CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bt4 n GLY 2229N 0.69 -0.45 0.50 2.72 0.00 -0.01 -4.73 105.19 103.91 2bt4 n GLY 2229Ca 0.01 -1.81 0.06 0.00 0.00 0.00 0.00 46.02 44.28 2bt4 n GLY 2229CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bt4 n SER 2230N -0.57 2.04 -4.77 1.61 7.64 -1.26 -4.23 113.62 114.09 2bt4 n SER 2230Ca 0.00 -1.52 -0.39 0.00 1.01 0.00 0.00 58.87 57.97 2bt4 n SER 2230Cb 0.00 0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 2bt4 n SER 2230CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2bt4 s ASP 2231N -1.06 6.57 0.80 6.43 1.01 -1.26 -4.70 116.67 124.46 2bt4 s ASP 2231Ca 0.15 2.37 -0.07 0.00 0.71 0.00 0.00 52.55 55.71 2bt4 s ASP 2231Cb 0.10 -2.62 0.14 0.00 1.01 0.00 0.00 42.92 41.56 2bt4 s ASP 2231CO 0.16 -0.64 1.11 0.42 0.21 0.00 0.00 175.17 176.42 2bt4 s THR 2232N -1.38 2.12 0.27 -1.27 -4.23 -1.26 -3.02 115.64 106.87 2bt4 s THR 2232Ca 0.56 -0.33 -0.02 0.00 -1.18 0.00 0.00 61.69 60.72 2bt4 s THR 2232Cb -0.32 -2.79 0.14 0.00 1.34 0.00 0.00 72.50 70.88 2bt4 s THR 2232CO 0.40 0.00 1.80 0.25 -0.54 0.00 0.00 174.62 176.53 2bt4 h LEU 2233N -0.92 0.78 -1.13 4.79 5.85 -1.80 -1.65 115.31 121.23 2bt4 h LEU 2233Ca -0.41 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.13 2bt4 h LEU 2233Cb 1.26 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 2bt4 h LEU 2233CO 0.43 0.79 0.24 0.00 -0.34 0.00 0.00 178.44 179.56 2bt4 h ALA 2234N 1.31 1.31 -0.69 1.25 0.00 -1.93 0.53 119.26 121.04 2bt4 h ALA 2234Ca 0.17 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2bt4 h ALA 2234Cb 0.34 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2bt4 h ALA 2234CO 0.00 0.51 0.25 -0.44 0.00 0.00 0.00 179.25 179.58 2bt4 h ASP 2235N 0.85 0.98 -0.64 0.00 3.32 -1.76 -1.73 116.42 117.43 2bt4 h ASP 2235Ca 0.20 -0.19 0.01 0.00 0.02 0.00 0.00 57.03 57.07 2bt4 h ASP 2235Cb 0.16 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 2bt4 h ASP 2235CO -0.02 0.90 0.42 0.58 -1.72 0.00 0.00 179.24 179.41 2bt4 h VAL 2236N 1.00 1.16 -0.61 -1.35 2.07 -0.38 -1.76 116.25 116.39 2bt4 h VAL 2236Ca 0.23 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2bt4 h VAL 2236Cb 0.25 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 2bt4 h VAL 2236CO -0.01 0.16 0.35 -0.08 0.02 0.00 0.00 177.57 178.00 2bt4 h GLU 2237N 0.87 0.65 -0.95 1.57 4.81 -0.60 -1.61 114.58 119.32 2bt4 h GLU 2237Ca 0.23 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2bt4 h GLU 2237Cb -0.10 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.09 2bt4 h GLU 2237CO -0.05 0.43 0.59 0.00 -0.73 0.00 0.00 179.01 179.25 2bt4 h ALA 2238N 1.29 1.21 -0.73 2.92 0.00 -1.00 -0.74 119.26 122.22 2bt4 h ALA 2238Ca 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2bt4 h ALA 2238Cb 0.10 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2bt4 h ALA 2238CO -0.14 0.65 0.42 -0.07 0.00 0.00 0.00 179.25 180.11 2bt4 h LEU 2239N 1.30 0.89 -0.43 0.00 3.38 -0.68 -2.21 115.31 117.56 2bt4 h LEU 2239Ca 0.34 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.12 2bt4 h LEU 2239Cb -0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2bt4 h LEU 2239CO -0.07 0.71 -0.16 0.00 0.09 0.00 0.00 178.44 179.01 2bt4 h VAL 2241N 0.69 0.92 -0.04 0.00 2.07 -1.05 -0.09 116.25 118.74 2bt4 h VAL 2241Ca 0.10 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2bt4 h VAL 2241Cb 0.72 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2bt4 h VAL 2241CO 0.05 0.05 0.02 0.50 0.02 0.00 0.00 177.57 178.22 2bt4 h LYS 2242N 0.30 0.06 -0.86 1.57 3.64 -1.35 -0.76 116.57 119.18 2bt4 h LYS 2242Ca 0.16 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2bt4 h LYS 2242Cb 0.12 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 2bt4 h LYS 2242CO -0.15 0.20 0.50 0.00 -2.27 0.00 0.00 179.45 177.72 2bt4 h ALA 2243N 0.86 1.27 -0.32 5.00 0.00 -1.07 -0.41 119.26 124.58 2bt4 h ALA 2243Ca 0.01 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2bt4 h ALA 2243Cb 0.16 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2bt4 h ALA 2243CO -0.00 0.62 -0.31 0.00 0.00 0.00 0.00 179.25 179.55 2bt4 h ALA 2244N 1.36 0.85 -0.14 0.00 0.00 -0.77 -2.74 119.26 117.82 2bt4 h ALA 