NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 A 4.4932 8.2649 123.5853 52.2035 20.0359 175.5729 21 Q 4.6282 9.5263 117.9302 54.1178 34.0235 172.8365 22 T 5.0634 9.2032 117.8387 62.3509 73.2241 172.5667 23 T 4.9121 9.0588 123.3637 61.6981 70.9590 173.0413 24 L 5.4413 8.6768 128.2449 53.7416 44.4403 175.1756 25 M 5.0344 9.3077 123.8170 53.5777 36.6865 173.9079 26 L 5.3041 8.4804 121.8704 53.4833 45.7946 175.5102 27 S 4.7112 9.2978 119.1360 56.6333 65.9656 172.0640 28 Q 5.2951 8.8491 127.6625 54.3686 31.1544 174.8237 29 K 4.5472 8.9022 124.7560 56.1832 36.0335 176.6908 30 S 3.7901 9.7367 119.8676 59.8766 60.4023 172.9302 31 D 4.5142 8.3072 115.7598 54.6608 38.9478 174.0497 32 V 4.1050 7.7858 120.7781 61.6053 33.4856 174.2914 33 N 5.0381 8.4996 125.3313 52.2226 40.2130 173.4160 34 Y 4.9675 9.0590 122.5281 56.2209 40.5551 174.7549 35 L 5.2797 9.3655 124.4219 53.0596 44.8459 175.8228 36 G 4.6063 9.4321 109.9605 44.3587 0.0000 171.4877 37 W 6.0658 8.5489 121.3204 54.8000 31.9683 174.4179 38 S 4.9145 9.1581 114.2877 57.0375 65.8812 172.8318 39 T 5.2102 8.5245 114.9309 60.5940 70.5070 172.8552 40 D 4.8725 8.3201 125.0504 52.8238 39.7635 175.9256 41 E 4.0781 7.9061 121.4998 56.6628 29.8454 177.1132 42 S 4.3768 8.6966 120.7974 60.0214 64.4902 174.4086 43 K 4.6263 8.6597 120.4342 54.6395 31.9962 175.4644 44 V 4.0384 7.6742 118.9006 63.2608 32.1528 175.6245 45 A 4.7437 9.2316 129.8033 53.4113 20.6816 176.6178 46 R 4.7846 7.5600 109.2734 55.5664 33.3374 173.8714 47 Q 4.9480 9.0189 117.6644 54.2867 33.1507 174.1529 48 E 4.8516 9.3005 123.4304 54.4480 32.7550 174.9660 49 V 4.4606 8.1177 124.3965 61.5118 33.4715 174.0881 50 Y 5.2103 9.2618 125.4971 56.3199 41.3438 174.7162 51 R 5.2445 9.4854 122.3895 54.9608 34.1850 174.0055 52 G 4.8725 9.3521 111.0372 45.1981 0.0000 173.6305 53 T 4.4200 8.9236 110.8067 62.7101 69.5542 174.3520 54 T 4.0537 7.5835 111.0540 59.4284 71.4845 173.6581 55 S 3.5702 7.1665 114.1039 57.9871 63.3929 173.6464 56 N 4.5109 7.8714 121.9469 52.3217 38.3119 173.5822 57 P 3.1302 0.0000 0.0000 65.5401 31.2877 178.2897 58 D 4.1650 8.3159 118.0232 56.2115 40.7251 176.8625 59 L 4.4872 7.4783 117.2921 54.0829 42.2620 176.8257 60 R 4.3948 7.1099 116.1166 56.3460 30.2508 175.9689 61 E 4.9078 9.2713 119.7990 54.3804 33.5650 175.2406 62 R 4.0186 8.7777 124.1777 56.2955 30.3354 175.9125 63 I 4.5203 8.3582 118.5749 60.7226 39.3415 175.2384 64 A 4.4602 7.1571 122.4714 50.9688 22.4382 175.1513 65 V 4.4848 8.3815 120.4755 61.1898 33.7522 174.8189 66 L 4.9917 9.1689 128.2208 52.5854 45.2326 176.0860 67 D 4.7280 8.5798 120.2622 52.9885 40.3158 176.0028 68 A 4.3536 8.4181 120.4075 53.4968 18.9988 178.1069 69 E 4.3172 8.2591 115.1948 58.1086 30.5381 176.8079 70 T 4.1091 8.2755 112.2935 62.3817 68.0808 173.6434 71 R 3.5229 8.5223 123.6117 55.2393 32.5614 174.6683 72 T 4.9928 7.3808 107.9168 60.3551 72.4473 172.8844 73 F 5.0872 9.3766 