NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 203 K 4.3623 8.1733 120.1374 56.5082 34.6132 177.6517 204 R 3.7595 8.0441 117.7434 58.7609 29.8968 177.0752 205 A 4.0133 8.2302 120.4384 55.5294 18.8024 178.7960 206 H 4.1791 8.1532 116.0821 59.5902 30.1328 176.6100 207 H 4.1272 8.5053 120.3712 59.5569 29.6419 176.8670 208 N 4.2439 8.7125 118.2652 56.2551 38.3238 177.3041 209 A 3.9943 7.7816 121.7001 55.1251 18.3912 179.7500 210 L 3.9387 7.9841 117.5967 57.7243 41.6420 179.3295 211 E 3.8692 8.2006 119.4874 59.0890 29.5768 178.7408 212 R 3.8817 7.9629 118.8747 59.3923 30.1058 178.6981 213 K 3.9003 7.9166 118.3052 59.2917 31.9414 179.3129 214 R 3.7959 8.0827 119.2336 59.5381 29.9562 178.8493 215 R 3.9737 8.4038 118.2827 59.2813 29.9652 178.7614 216 D 4.3553 8.1839 118.7673 57.7268 40.8177 178.5816 217 H 4.3011 8.1269 116.7185 58.9244 28.6859 177.9901 218 I 3.7763 7.7048 121.4340 64.1256 36.9363 178.3701 219 K 4.0522 8.3735 120.7002 59.6901 31.9826 178.5711 220 D 4.3831 8.3322 119.2379 57.6131 40.7700 179.0550 221 S 4.1288 8.1610 115.5163 61.2902 62.6581 176.8412 222 F 4.0360 8.2035 120.8729 60.7569 38.8291 177.3513 223 H 4.3182 8.4152 115.8940 59.2443 28.2898 178.0979 224 S 4.2138 8.1881 116.0233 61.3454 63.0394 176.1812 225 L 4.1101 7.8746 122.8318 57.9846 41.8751 178.8783 226 R 3.9527 8.3141 118.9160 59.4757 29.8669 177.5700 227 D 4.6641 7.8548 115.1666 55.3834 41.1576 177.5543 228 S 4.7435 7.6597 114.6756 57.4375 63.5695 173.9076 229 V 3.8055 6.9676 116.5008 58.7511 33.0201 175.3721 230 P 4.7493 0.0000 0.0000 60.9736 29.1728 175.9151 231 S 4.5663 6.9057 112.0823 58.4059 67.2972 177.1800 232 L 4.6109 7.7526 119.7283 54.1236 43.6628 176.2494 233 Q 4.2333 8.0572 119.8604 57.6568 29.0961 176.1598 234 G 3.9105 8.7200 113.1365 46.2461 0.0000 172.7820 235 E 4.7649 7.8611 117.3673 54.1156 32.6958 177.0740 236 K 4.2216 8.3259 121.3063 55.1604 30.7259 175.5213 237 A 4.6082 7.6882 124.2167 50.2807 21.1241 178.2652 238 S 4.4265 8.2153 116.6061 57.7836 65.6426 175.8040 239 R 3.7205 8.2353 120.5140 59.0079 29.6116 179.2432 240 A 3.9999 7.8382 120.2252 55.3829 18.4457 179.5152 241 Q 4.0006 7.9676 116.1831 59.0606 28.7336 179.2442 242 I 3.7571 7.8675 120.8552 64.3531 37.2259 178.4534 243 L 4.0621 7.9689 119.5909 57.9357 41.5095 179.3685 244 D 4.3814 8.1432 118.6897 57.5143 40.8465 179.1416 245 K 4.0540 8.4182 118.9509 59.2093 31.9078 179.3972 246 A 4.1272 8.1903 121.2377 55.3959 18.3113 179.6608 247 T 3.8304 7.9997 114.2826 66.7748 68.5021 176.2392 248 E 3.9282 8.3095 120.9584 59.6123 29.7304 178.0594 249 Y 4.3947 8.6458 119.7656 61.0505 38.8196 178.3048 250 I 3.6241 8.1888 120.7939 64.4365 37.2846 178.5038 251 Q 3.9857 8.1425 118.9512 58.9127 28.4796 178.0388 252 Y 4.1046 8.3869 120.9032 61.2225 38.9135 178.2029 253 M 3.5579 8.3333 119.7034 58.1679 31.9672 179.1051 254 R 3.8397 7.8761 118.3440 59.1118 30.2404 179.2531 255 R 3.8449 7.7275 117.6747 59.0221 30.0851 178.9928 256 K 3.6453 7.7360 119.4071 59.6209 32.2007 178.6649 257 N 4.3169 8.0676 116.6201 56.2371 38.3395 177.0772 258 H 4.1432 8.0713 119.7454 59.5084 30.0159 177.2970 259 T 3.8845 7.7533 117.5100 67.1960 68.2037 176.3252 260 H 4.3167 8.1705 117.9012 58.6447 28.7679 177.6295 261 Q 3.9285 7.9057 121.5162 59.1631 28.7872 178.3278 262 Q 3.9270 7.9532 118.9215 59.2627 28.8477 178.3996 263 D 4.3865 7.9856 119.6964 57.8402 40.7391 179.3356 264 I 3.7848 7.9946 120.1030 64.1958 36.9872 178.1583 265 D 4.4051 7.9383 119.6214 57.0450 40.7787 178.4335 266 D 4.3562 8.4266 119.8891 57.4703 40.7693 178.8944 267 L 4.3243 7.9663 120.7088 56.9102 41.5526 179.6914 268 K 3.9914 7.9002 118.9785 59.2586 31.8609 179.5967 269 R 3.9077 8.1669 116.5327 59.5148 29.5023 178.9517 270 Q 3.9943 8.0606 118.9605 58.4754 28.5616 178.6973 271 N 4.4127 8.4374 117.4052 56.3288 38.3122 177.4610 272 A 4.0199 8.1734 121.9827 54.8344 18.5099 179.0360 273 L 3.8926 7.7580 116.6186 56.3871 41.9270 178.7443 274 L 4.2667 8.0676 119.6084 56.9347 41.7721 178.6768 275 E 4.0324 8.1299 117.3737 59.2093 29.4077 179.1064 276 Q 4.1066 7.3856 117.2466 59.2292 29.0067 178.4400 277 Q 4.0898 7.4672 116.5658 58.3121 28.7518 177.5917 278 V 4.0189 7.5666 123.1938 62.9528 31.7453 175.1594 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 203 K 8.17 4.36 0.00 1.81 1.94 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.42 7.81 204 R 8.04 3.76 0.00 1.95 2.01 0.00 3.15 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 205 A 8.23 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 H 8.15 4.18 0.00 3.25 3.51 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 H 8.51 4.13 0.00 3.20 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 N 8.71 4.24 0.00 2.91 2.82 0.00 0.00 6.95 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 7.78 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 L 7.98 3.94 0.00 1.79 1.69 0.75 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.20 3.87 0.00 1.98 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 212 R 7.96 3.88 0.00 2.08 2.03 0.00 3.14 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 213 K 7.92 3.90 0.00 1.94 1.73 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.68 7.81 214 R 8.08 3.80 0.00 1.94 2.09 0.00 3.10 