2244Ca 0.31 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2bt4 h ALA 2244Cb -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2bt4 h ALA 2244CO -0.05 0.64 -0.36 0.00 0.00 0.00 0.00 179.25 179.47 2bt4 h ALA 2245N 1.07 1.13 0.00 0.00 0.00 -0.42 0.14 119.26 121.17 2bt4 h ALA 2245Ca 0.07 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2bt4 h ALA 2245Cb 0.82 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2bt4 h ALA 2245CO 0.07 0.56 -0.02 0.00 0.00 0.00 0.00 179.25 179.86 2bt4 h ALA 2246N 1.37 1.25 -0.22 0.00 0.00 -0.78 -2.14 119.26 118.74 2bt4 h ALA 2246Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2bt4 h ALA 2246Cb 0.75 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2bt4 h ALA 2246CO 0.06 0.03 0.00 0.72 0.00 0.00 0.00 179.25 180.06 2bt4 n HIS 2247N -3.47 0.40 -1.51 0.00 8.25 -0.32 -4.98 115.22 113.59 2bt4 n HIS 2247Ca -0.03 -0.61 0.00 0.00 -0.26 0.00 0.00 57.72 56.82 2bt4 n HIS 2247Cb 0.12 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.13 2bt4 n HIS 2247CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bt4 n GLY 2248N -0.09 0.50 0.95 -1.41 0.00 -0.79 -4.97 105.19 99.39 2bt4 n GLY 2248Ca 0.11 -0.86 -0.07 0.00 0.00 0.00 0.00 46.02 45.20 2bt4 n GLY 2248CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bt4 n GLY 2249N -1.61 3.85 3.20 -0.02 0.00 0.34 -4.14 105.19 106.80 2bt4 n GLY 2249Ca 0.00 -1.95 -0.12 0.00 0.00 0.00 0.00 46.02 43.95 2bt4 n GLY 2249CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bt4 s THR 2250N -2.02 0.22 0.23 2.61 -4.23 -1.26 -3.26 115.64 107.94 2bt4 s THR 2250Ca 0.06 -1.95 0.08 0.00 -1.18 0.00 0.00 61.69 58.70 2bt4 s THR 2250Cb 0.00 -2.24 -0.05 0.00 1.34 0.00 0.00 72.50 71.56 2bt4 s THR 2250CO 0.05 -0.30 -0.13 0.68 -0.54 0.00 0.00 174.62 174.38 2bt4 s VAL 2251N -3.98 1.79 -0.29 2.29 -7.23 -1.26 -0.69 120.40 111.04 2bt4 s VAL 2251Ca 0.29 -2.21 -0.00 0.00 -1.81 0.00 0.00 61.98 58.25 2bt4 s VAL 2251Cb 0.07 -2.18 0.09 0.00 0.56 0.00 0.00 36.38 34.92 2bt4 s VAL 2251CO 0.06 -0.49 0.06 -0.62 -0.31 0.00 0.00 175.10 173.79 2bt4 s ASP 2252N -3.37 3.96 -0.21 4.85 -1.08 -0.03 -4.84 116.67 115.95 2bt4 s ASP 2252Ca 0.25 -1.52 -0.07 0.00 -0.52 0.00 0.00 52.55 50.69 2bt4 s ASP 2252Cb 0.00 -0.99 -0.03 0.00 -1.46 0.00 0.00 42.92 40.44 2bt4 s ASP 2252CO 0.09 -0.36 0.05 0.12 0.52 0.00 0.00 175.17 175.58 2bt4 s PHE 2253N 1.51 3.12 0.03 -5.34 5.36 -1.26 -0.78 117.98 120.62 2bt4 s PHE 2253Ca 0.06 -0.26 -0.01 0.00 -0.96 0.00 0.00 56.93 55.77 2bt4 s PHE 2253Cb -0.18 -2.14 -0.03 0.00 -0.34 0.00 0.00 43.02 40.34 2bt4 s PHE 2253CO -0.17 -0.15 -0.03 1.03 -1.46 0.00 0.00 175.22 174.45 2bt4 s ARG 2254N 1.00 0.43 0.01 10.12 0.52 -0.15 -4.97 118.95 125.92 2bt4 s ARG 2254Ca 0.03 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.40 2bt4 s ARG 2254Cb -0.14 0.15 -0.01 0.00 0.52 0.00 0.00 34.95 35.47 2bt4 s ARG 2254CO 0.03 -0.08 -0.02 -1.14 0.02 0.00 0.00 175.30 174.11 2bt4 s GLN 2255N -2.44 0.20 -0.05 3.54 -0.44 -1.26 -1.37 119.66 117.84 2bt4 s GLN 2255Ca -0.07 -0.30 -0.19 0.00 -2.50 0.00 0.00 55.36 52.30 2bt4 s GLN 2255Cb -0.03 -0.03 0.04 0.00 -1.64 0.00 0.00 33.01 31.35 2bt4 s GLN 2255CO -0.05 -0.00 0.44 0.45 0.50 0.00 0.00 175.29 176.63 2bt4 s SER 2256N -0.66 -0.37 0.00 6.67 0.15 -0.50 -4.97 113.70 114.02 2bt4 s SER 2256Ca -0.06 0.41 0.27 0.00 0.70 0.00 0.00 55.95 57.27 2bt4 s SER 2256Cb -0.05 0.49 0.88 0.00 -1.71 0.00 0.00 66.02 65.63 2bt4 s SER 2256CO -0.00 -0.44 1.64 0.59 1.20 0.00 0.00 173.24 176.23 2bt4 n ASN 2257N 1.48 1.41 -4.47 5.45 3.02 -1.26 -2.48 115.26 118.41 2bt4 n ASN 2257Ca -0.19 -1.30 -0.36 0.00 -0.03 0.00 0.00 54.58 52.69 2bt4 n ASN 2257Cb 0.56 0.06 -0.12 0.00 -0.61 0.00 0.00 39.78 39.67 2bt4 n ASN 2257CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2bt4 s HIS 2258N -2.19 3.10 0.18 3.10 3.76 -1.26 -4.71 115.29 117.27 2bt4 s HIS 2258Ca 0.32 -0.36 -0.13 0.00 -0.15 0.00 0.00 55.06 54.74 2bt4 s HIS 2258Cb 0.20 -2.22 0.08 0.00 1.11 0.00 0.00 32.58 31.75 2bt4 s HIS 2258CO 0.41 -0.30 1.82 1.49 -0.85 0.00 0.00 174.74 177.31 2bt4 h GLU 2259N 8.07 0.76 -0.11 1.40 4.81 -2.00 -2.06 114.58 125.45 2bt4 h GLU 2259Ca -0.38 