123.2461 56.9793 43.5093 172.5356 74 K 4.4037 7.4846 126.0072 54.3906 34.2713 174.5295 75 D 4.5747 8.6702 127.7579 52.6027 42.7188 175.6802 76 A 4.3212 8.3282 127.6247 51.9816 20.0749 176.8543 77 D 4.6736 7.9871 118.8269 54.0660 39.8722 176.2976 78 T 4.8099 7.3277 106.5747 61.4587 69.9676 176.2130 79 N 4.4415 8.4155 120.2788 56.0445 38.6534 176.3722 80 S 4.1612 8.1255 112.4765 59.3943 63.3366 175.5169 81 G 3.9162 8.4563 108.1353 45.4947 0.0000 173.3650 82 L 4.3047 7.4735 119.1104 53.6650 42.7143 176.0257 83 N 4.8007 7.9827 117.2271 52.4777 39.6872 174.3031 84 Y 5.0856 8.2057 118.0510 56.1170 42.8801 174.0721 85 W 4.8116 9.3787 120.8124 55.2175 32.4723 174.6691 86 Y 5.5131 8.7815 120.1565 56.3264 42.0977 174.4605 87 W 5.5288 9.5887 120.2801 55.1654 34.3961 174.2010 88 V 4.6677 8.8481 122.3074 61.1965 34.1027 173.8200 89 D 5.2146 9.2831 128.2935 52.7311 42.9728 175.5641 90 V 4.3430 8.6271 125.2411 61.8260 33.0938 174.6656 91 V 4.8459 8.6919 129.4079 61.4193 32.0304 175.8410 92 S 4.9858 8.6209 123.2383 57.4500 64.6998 174.8963 93 E 4.1652 8.8279 119.2463 57.7676 29.5849 178.0110 94 N 4.8575 7.1469 117.4876 53.0926 38.5646 174.7962 95 Q 3.4551 8.1941 111.4771 56.5790 27.3429 173.9638 96 A 4.1806 7.8255 120.7520 51.8719 19.7445 177.2803 97 Q 4.4455 8.6852 123.9707 54.5273 29.8834 174.6072 98 V 4.0742 8.8309 127.1646 61.3524 31.2459 173.4191 99 V 4.3609 7.9729 125.6139 62.0311 32.3323 175.6075 100 S 5.3477 9.0400 123.3575 56.9589 64.3302 173.4465 101 N 4.7669 8.6607 117.3080 52.8321 37.9038 174.5757 102 A 3.9893 8.4127 121.7559 51.5248 19.8653 177.1107 103 V 4.5138 8.0938 112.7056 60.0615 36.0925 174.5849 104 T 5.0431 8.2228 115.5367 60.9382 70.0878 173.4257 105 T 4.2953 8.1099 113.4880 62.2551 70.4184 174.7593 106 A 4.0513 7.1487 126.3797 51.2047 18.8727 175.5458 107 P 4.1745 0.0000 0.0000 62.6659 32.1053 176.4080 *119 S 4.4009 8.2082 117.5895 58.4335 63.7999 172.9894 120 E 4.1121 8.7632 117.4196 59.2835 29.5757 177.5214 121 C 4.8539 7.7858 116.7193 55.8059 33.7351 172.7900 122 K 4.7570 8.0192 122.6788 53.9175 35.3934 174.2730 123 P 4.4338 0.0000 0.0000 64.7172 31.5403 177.0979 124 G 3.8459 8.9143 111.2713 44.8563 0.0000 173.6110 125 A 4.0683 7.5465 122.0224 52.0876 19.6539 176.6080 126 T 4.7161 8.2084 117.4595 61.6948 71.1870 173.4776 127 F 5.2778 8.8783 125.7299 55.7742 41.5131 174.4029 128 E 5.0430 8.4810 123.7389 54.8717 32.5041 174.8047 129 N 4.2936 9.0892 123.8148 52.7045 36.9375 173.4189 130 R 4.5387 7.3775 111.5386 56.1637 33.0625 173.3168 131 T 5.0408 8.3908 115.6973 61.6684 71.0313 174.1231 132 V 4.0758 8.6225 126.3148 60.9354 34.2341 173.5421 133 D 4.9577 8.5359 127.9694 52.9913 42.0112 176.6132 134 C 4.4370 9.4948 124.0875 56.8347 40.4988 174.7928 135 G 3.8223 9.3930 107.6199 46.3913 0.0000 174.8726 136 G 3.8776 8.5887 105.9058 45.1560 0.0000 174.8275 137 V 3.9738 7.5250 113.0802 61.4295 33.0734 174.9898 138 T 