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 215 R 8.40 3.97 0.00 1.98 1.96 0.00 3.17 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 216 D 8.18 4.36 0.00 2.96 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 H 8.13 4.30 0.00 3.35 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 I 7.70 3.78 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 1.13 0.00 0.00 219 K 8.37 4.05 0.00 1.89 1.99 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.39 7.81 220 D 8.33 4.38 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 S 8.16 4.13 0.00 3.96 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 F 8.20 4.04 0.00 3.30 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 H 8.42 4.32 0.00 3.40 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 S 8.19 4.21 0.00 3.84 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 L 7.87 4.11 0.00 1.79 1.80 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 226 R 8.31 3.95 0.00 1.96 2.25 0.00 3.32 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 227 D 7.85 4.66 0.00 2.74 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 S 7.66 4.74 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 V 6.97 3.81 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.95 0.00 0.00 230 P 0.00 4.75 0.00 1.76 1.92 0.00 2.20 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.90 0.00 231 S 6.91 4.57 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 L 7.75 4.61 0.00 1.77 1.67 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 233 Q 8.06 4.23 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.50 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 234 G 8.72 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 E 7.86 4.76 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 236 K 8.33 4.22 0.00 1.73 1.75 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 237 A 7.69 4.61 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 S 8.22 4.43 0.00 4.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 R 8.24 3.72 0.00 1.59 1.50 0.00 2.71 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 240 A 7.84 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 Q 7.97 4.00 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 242 I 7.87 3.76 2.23 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.07 1.07 0.00 0.00 243 L 7.97 4.06 0.00 1.80 1.78 1.06 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 244 D 8.14 4.38 0.00 2.76 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 K 8.42 4.05 0.00 2.01 1.86 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.50 7.81 246 A 8.19 4.13 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 T 8.00 3.83 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 248 E 8.31 3.93 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 249 Y 8.65 4.39 0.00 3.14 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 I 8.19 3.62 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.74 0.89 0.00 0.00 251 Q 8.14 3.99 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.72 0.00 252 Y 8.39 4.10 0.00 3.03 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 M 8.33 3.56 0.00 1.72 1.79 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 254 R 7.88 3.84 0.00 2.00 1.91 0.00 3.09 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 255 R 7.73 3.84 0.00 1.96 1.91 0.00 3.14 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 256 K 7.74 3.65 0.00 1.18 1.47 0.00 1.44 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.17 1.22 7.81 257 N 8.07 4.32 0.00 2.79 2.80 0.00 0.00 6.72 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 H 8.07 4.14 0.00 3.24 3.41 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 T 7.75 3.88 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 260 H 8.17 4.32 0.00 3.14 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 Q 7.91 3.93 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 262 Q 7.95 3.93 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 263 D 7.99 4.39 0.00 2.87 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 I 7.99 3.78 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.90 0.00 0.00 265 D 7.94 4.41 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 D 8.43 4.36 0.00 2.86 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 L 7.97 4.32 0.00 1.74 1.70 1.08 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 268 K 7.90 3.99 0.00 1.90 1.85 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.69 7.81 269 R 8.17 3.91 0.00 2.03 2.18 0.00 2.77 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 270 Q 8.06 3.99 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.72 0.00 271 N 8.44 4.41 0.00 2.85 2.85 0.00 0.00 6.86 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 A 8.17 4.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 L 7.76 3.89 0.00 1.84 1.71 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 274 L 8.07 4.27 0.00 1.89 1.70 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 275 E 8.13 4.03 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 276 Q 7.39 4.11 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 277 Q 7.47 4.09 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 278 V 7.57 4.02 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.98 0.00 0.00