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 58.71 2bt4 h GLU 2259Cb 1.18 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 2bt4 h GLU 2259CO 0.59 0.54 -0.28 0.78 -0.73 0.00 0.00 179.01 179.90 2bt4 h GLY 2260N 0.77 0.22 0.99 1.92 0.00 -1.99 -1.43 103.07 103.55 2bt4 h GLY 2260Ca 0.21 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.31 2bt4 h GLY 2260CO -0.04 0.16 0.14 -2.09 0.00 0.00 0.00 176.54 174.70 2bt4 h GLU 2261N 0.18 0.87 -0.33 4.80 4.81 -1.86 -1.01 114.58 122.04 2bt4 h GLU 2261Ca 0.03 -0.21 0.02 0.00 -0.13 0.00 0.00 59.36 59.07 2bt4 h GLU 2261Cb 0.60 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2bt4 h GLU 2261CO 0.04 0.81 0.18 -0.07 -0.73 0.00 0.00 179.01 179.25 2bt4 h LEU 2262N 0.77 0.29 -0.30 1.64 3.38 -0.86 -0.03 115.31 120.20 2bt4 h LEU 2262Ca 0.17 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.21 2bt4 h LEU 2262Cb 0.33 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 2bt4 h LEU 2262CO 0.00 0.21 -0.14 0.58 0.09 0.00 0.00 178.44 179.18 2bt4 h VAL 2263N 0.38 0.56 -0.90 1.22 2.07 -1.07 -1.32 116.25 117.19 2bt4 h VAL 2263Ca 0.13 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.72 2bt4 h VAL 2263Cb 0.01 0.56 -0.07 0.00 -1.52 0.00 0.00 31.29 30.27 2bt4 h VAL 2263CO -0.07 0.00 0.56 0.44 0.02 0.00 0.00 177.57 178.52 2bt4 h ASP 2264N -0.10 0.87 0.45 0.57 3.32 -0.65 -1.76 116.42 119.13 2bt4 h ASP 2264Ca 0.16 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.11 2bt4 h ASP 2264Cb 0.33 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2bt4 h ASP 2264CO -0.36 0.54 -0.54 -0.50 -1.72 0.00 0.00 179.24 176.66 2bt4 h TRP 2265N 1.00 0.12 -0.45 4.55 6.55 -0.56 -2.27 115.95 124.88 2bt4 h TRP 2265Ca 0.40 -0.04 -0.10 0.00 0.95 0.00 0.00 58.89 60.09 2bt4 h TRP 2265Cb 0.21 -0.02 -0.01 0.00 -0.86 0.00 0.00 29.16 28.48 2bt4 h TRP 2265CO -0.03 0.61 -0.12 0.82 -1.05 0.00 0.00 178.44 178.67 2bt4 h ILE 2266N 0.08 1.27 -0.62 1.49 2.04 -0.60 -1.18 117.51 119.99 2bt4 h ILE 2266Ca -0.00 -1.25 0.04 0.00 1.00 0.00 0.00 64.86 64.64 2bt4 h ILE 2266Cb 0.97 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 2bt4 h ILE 2266CO 0.07 0.43 0.41 0.45 0.00 0.00 0.00 178.15 179.51 2bt4 h HIS 2267N 0.72 0.70 -0.34 1.37 3.86 -1.07 0.60 115.15 120.99 2bt4 h HIS 2267Ca 0.11 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.24 2bt4 h HIS 2267Cb 0.67 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2bt4 h HIS 2267CO 0.05 0.41 -0.18 1.49 0.86 0.00 0.00 177.93 180.56 2bt4 h GLU 2268N 0.72 0.72 -0.92 2.45 4.81 -1.20 -3.03 114.58 118.13 2bt4 h GLU 2268Ca 0.25 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2bt4 h GLU 2268Cb 0.10 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 2bt4 h GLU 2268CO -0.07 0.93 0.56 0.00 -0.73 0.00 0.00 179.01 179.70 2bt4 h ALA 2269N 0.77 1.26 -0.89 2.92 0.00 -0.68 -0.60 119.26 122.04 2bt4 h ALA 2269Ca 0.07 -0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.05 2bt4 h ALA 2269Cb 0.72 -0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 2bt4 h ALA 2269CO 0.05 0.64 0.58 -0.09 0.00 0.00 0.00 179.25 180.43 2bt4 h ARG 2270N 1.27 0.57 0.00 0.00 2.43 -0.78 -1.55 114.38 116.32 2bt4 h ARG 2270Ca 0.33 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.32 2bt4 h ARG 2270Cb -0.07 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 2bt4 h ARG 2270CO -0.06 0.38 -1.98 1.28 -1.51 0.00 0.00 179.97 178.07 2bt4 n LEU 2271N -4.56 0.19 0.00 3.80 4.77 -0.85 -4.74 117.00 115.62 2bt4 n LEU 2271Ca 0.18 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2bt4 n LEU 2271Cb 0.55 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2bt4 n LEU 2271CO 0.29 0.18 0.06 0.59 -1.33 0.00 0.00 177.39 177.19 2bt4 n ASN 2272N -2.55 0.26 -4.41 -1.43 3.02 -0.29 -5.08 115.26 104.77 2bt4 n ASN 2272Ca -0.14 -0.60 -0.21 0.00 -0.03 0.00 0.00 54.58 53.60 2bt4 n ASN 2272Cb 0.81 0.62 -0.10 0.00 -0.61 0.00 0.00 39.78 40.49 2bt4 n ASN 2272CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2bt4 s HIS 2273N -0.62 1.93 -1.89 3.10 3.76 -0.63 -4.53 115.29 116.42 2bt4 s HIS 2273Ca 0.00 -0.62 0.26 0.00 -0.15 0.00 0.00 55.06 54.55 2bt4 s HIS 2273Cb 0.00 -1.02 0.73 0.00 1.11 0.00 0.00 32.58 33.40 