5.1551 8.3025 118.5163 62.0129 70.5161 174.0428 139 I 4.6976 9.0865 118.2659 58.7326 41.6173 174.3710 140 G 4.1064 7.8713 111.7896 47.1989 0.0000 170.9212 141 T 4.4845 8.8195 108.1198 61.1953 71.3715 175.7973 142 S 4.6335 7.4859 113.1874 57.5319 66.9030 174.8147 143 C 5.3979 7.9451 114.7203 55.6171 44.5793 171.2159 144 P 4.6041 0.0000 0.0000 62.5678 32.6707 177.4296 145 N 4.7753 8.3741 117.8977 51.7620 37.5820 172.7411 146 D 4.6459 7.2587 116.5738 52.7727 42.6941 175.5690 147 S 4.5644 8.4495 112.3146 58.2330 63.1737 173.7684 148 D 4.3275 8.5066 122.3351 54.4820 40.7951 176.3359 149 K 4.0130 8.5801 125.8994 56.6042 32.8123 176.0019 150 Q 4.4062 8.5782 125.1427 55.5141 30.4864 175.0182 151 K 4.8434 8.3691 121.5782 53.7359 35.2374 174.0381 152 P 4.6728 0.0000 0.0000 63.1380 31.6481 176.4245 153 L 4.2368 9.2117 122.3624 57.2601 42.9933 177.1801 154 I 4.9017 7.5492 117.9241 59.3965 41.7694 174.4225 155 I 4.8164 8.4492 126.6567 59.5013 39.9387 174.4199 156 L 5.2075 9.1944 127.2361 52.9549 44.8048 176.0191 157 K 4.6967 8.7912 121.7695 54.3419 35.5106 176.1424 158 N 5.0267 9.2231 126.7864 53.2628 38.0817 172.5361 159 A 4.9832 7.5077 116.7185 50.7212 24.0640 176.0188 160 T 5.2862 8.8309 114.9045 61.7636 72.4704 173.9332 161 V 5.0704 8.7891 124.9064 59.8067 34.6196 174.6829 162 K 5.4561 8.4221 121.3945 54.8248 36.4889 174.7924 163 N 4.1583 8.6009 116.9722 54.2285 35.5824 172.9557 164 L 5.1110 7.8977 120.3209 53.1033 46.6326 175.3719 165 R 4.9070 8.8442 125.7196 54.5561 33.0003 174.2198 166 I 4.8308 8.5740 127.4308 59.1950 39.0231 175.5950 167 S 4.4694 8.8986 122.3606 58.3006 63.5016 175.5868 168 A 4.0686 8.7417 124.7278 54.9806 18.3897 178.6642 169 S 2.9567 7.7234 108.1301 57.7098 63.5907 174.7447 170 G 4.0380 7.5866 110.5658 45.3291 0.0000 175.2883 171 G 3.5990 8.4547 110.2987 46.3266 0.0000 176.3039 172 A 4.0789 7.2069 121.7334 52.4328 19.1235 177.4364 173 D 4.7374 8.9569 115.7631 56.3069 42.3576 178.1271 174 G 3.8606 8.2124 107.6463 46.6005 0.0000 173.9154 175 I 4.9940 8.7364 123.2750 59.8685 40.0649 174.4137 176 H 5.2175 9.1380 124.4504 54.5338 31.2716 173.5269 177 C 5.2160 9.1362 123.3466 55.4435 44.5544 173.2990 178 D 4.7685 8.9068 126.0650 53.7773 41.3616 176.8509 179 S 4.3777 8.2178 111.3400 58.9630 65.4962 178.1729 180 G 4.0688 8.1318 109.7849 45.9762 0.0000 171.0753 181 N 5.3652 8.4939 116.9147 52.1204 40.6348 175.0930 182 C 6.1285 9.2029 120.8654 54.4846 45.7949 173.1220 183 T 5.1140 8.4281 117.3975 61.8810 72.0833 172.9200 184 I 4.7866 9.0469 127.3948 59.6977 39.5737 173.8396 185 E 4.7341 9.0470 129.4209 54.2143 31.6630 175.3858 186 N 4.0959 8.4964 126.9416 54.8240 37.9215 172.9495 187 V 4.3969 7.1932 118.5028 61.1873 35.0660 174.9855 188 I 5.1094 8.3766 127.7416 59.4281 40.1741 174.4770 189 W 4.8869 9.6196 128.3813 55.1403 29.7616 177.1051 190 E 4.0128 9.1465 126.2842 59.3376 29.7515 177.0505 191 D 4.5806 8.0373 114.8005 