2bt4 s HIS 2273CO 0.00 0.36 1.55 0.00 -0.85 0.00 0.00 174.74 175.80 2bt4 n GLY 2275N 1.32 1.12 3.02 0.00 0.00 -1.26 -4.41 105.19 104.98 2bt4 n GLY 2275Ca 0.13 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 45.00 2bt4 n GLY 2275CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bt4 s ILE 2276N -2.00 1.19 -0.21 -0.61 1.01 -0.34 -1.27 121.20 118.98 2bt4 s ILE 2276Ca 0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 60.65 60.11 2bt4 s ILE 2276Cb 0.00 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.35 2bt4 s ILE 2276CO 0.00 0.37 -0.01 -0.69 0.00 0.00 0.00 174.94 174.61 2bt4 s VAL 2277N 0.83 3.83 -0.07 2.92 1.01 0.17 -1.32 120.40 127.76 2bt4 s VAL 2277Ca -0.11 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2bt4 s VAL 2277Cb -0.15 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.51 2bt4 s VAL 2277CO 0.02 0.42 -0.09 -0.51 0.00 0.00 0.00 175.10 174.94 2bt4 s ILE 2278N 1.13 0.94 -0.53 2.22 2.07 -0.35 -0.46 121.20 126.20 2bt4 s ILE 2278Ca 0.02 -0.32 -0.08 0.00 -1.41 0.00 0.00 60.65 58.87 2bt4 s ILE 2278Cb -0.14 -0.91 0.14 0.00 0.13 0.00 0.00 42.46 41.67 2bt4 s ILE 2278CO 0.01 0.33 0.39 0.21 -1.91 0.00 0.00 174.94 173.97 2bt4 s ASN 2279N 1.05 5.67 0.00 4.50 3.84 -0.30 -0.79 114.94 128.91 2bt4 s ASN 2279Ca -0.08 -2.20 0.26 0.00 0.21 0.00 0.00 52.86 51.05 2bt4 s ASN 2279Cb -0.14 -1.98 1.26 0.00 -0.55 0.00 0.00 41.25 39.84 2bt4 s ASN 2279CO -0.01 -0.60 1.86 -2.65 -2.79 0.00 0.00 177.10 172.92 2bt4 n PRO 2280N 4.48 0.30 0.00 0.43 -0.02 -1.26 -0.85 135.00 138.09 2bt4 n PRO 2280Ca -0.02 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2bt4 n PRO 2280Cb 0.41 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 2bt4 n PRO 2280CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bt4 n ALA 2281N -1.32 0.00 0.18 3.55 0.00 -1.26 -1.69 120.51 119.96 2bt4 n ALA 2281Ca 0.11 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.71 2bt4 n ALA 2281Cb 0.22 0.00 0.78 0.00 0.00 0.00 0.00 19.45 20.45 2bt4 n ALA 2281CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bt4 h ALA 2282N -0.57 1.96 0.00 0.00 0.00 -1.94 0.18 119.26 118.89 2bt4 h ALA 2282Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bt4 h ALA 2282Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2bt4 h ALA 2282CO 0.00 -0.31 0.00 0.66 0.00 0.00 0.00 179.25 179.60 2bt4 n TYR 2283N -4.02 0.74 -0.26 0.00 0.53 -0.68 -1.88 117.16 111.58 2bt4 n TYR 2283Ca 0.02 0.27 0.05 0.00 -1.02 0.00 0.00 57.90 57.23 2bt4 n TYR 2283Cb 0.34 -0.94 0.19 0.00 -1.03 0.00 0.00 39.34 37.89 2bt4 n TYR 2283CO 0.00 0.00 0.00 0.77 -1.02 0.00 0.00 176.86 176.61 2bt4 h SER 2284N 0.00 0.33 1.23 7.72 0.02 -0.65 -1.42 113.55 120.77 2bt4 h SER 2284Ca 0.00 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 2bt4 h SER 2284Cb 0.43 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 2bt4 h SER 2284CO 0.00 0.13 -0.80 0.45 -1.14 0.00 0.00 176.83 175.47 2bt4 h HIS 2285N 0.48 0.00 0.00 3.45 3.86 -1.54 -1.14 115.15 120.26 2bt4 h HIS 2285Ca 0.42 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.62 2bt4 h HIS 2285Cb 0.61 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.08 2bt4 h HIS 2285CO -0.15 0.19 -1.21 0.25 0.86 0.00 0.00 177.93 177.87 2bt4 n THR 2286N -2.89 0.04 -3.19 2.45 -2.24 -1.13 -4.77 114.28 102.54 2bt4 n THR 2286Ca -0.01 -0.11 -0.45 0.00 -2.27 0.00 0.00 64.05 61.22 2bt4 n THR 2286Cb 0.63 0.22 -0.05 0.00 -2.10 0.00 0.00 70.33 69.03 2bt4 n THR 2286CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2bt4 s SER 2287N -2.64 6.19 0.40 3.42 0.15 -0.55 -4.84 113.70 115.83 2bt4 s SER 2287Ca -0.02 -1.35 0.19 0.00 0.70 0.00 0.00 55.95 55.48 2bt4 s SER 2287Cb 0.03 -2.27 0.84 0.00 -1.71 0.00 0.00 66.02 62.91 2bt4 s SER 2287CO 0.18 -0.95 1.82 0.58 1.20 0.00 0.00 173.24 176.07 2bt4 h VAL 2288N 5.88 0.92 -0.53 4.45 2.07 -1.95 -3.02 116.25 124.07 2bt4 h VAL 2288Ca -0.29 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 65.91 2bt4 h VAL 2288Cb 1.09 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.60 2bt4 h VAL 2288CO 1.03 0.32 0.16 0.00 0.02 0.00 0.00 177.57 179.09 2bt4 h ALA 2289N 1.67 0.69 -0.46 1.67 0.00 -1.97 0.10 119.26 120.96 2bt4 h ALA 