53.3037 42.9172 175.2820 192 I 3.6486 8.7289 127.8919 63.6864 37.6197 172.9026 193 C 4.2483 9.2532 126.9853 58.2171 41.9051 174.3829 194 E 4.2601 5.9000 115.5231 58.8230 30.0250 177.3216 195 D 4.6481 7.8627 114.1798 53.8422 41.8198 175.4173 196 A 4.0053 8.6991 120.4342 54.0695 19.4573 177.3998 197 A 5.3054 7.5297 115.0288 51.0117 23.3225 174.9675 198 T 4.8756 8.9042 115.7810 61.8627 72.8593 172.9650 199 N 4.7629 9.3121 126.4261 52.5168 39.4231 174.1375 200 N 5.0133 9.1420 123.7708 52.2988 39.5527 175.6171 201 G 4.0808 8.6076 109.6732 45.6205 0.0000 173.1715 202 K 4.2976 8.7158 121.2234 57.1981 32.8790 175.9821 203 T 5.0355 8.3598 114.3647 61.9249 72.3192 172.0479 204 M 4.9219 9.0029 127.2474 54.2094 34.4505 174.4254 205 T 5.0134 8.9923 123.8223 61.8923 71.4758 173.3881 206 I 4.5841 8.8602 128.0052 59.7948 39.2479 174.9511 207 V 4.3059 8.6223 128.5055 61.7272 32.7239 175.7110 208 G 3.8677 9.4363 120.8412 46.6634 0.0000 172.5526 209 G 4.2977 9.3838 105.3809 45.5168 0.0000 172.0085 210 I 5.0663 8.8851 118.8403 59.3374 41.3243 174.3645 211 A 5.3295 9.0592 129.0853 50.4903 21.5776 174.2053 212 H 5.3120 9.1812 122.7355 54.1986 32.6495 172.9564 213 N 5.2159 8.1064 120.2277 52.5796 43.1085 172.7574 214 A 5.6116 8.0479 122.5638 50.0295 22.4303 177.6129 215 K 3.9253 9.0825 119.6397 58.8439 32.3577 177.9610 216 D 4.7348 8.0099 116.0905 52.8736 39.2361 176.4110 217 G 3.9470 7.4564 110.2565 44.5389 0.0000 173.0375 218 Y 4.0611 8.3433 117.4894 59.5247 38.0044 177.2823 219 G 3.9209 8.8584 112.6841 44.5847 0.0000 174.7363 220 G 3.7037 7.3022 106.0683 44.0563 0.0000 172.5199 221 K 3.7880 8.5382 120.4455 56.0032 32.4344 175.8895 222 P 4.3542 0.0000 0.0000 63.6289 32.9839 173.8290 223 D 4.9369 7.9289 121.6894 54.1855 43.9235 177.4430 224 K 4.5623 8.7865 114.9238 56.5375 32.8045 176.4277 225 V 3.8074 8.7770 123.7294 64.6754 32.9397 175.2264 226 L 5.1177 8.3053 121.5138 53.1483 43.7338 175.4958 227 Q 4.5872 8.8625 123.4305 55.0358 31.5828 175.0387 228 H 4.9845 8.2651 121.3953 55.7575 31.8628 172.6880 229 N 4.8270 8.9534 124.3253 54.2050 40.4906 176.2419 230 S 4.3817 8.1485 111.9147 57.9753 63.9772 172.9319 231 K 4.5776 8.0776 119.3306 55.1240 35.0475 175.3418 232 N 4.4002 8.9771 115.6477 54.3879 36.6446 174.2068 233 S 5.0558 7.7680 109.7327 57.2908 67.6254 173.4356 234 T 5.3754 9.0696 116.5218 62.3016 72.7400 173.0068 235 T 4.9465 9.0362 122.2672 61.8380 71.2239 173.4036 236 V 4.7527 8.8936 126.7928 60.9621 34.4523 174.3542 237 V 4.8206 8.9743 127.7310 61.1337 34.2381 174.3688 238 K 4.8097 8.7901 126.8205 56.2354 36.6510 177.1143 239 G 3.8674 9.0885 106.1647 45.6567 0.0000 173.1152 240 N 4.2247 7.7528 114.5230 53.4785 37.5983 174.4789 241 F 4.5441 8.1833 119.0472 59.5505 40.8323 173.9628 242 T 4.8463 8.7100 121.9829 61.6276 71.7075 172.7977 243 L 4.9079 8.5727 126.4416 53.0832 44.2061 175.7136 244 T 4.5833 8.6913 113.1263 60.5009 72.2584 174.2593 