2289Ca -0.00 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 2bt4 h ALA 2289Cb 0.73 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bt4 h ALA 2289CO 0.04 0.36 -0.23 0.82 0.00 0.00 0.00 179.25 180.24 2bt4 h ILE 2290N 0.73 1.27 -0.26 0.00 2.04 -1.91 -0.79 117.51 118.60 2bt4 h ILE 2290Ca 0.17 -1.40 0.05 0.00 1.00 0.00 0.00 64.86 64.68 2bt4 h ILE 2290Cb 0.29 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 2bt4 h ILE 2290CO -0.00 0.48 -0.06 0.25 0.00 0.00 0.00 178.15 178.82 2bt4 h LEU 2291N 0.82 -0.23 -1.06 1.44 5.85 -1.35 -1.01 115.31 119.78 2bt4 h LEU 2291Ca 0.10 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 2bt4 h LEU 2291Cb 0.82 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2bt4 h LEU 2291CO 0.07 -0.08 0.12 0.44 -0.34 0.00 0.00 178.44 178.65 2bt4 h ASP 2292N 0.01 0.74 -0.36 1.25 3.32 -0.51 -1.07 116.42 119.80 2bt4 h ASP 2292Ca 0.12 -0.13 0.02 0.00 0.02 0.00 0.00 57.03 57.06 2bt4 h ASP 2292Cb 0.19 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2bt4 h ASP 2292CO -0.26 0.73 0.20 0.00 -1.72 0.00 0.00 179.24 178.20 2bt4 h ALA 2293N 1.36 0.45 -0.41 3.45 0.00 -0.80 -2.30 119.26 121.01 2bt4 h ALA 2293Ca 0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2bt4 h ALA 2293Cb 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2bt4 h ALA 2293CO -0.00 -0.15 0.05 -0.07 0.00 0.00 0.00 179.25 179.07 2bt4 h LEU 2294N 0.41 0.59 -2.01 0.00 3.38 -0.93 -2.30 115.31 114.44 2bt4 h LEU 2294Ca 0.14 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2bt4 h LEU 2294Cb 0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2bt4 h LEU 2294CO -0.08 0.63 -0.04 0.78 0.09 0.00 0.00 178.44 179.82 2bt4 h ASN 2295N 0.61 0.00 0.75 -0.43 2.35 -0.65 -1.05 115.58 117.15 2bt4 h ASN 2295Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2bt4 h ASN 2295Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2bt4 h ASN 2295CO 0.01 0.04 0.00 0.35 -1.65 0.00 0.00 177.43 176.18 2bt4 n THR 2296N -4.32 0.63 -1.72 2.81 -2.24 -0.87 -4.19 114.28 104.38 2bt4 n THR 2296Ca -0.03 0.13 -0.38 0.00 -2.27 0.00 0.00 64.05 61.50 2bt4 n THR 2296Cb 0.13 -0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 67.51 2bt4 n THR 2296CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bt4 n ASP 2298N 2.33 3.26 0.00 0.00 8.00 -1.26 -1.06 116.55 127.82 2bt4 n ASP 2298Ca 0.67 1.08 0.00 0.00 0.71 0.00 0.00 54.79 57.25 2bt4 n ASP 2298Cb 0.27 -1.46 0.00 0.00 -0.02 0.00 0.00 41.12 39.91 2bt4 n ASP 2298CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bt4 n GLY 2299N 3.47 1.98 3.78 0.44 0.00 -1.26 -5.00 105.19 108.60 2bt4 n GLY 2299Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2bt4 n GLY 2299CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bt4 s LEU 2300N 0.00 4.37 0.16 0.99 2.96 -0.23 -5.03 118.68 121.90 2bt4 s LEU 2300Ca 0.00 0.85 -0.31 0.00 -0.22 0.00 0.00 54.13 54.46 2bt4 s LEU 2300Cb 0.00 -2.61 -0.08 0.00 0.50 0.00 0.00 46.19 43.99 2bt4 s LEU 2300CO 0.00 0.16 1.36 -2.16 -1.32 0.00 0.00 176.35 174.39 2bt4 s PRO 2301N -0.19 4.34 -0.07 0.98 0.04 -1.26 -4.94 135.00 133.90 2bt4 s PRO 2301Ca 0.24 2.08 0.02 0.00 0.04 0.00 0.00 61.00 63.38 2bt4 s PRO 2301Cb -0.16 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 31.19 2bt4 s PRO 2301CO 0.11 -0.36 -0.09 0.08 0.04 0.00 0.00 177.00 176.78 2bt4 s VAL 2302N 0.61 0.95 -0.11 -0.36 1.01 -1.26 -1.19 120.40 120.04 2bt4 s VAL 2302Ca 0.61 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 62.26 2bt4 s VAL 2302Cb -0.37 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.12 2bt4 s VAL 2302CO 0.34 0.32 -0.17 -0.69 0.00 0.00 0.00 175.10 174.91 2bt4 s VAL 2303N 0.88 1.63 0.09 2.92 1.01 -0.44 -0.43 120.40 126.07 2bt4 s VAL 2303Ca -0.11 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2bt4 s VAL 2303Cb -0.15 -1.47 -0.07 0.00 0.00 0.00 0.00 36.38 34.69 2bt4 s VAL 2303CO 0.01 0.47 0.61 -0.70 0.00 0.00 0.00 175.10 175.49 2bt4 s GLU 2304N 0.91 4.28 -0.06 2.72 2.12 -0.43 -1.22 118.70 127.03 2bt4 s GLU 2304Ca -0.08 0.83 0.03 0.00 0.36 0.00 0.00 54.97 56.11 2bt4 s GLU 2304Cb -0.15 -3.25 0.01 0.00 0.26 0.00 0.00 34.13 31.00 2bt4 s GLU 2304CO -0.01 0.62 -0.14 0.08 -0.54 