245 G 3.9357 8.9331 108.0492 45.5291 0.0000 172.4689 246 E 5.1544 8.8981 122.0571 54.8821 32.3882 175.2588 247 H 4.6238 9.2682 121.1603 54.2013 32.8854 173.2034 248 G 4.0040 8.8299 106.1949 47.0837 0.0000 173.0646 249 K 5.7691 8.4613 117.1190 52.7849 36.9642 177.2108 250 L 4.0449 8.7559 125.7124 57.7042 43.5295 176.4505 251 W 5.9567 8.5052 127.6769 55.6177 34.6232 173.5894 252 R 4.3290 7.5332 125.8831 54.2243 32.4033 174.2240 253 S 3.4985 7.1729 122.2160 57.5993 63.0440 172.6207 254 C 3.6908 8.3482 127.3752 57.6009 42.5033 173.9287 255 G 3.5945 8.7309 113.9742 47.9083 0.0000 173.5082 256 D 5.8500 7.4883 119.2921 51.8861 39.6102 176.9675 257 C 4.4842 8.5448 115.6827 57.9767 41.7098 173.5482 258 S 4.3974 8.5773 116.5108 58.9808 62.8530 173.1970 259 N 4.0656 8.8168 123.3432 54.2119 37.2621 173.5628 260 N 4.4053 8.2834 113.0717 52.9671 40.0629 174.2354 261 G 2.9265 7.3686 106.6652 46.6846 0.0000 170.2880 262 G 4.1320 7.5195 105.4942 45.2442 0.0000 171.3693 263 P 4.9291 0.0000 0.0000 61.7542 33.4280 175.3088 264 R 4.8947 8.8164 120.1293 54.4191 33.3620 174.7029 265 F 5.3812 9.1743 121.7386 55.5470 42.7586 173.9955 266 L 4.5864 8.3714 123.6319 53.2911 45.0140 175.2236 267 T 4.8998 8.8566 122.5274 61.9170 71.8125 172.8298 268 V 4.8329 8.7137 127.9385 61.3269 33.2999 175.8962 269 T 4.5355 8.6738 117.1073 61.9145 71.3496 173.8354 270 S 4.7662 7.8806 113.7949 57.7845 65.4923 173.7254 271 A 4.8120 8.4782 127.4410 51.3981 23.1878 174.8127 272 T 4.9559 8.8706 116.0812 61.7227 72.9549 173.4462 273 V 4.3382 8.9205 126.2894 61.0196 33.2357 174.4583 274 N 4.8125 9.1644 127.3112 53.2140 38.9214 175.3753 275 G 4.9114 8.2644 104.7107 45.6878 0.0000 173.3427 276 T 4.8303 8.4214 114.1667 60.5477 71.7172 173.7953 277 I 5.3662 7.7407 120.7092 60.8741 40.4597 174.1994 278 D 4.7020 9.0027 128.5478 57.4379 41.9372 176.2865 279 S 4.5696 7.6684 109.8500 58.1896 65.7662 176.5326 280 I 4.0535 8.3390 121.3933 63.3136 37.6949 175.6297 281 A 5.5817 8.9646 123.6537 50.1029 23.0031 174.6023 282 G 4.4862 9.0993 107.0795 44.7620 0.0000 172.0959 283 V 4.9006 8.9833 119.5574 59.6996 35.0381 175.5069 284 N 5.1717 9.5210 122.8709 51.7691 38.3954 176.1232 285 R 4.0094 8.9218 122.7355 58.7653 29.7973 179.0534 286 N 4.4783 8.0664 114.4004 54.7224 37.7391 174.9234 287 Y 4.7846 8.0038 116.4368 57.6891 38.3540 176.9422 288 G 4.0622 8.0940 107.5815 45.4995 0.0000 173.8730 289 D 4.4745 7.8436 118.5416 54.4556 41.8823 176.1692 290 V 4.7427 8.4131 120.4390 61.3950 35.3485 173.5117 291 A 4.9395 9.0462 129.9985 50.5918 21.1972 175.2738 292 T 4.9043 8.9686 120.5196 62.1076 70.7125 173.8640 293 I 5.1407 8.3673 127.3085 59.6815 40.7045 174.9889 294 S 4.4717 9.0473 119.3607 58.1065 66.5841 174.4913 295 G 3.9521 8.5440 105.3277 46.1497 0.0000 172.2346 296 L 4.9131 7.7329 122.4210 53.5080 43.7092 175.3764 297 K 5.1532 8.9965 125.8146 54.6677 35.3285 175.2177 298 I 5.0668 8.6591 