0.00 0.00 175.26 175.27 2bt4 s VAL 2305N -1.10 1.22 -0.09 3.70 1.01 0.03 -0.46 120.40 124.71 2bt4 s VAL 2305Ca 0.30 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.76 2bt4 s VAL 2305Cb -0.20 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.10 2bt4 s VAL 2305CO 0.21 0.37 -0.20 -1.00 0.00 0.00 0.00 175.10 174.47 2bt4 s HIS 2306N 0.41 2.18 0.04 5.22 3.76 0.83 -4.07 115.29 123.65 2bt4 s HIS 2306Ca -0.10 -0.85 -0.24 0.00 -0.15 0.00 0.00 55.06 53.71 2bt4 s HIS 2306Cb -0.14 -1.48 -0.17 0.00 1.11 0.00 0.00 32.58 31.90 2bt4 s HIS 2306CO 0.03 -0.36 1.52 0.82 -0.85 0.00 0.00 174.74 175.90 2bt4 h ILE 2307N 5.74 1.19 -3.98 0.60 2.04 -1.85 -1.33 117.51 119.92 2bt4 h ILE 2307Ca -0.24 -0.55 -0.49 0.00 1.00 0.00 0.00 64.86 64.58 2bt4 h ILE 2307Cb 1.22 1.55 0.03 0.00 -0.74 0.00 0.00 36.82 38.88 2bt4 h ILE 2307CO 0.47 0.15 0.27 -0.94 0.00 0.00 0.00 178.15 178.09 2bt4 s SER 2308N -5.44 6.41 -0.93 1.72 1.04 -1.26 -2.36 113.70 112.87 2bt4 s SER 2308Ca -0.14 1.28 -0.23 0.00 0.48 0.00 0.00 55.95 57.34 2bt4 s SER 2308Cb 0.04 -2.40 0.07 0.00 0.10 0.00 0.00 66.02 63.83 2bt4 s SER 2308CO 0.67 -0.62 1.31 0.21 0.98 0.00 0.00 173.24 175.80 2bt4 s ASN 2309N -3.62 6.46 0.63 7.02 3.84 -1.26 -1.92 114.94 126.08 2bt4 s ASN 2309Ca 0.53 -1.42 0.30 0.00 0.21 0.00 0.00 52.86 52.49 2bt4 s ASN 2309Cb -0.10 -2.52 1.65 0.00 -0.55 0.00 0.00 41.25 39.73 2bt4 s ASN 2309CO 0.41 -1.44 1.99 0.16 -2.79 0.00 0.00 177.10 175.42 2bt4 h ILE 2310N 6.41 0.22 0.00 -5.21 3.07 -1.92 -0.65 117.51 119.43 2bt4 h ILE 2310Ca 0.09 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.50 2bt4 h ILE 2310Cb 1.02 0.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.29 2bt4 h ILE 2310CO 1.31 0.00 0.00 0.45 -1.05 0.00 0.00 178.15 178.86 2bt4 h HIS 2311N 0.00 0.00 -0.34 0.16 3.86 -1.89 -2.41 115.15 114.53 2bt4 h HIS 2311Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 2bt4 h HIS 2311Cb 0.72 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.19 2bt4 h HIS 2311CO 0.00 0.00 0.00 1.04 0.86 0.00 0.00 177.93 179.83 2bt4 n GLN 2312N -2.61 2.45 0.00 2.45 6.02 -0.25 -4.97 117.38 120.47 2bt4 n GLN 2312Ca 0.01 -2.18 0.00 0.00 -0.01 0.00 0.00 57.00 54.82 2bt4 n GLN 2312Cb 0.26 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.02 2bt4 n GLN 2312CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2bt4 n ARG 2313N 1.41 3.44 -1.83 -1.09 1.74 -0.91 -5.07 116.66 114.35 2bt4 n ARG 2313Ca 0.19 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.88 2bt4 n ARG 2313Cb 0.59 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.07 2bt4 n ARG 2313CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2bt4 s GLU 2314N 2.17 3.22 0.36 5.56 8.01 -1.26 -4.88 118.70 131.88 2bt4 s GLU 2314Ca 0.00 2.20 0.13 0.00 0.01 0.00 0.00 54.97 57.31 2bt4 s GLU 2314Cb 0.00 -2.29 0.97 0.00 -4.31 0.00 0.00 34.13 28.50 2bt4 s GLU 2314CO 0.00 -1.11 1.76 -1.35 0.01 0.00 0.00 175.26 174.57 2bt4 h PRO 2315N 1.55 0.51 0.00 0.39 0.11 -1.96 -0.13 132.00 132.47 2bt4 h PRO 2315Ca -0.51 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 2bt4 h PRO 2315Cb 1.29 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2bt4 h PRO 2315CO 0.58 0.34 -0.11 0.27 -0.21 0.00 0.00 178.00 178.86 2bt4 h PHE 2316N 0.52 0.00 0.00 0.65 -5.15 -1.97 -1.83 116.94 109.17 2bt4 h PHE 2316Ca 0.60 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.37 2bt4 h PHE 2316Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.46 2bt4 h PHE 2316CO -0.00 0.11 0.00 0.54 -2.00 0.00 0.00 178.31 176.96 2bt4 n ARG 2317N -3.66 0.10 0.23 6.09 1.74 -0.06 -3.80 116.66 117.29 2bt4 n ARG 2317Ca -0.02 0.18 0.11 0.00 -0.77 0.00 0.00 57.85 57.35 2bt4 n ARG 2317Cb 0.23 -1.64 0.46 0.00 -1.02 0.00 0.00 32.46 30.49 2bt4 n ARG 2317CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bt4 h HIS 2318N 0.00 0.00 -3.15 -1.55 3.86 -1.39 -3.44 115.15 109.48 2bt4 h HIS 2318Ca 0.00 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.55 2bt4 h HIS 2318Cb 0.48 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 28.84 2bt4 h HIS 2318CO 0.00 0.18 -0.59 -1.58 0.86 0.00 0.00 177.93 176.80 2bt4 s HIS 2319N -3.58 3.25 -0.07 2.45 5.65 -1.25 -4.87 115.29 