124.9032 58.8984 41.1598 174.8267 299 K 4.0830 9.0465 128.9131 57.5893 32.6270 176.0910 300 N 4.2379 9.0650 123.9589 53.8745 36.3175 173.8276 301 Y 4.2509 7.9669 117.4259 58.0535 39.7597 174.9274 302 K 4.1302 7.2995 124.4882 54.1038 36.5077 175.3637 303 E 4.1070 7.7639 122.7219 57.3276 29.6941 177.3913 304 G 4.1064 9.6255 114.1171 45.3794 0.0000 173.6036 305 K 4.4442 8.2245 121.0490 53.7591 32.1359 173.3791 306 P 4.7290 0.0000 0.0000 60.0291 33.5463 174.6109 307 P 4.3629 0.0000 0.0000 63.1503 32.1510 176.3316 308 V 3.9585 9.4669 123.1885 63.1255 31.8450 173.6723 309 C 5.3028 7.3562 117.2569 54.8528 46.5892 172.0312 310 E 5.1404 9.2587 125.6541 54.6024 32.7053 174.7747 311 E 5.1904 8.6285 122.6589 55.2712 32.0590 175.1601 312 F 5.1670 9.4205 121.1050 55.7925 44.4573 173.2652 313 K 4.7153 8.7502 121.3379 54.8843 33.5186 175.8013 314 G 3.8215 8.9481 115.6379 45.8976 0.0000 172.6269 315 V 4.8808 8.6808 113.1802 58.5168 36.9220 174.5176 316 V 4.4597 8.2807 121.8296 61.3661 33.1131 175.2232 317 K 3.8194 8.4267 128.6834 58.5157 32.2297 176.9664 318 G 3.9811 9.0627 114.1165 45.6497 0.0000 173.4912 319 Q 4.4465 8.4733 117.0362 54.6741 29.4430 175.3548 320 G 3.9753 6.8194 106.3143 45.6976 0.0000 171.4360 321 S 4.9650 7.9806 113.3371 56.2504 65.4708 174.3734 322 T 4.4562 8.2941 111.5437 61.4445 69.8452 173.1295 323 E 4.7048 8.4087 120.1195 54.5855 34.2224 174.4816 324 K 4.3611 8.2841 120.7383 55.0089 33.8881 175.8112 325 Y 4.5647 8.2908 120.3665 57.2068 40.0271 176.7060 326 G 3.7146 7.7100 107.3371 43.9654 0.0000 171.7935 327 E 4.5681 8.2639 118.9308 56.2636 30.5703 175.9937 328 K 4.8355 8.6285 124.8267 54.4466 36.4693 175.6368 329 W 4.6708 8.6138 121.7159 55.5268 31.9447 175.5491 330 D 4.3901 8.5469 125.2648 55.8221 38.3171 172.1356 331 T 4.6219 7.6823 107.8703 59.6689 71.8446 175.1032 332 T 4.0127 8.5435 117.5533 66.5494 68.5413 175.3574 333 N 4.8371 8.1162 116.8568 53.9382 39.7595 174.5336 334 C 5.1316 8.0208 116.4978 54.7867 42.1462 172.9029 335 K 4.9912 8.9488 126.2996 54.5897 30.5811 175.1753 336 V 4.8515 7.5563 120.9949 60.1685 35.3475 175.7407 337 S 5.3616 8.7369 119.3859 56.4916 65.4548 175.1041 338 R 3.5124 8.3376 122.1505 59.2946 29.8272 178.4567 339 S 4.2929 8.0512 110.5646 59.7758 63.5255 174.7057 340 G 3.9291 8.3923 110.4446 45.9110 0.0000 173.1882 341 V 4.9430 7.4478 119.8824 61.0977 34.4962 174.5965 342 S 4.7580 8.6082 120.2572 56.5002 67.0850 172.8601 343 K 4.6171 8.6321 122.3917 56.0309 32.7259 176.3221 344 L 4.2481 8.4712 128.5832 55.4483 41.6198 176.4437 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 20 A 8.26 4.49 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 21 Q 9.53 4.63 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 22 T 9.20 5.06 4.29 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 1.29 0.00 0.00 23 T 9.06 4.91 4.41 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 1.26 0.00 0.00 24 L 8.68 5.44 0.00 1.69 1.69 1.13 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 25 M 9.31 5.03 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 26 L 8.48 5.30 0.00 1.57 1.46 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 27 S 9.30 4.71 0.00 3.91 3.71 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 28 Q 8.85 5.30 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.47 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 29 K 8.90 4.55 0.00 1.97 1.64 0.00 1.35 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.36 1.38 7.81 30 S 9.74 3.79 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 31 D 8.31 4.51 0.00 2.86 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.79 4.11 2.12 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 0.31 0.00 0.00 0.95 0.00 0.00 33 N 8.50 5.04 0.00 2.59 2.49 0.00 0.00 6.62 7.44 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 34 Y 9.06 4.97 0.00 2.99 2.86 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 35 L 9.37 5.28 0.00 1.94 1.88 0.92 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 G 9.43 4.61 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 37 W 8.55 6.07 0.00 3.40 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 38 S 9.16 4.91 0.00 4.10 3.97 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 39 T 8.52 5.21 4.46 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 1.36 0.00 0.00 40 D 8.32 4.87 0.00 2.78 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 41 E 7.91 4.08 0.00 1.97 1.96 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 2.33 0.00 42 S 8.70 4.38 0.00 4.03 3.99 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 43 K 8.66 4.63 0.00 1.86 1.75 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.34 7.81 44 V 7.67 4.04 2.14 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 0.83 0.00 0.00 1.04 0.00 0.00 45 A 9.23 4.74 1.30 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 46 R 7.56 4.78 0.00 1.97 2.02 0.00 3.00 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 47 Q 9.02 4.95 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 48 E 9.30 4.85 0.00 1.91 1.46 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 2.13 2.19 0.00 49 V 8.12 4.46 1.43 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 0.73 0.00 0.00 0.19 0.00 0.00 50 Y 9.26 5.21 0.00 3.07 2.89 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 0.00 0.00 0.00 0.00 51 R 9.49 5.24 0.00 1.81 1.69 0.00 2.21 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.67 0.00 52 G 9.35 4.87 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 53 T 8.92 4.42 4.27 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 1.33 0.00 0.00 54 T 7.58 4.05 3.97 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 1.13 0.00 0.00 55 S 7.17 3.57 0.00 3.68 2.64 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 56 N 7.87 4.51 0.00 2.68 2.68 0.00 0.00 