116.87 2bt4 s HIS 2319Ca 0.01 0.21 0.00 0.00 0.25 0.00 0.00 55.06 55.53 2bt4 s HIS 2319Cb 0.09 -1.75 0.02 0.00 -1.18 0.00 0.00 32.58 29.77 2bt4 s HIS 2319CO 0.63 0.53 -0.04 0.45 -0.65 0.00 0.00 174.74 175.66 2bt4 s SER 2320N -1.50 1.42 0.46 9.88 0.15 -1.26 -4.20 113.70 118.64 2bt4 s SER 2320Ca 0.20 -0.15 0.17 0.00 0.70 0.00 0.00 55.95 56.87 2bt4 s SER 2320Cb -0.12 -0.53 1.08 0.00 -1.71 0.00 0.00 66.02 64.73 2bt4 s SER 2320CO 0.10 -0.11 1.99 1.88 1.20 0.00 0.00 173.24 178.31 2bt4 h TYR 2321N 7.72 0.00 -0.06 3.44 -1.99 -1.50 -3.00 116.97 121.58 2bt4 h TYR 2321Ca -0.30 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.30 2bt4 h TYR 2321Cb 1.14 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.86 2bt4 h TYR 2321CO 0.49 0.19 -0.55 0.28 -0.00 0.00 0.00 178.16 178.57 2bt4 h VAL 2322N 0.00 1.37 0.00 -2.88 2.07 -1.87 -2.23 116.25 112.71 2bt4 h VAL 2322Ca -0.00 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.66 2bt4 h VAL 2322Cb 0.37 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2bt4 h VAL 2322CO 0.03 0.54 0.00 0.28 0.02 0.00 0.00 177.57 178.44 2bt4 h SER 2323N 0.13 0.00 1.08 0.57 0.02 -1.88 -0.85 113.55 112.62 2bt4 h SER 2323Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2bt4 h SER 2323Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2bt4 h SER 2323CO 0.08 0.00 0.00 1.56 -1.14 0.00 0.00 176.83 177.33 2bt4 h GLN 2324N 0.00 0.00 0.00 3.45 4.20 -1.55 -3.33 115.11 117.88 2bt4 h GLN 2324Ca 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 2bt4 h GLN 2324Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2bt4 h GLN 2324CO 0.00 0.00 -1.25 -2.13 -0.67 0.00 0.00 178.83 174.78 2bt4 n ARG 2325N -2.73 1.71 -1.69 1.46 3.00 -0.57 -5.03 116.66 112.82 2bt4 n ARG 2325Ca 0.02 0.01 -0.44 0.00 -0.00 0.00 0.00 57.85 57.45 2bt4 n ARG 2325Cb 0.32 -1.09 -0.02 0.00 0.00 0.00 0.00 32.46 31.67 2bt4 n ARG 2325CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2bt4 n ALA 2326N -2.39 1.41 0.01 5.13 0.00 -0.43 -4.86 120.51 119.36 2bt4 n ALA 2326Ca -0.07 0.39 -0.12 0.00 0.00 0.00 0.00 53.44 53.63 2bt4 n ALA 2326Cb 0.60 -2.30 -0.08 0.00 0.00 0.00 0.00 19.45 17.67 2bt4 n ALA 2326CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2bt4 h ASP 2327N 3.74 0.02 -3.75 0.00 3.32 -1.09 -3.44 116.42 115.22 2bt4 h ASP 2327Ca -0.46 -0.27 -0.48 0.00 0.02 0.00 0.00 57.03 55.85 2bt4 h ASP 2327Cb 1.27 -0.01 -0.18 0.00 0.22 0.00 0.00 39.33 40.63 2bt4 h ASP 2327CO 0.72 0.28 -0.77 -0.83 -1.72 0.00 0.00 179.24 176.92 2bt4 s GLY 2328N -2.75 1.28 -0.05 2.75 0.00 -1.16 -5.06 107.32 102.33 2bt4 s GLY 2328Ca -0.15 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.16 2bt4 s GLY 2328CO 0.67 -1.47 -0.02 0.14 0.00 0.00 0.00 173.10 172.42 2bt4 s VAL 2329N -2.08 0.41 -0.15 1.40 1.01 -1.26 -1.31 120.40 118.42 2bt4 s VAL 2329Ca 0.13 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.14 2bt4 s VAL 2329Cb -0.05 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.85 2bt4 s VAL 2329CO 0.05 0.22 -0.20 -0.69 0.00 0.00 0.00 175.10 174.48 2bt4 s VAL 2330N 1.32 1.97 -0.03 2.92 1.01 0.40 -4.99 120.40 123.00 2bt4 s VAL 2330Ca -0.05 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2bt4 s VAL 2330Cb -0.13 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.49 2bt4 s VAL 2330CO -0.02 0.53 -0.07 0.00 0.00 0.00 0.00 175.10 175.54 2bt4 s ALA 2331N 1.05 0.73 0.00 5.51 0.00 -1.26 -0.12 121.76 127.66 2bt4 s ALA 2331Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.74 2bt4 s ALA 2331Cb -0.14 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.65 2bt4 s ALA 2331CO -0.06 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.19 2bt4 n GLY 2332N 3.53 0.44 1.83 0.00 0.00 -0.50 -4.71 105.19 105.78 2bt4 n GLY 2332Ca -0.20 -0.75 0.07 0.00 0.00 0.00 0.00 46.02 45.13 2bt4 n GLY 2332CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt4 n GLY 2334N 0.68 -0.09 0.20 0.00 0.00 -0.99 -2.74 105.19 102.24 2bt4 n GLY 2334Ca 0.27 -0.93 0.14 0.00 0.00 0.00 0.00 46.02 45.50 2bt4 n GLY 2334CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2bt4 h VAL 2335N 0.00 0.00 -0.00 1.61 -1.51 -1.86 -0.98 116.25 113.51 2bt4 h VAL 2335Ca 0.00 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.30 2bt4 h VAL 2335Cb 0.00 0.91 -0.00 0.00 -2.13 0.00 0.00 31.29 30.07 2bt4 h VAL 2335CO 0.00 0.00 0.01 -0.61 -1.23 0.00 0.00 177.57 175.74 2bt4 h GLN 2336N 0.00 0.00 -0.28 5.19 4.15 -1.94 -2.04 115.11 120.20 2bt4 h GLN 2336Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 2bt4 h GLN 2336Cb 0.22 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2bt4 h GLN 2336CO 0.00 0.00 0.11 0.78 -1.93 0.00 0.00 178.83 177.79 2bt4 h GLY 2337N 0.00 0.41 1.51 2.39 0.00 -1.05 -1.06 103.07 105.26 2bt4 h GLY 2337Ca 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 2bt4 h GLY 2337CO -0.00 0.17 0.13 -0.97 0.00 0.00 0.00 176.54 175.88 2bt4 h TYR 2338N 0.39 0.64 -0.51 5.60 -1.99 -1.57 -0.36 116.97 119.16 2bt4 h TYR 2338Ca 0.10 -0.04 -0.05 0.00 2.00 0.00 0.00 58.73 60.74 2bt4 h TYR 2338Cb 0.08 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 38.59 2bt4 h TYR 2338CO 0.00 0.53 0.11 0.28 -0.00 0.00 0.00 178.16 179.08 2bt4 h VAL 2339N 0.62 1.24 -0.82 -2.88 2.07 -1.33 -1.63 116.25 113.53 2bt4 h VAL 2339Ca 0.15 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2bt4 h VAL 2339Cb 0.19 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2bt4 h VAL 2339CO -0.01 0.32 0.43 -0.26 0.02 0.00 0.00 177.57 178.07 2bt4 h PHE 2340N 0.71 1.15 -0.41 1.57 0.05 -0.98 0.15 116.94 119.18 2bt4 h PHE 2340Ca 0.16 -0.04 0.07 0.00 3.82 0.00 0.00 57.97 61.98 2bt4 h PHE 2340Cb 0.36 -0.36 -0.06 0.00 2.00 0.00 0.00 35.95 37.89 2bt4 h PHE 2340CO 0.02 0.82 0.07 0.78 -0.18 0.00 0.00 178.31 179.82 2bt4 h GLY 2341N 1.16 0.48 0.96 -1.45 0.00 -0.67 0.66 103.07 104.20 2bt4 h GLY 2341Ca 0.29 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.56 2bt4 h GLY 2341CO -0.04 -0.05 0.11 -2.08 0.00 0.00 0.00 176.54 174.48 2bt4 h VAL 2342N 0.20 1.23 -0.89 4.60 2.07 -0.66 -1.54 116.25 121.26 2bt4 h VAL 2342Ca 0.20 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2bt4 h VAL 2342Cb 0.25 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2bt4 h VAL 2342CO -0.27 0.29 0.56 -0.33 0.02 0.00 0.00 177.57 177.84 2bt4 h GLU 2343N 0.60 1.19 -0.29 1.57 5.08 -0.08 0.44 114.58 123.10 2bt4 h GLU 2343Ca 0.14 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 2bt4 h GLU 2343Cb 0.32 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2bt4 h GLU 2343CO 0.00 0.82 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.51 2bt4 h ARG 2344N 1.22 0.68 -0.63 2.33 9.65 -0.53 -1.93 114.38 125.17 2bt4 h ARG 2344Ca 0.32 -0.34 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2bt4 h ARG 2344Cb -0.09 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 2bt4 h ARG 2344CO -0.06 0.94 0.39 0.82 2.80 0.00 0.00 179.97 184.85 2bt4 h ILE 2345N 0.42 1.18 -0.72 1.20 1.08 -0.97 0.36 117.51 120.06 2bt4 h ILE 2345Ca 0.05 -0.39 0.04 0.00 -0.39 0.00 0.00 64.86 64.17 2bt4 h ILE 2345Cb 0.79 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.80 2bt4 h ILE 2345CO 0.06 0.18 0.48 0.00 -0.69 0.00 0.00 178.15 178.18 2bt4 h ALA 2346N 1.20 1.59 -0.15 1.87 0.00 -0.77 0.33 119.26 123.33 2bt4 h ALA 2346Ca 0.23 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 2bt4 h ALA 2346Cb -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2bt4 h ALA 2346CO -0.04 0.33 -0.69 0.00 0.00 0.00 0.00 179.25 178.85 2bt4 h ALA 2347N 1.58 0.50 0.15 0.00 0.00 -0.53 -3.24 119.26 117.71 2bt4 h ALA 2347Ca 0.29 -0.58 -0.29 0.00 0.00 0.00 0.00 54.91 54.33 2bt4 h ALA 2347Cb 0.07 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2bt4 h ALA 2347CO -0.08 0.71 -1.35 -0.07 0.00 0.00 0.00 179.25 178.46 2bt4 h LEU 2348N 0.45 0.49 -4.07 0.00 3.38 -0.24 -3.20 115.31 112.12 2bt4 h LEU 2348Ca -0.03 -0.55 -0.41 0.00 0.09 0.00 0.00 57.88 56.99 2bt4 h LEU 2348Cb 1.28 -0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.72 2bt4 h LEU 2348CO 0.13 1.44 0.34 0.00 0.09 0.00 0.00 178.44 180.44 2bt4 n ALA 2349N -2.59 5.92 -1.07 1.53 0.00 0.11 -5.03 120.51 119.37 2bt4 n ALA 2349Ca -0.12 -2.40 0.00 0.00 0.00 0.00 0.00 53.44 50.92 2bt4 n ALA 2349Cb 1.04 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2bt4 n ALA 2349CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91