6.90 7.69 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 57 P 0.00 3.13 0.00 1.87 2.05 0.00 3.72 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 58 D 8.32 4.17 0.00 2.75 2.67 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 59 L 7.48 4.49 0.00 1.56 1.65 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.11 4.39 0.00 1.77 1.26 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.29 0.00 61 E 9.27 4.91 0.00 1.93 1.87 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 2.24 2.25 0.00 62 R 8.78 4.02 0.00 1.52 1.68 0.00 2.92 0.00 0.00 2.85 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.09 0.00 63 I 8.36 4.52 1.92 0.00 0.00 1.12 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 0.70 0.97 0.00 0.00 64 A 7.16 4.46 0.91 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 65 V 8.38 4.48 2.05 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 0.84 0.00 0.00 0.85 0.00 0.00 66 L 9.17 4.99 0.00 1.77 1.69 1.14 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.58 4.73 0.00 2.92 2.76 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 68 A 8.42 4.35 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 69 E 8.26 4.32 0.00 2.22 2.01 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 70 T 8.28 4.11 4.32 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 1.51 0.00 0.00 71 R 8.52 3.52 0.00 1.51 1.42 0.00 3.15 0.00 0.00 2.98 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 72 T 7.38 4.99 4.33 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 1.21 0.00 0.00 73 F 9.38 5.09 0.00 3.52 3.19 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 74 K 7.48 4.40 0.00 1.65 1.33 0.00 1.82 0.00 0.00 1.52 0.00 0.00 2.55 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.94 0.80 7.81 75 D 8.67 4.57 0.00 2.88 2.44 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 76 A 8.33 4.32 1.17 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 77 D 7.99 4.67 0.00 2.65 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 78 T 7.33 4.81 4.39 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 1.34 0.00 0.00 79 N 8.42 4.44 0.00 2.77 2.96 0.00 0.00 7.10 7.57 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 80 S 8.13 4.16 0.00 4.05 4.13 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 81 G 8.46 3.92 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 82 L 7.47 4.30 0.00 1.13 1.26 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 83 N 7.98 4.80 0.00 2.50 2.32 0.00 0.00 7.05 7.46 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 84 Y 8.21 5.09 0.00 2.80 2.35 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 85 W 9.38 4.81 0.00 3.50 2.42 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 86 Y 8.78 5.51 0.00 2.73 2.81 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 0.00 0.00 0.00 87 W 9.59 5.53 0.00 3.37 2.94 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 88 V 8.85 4.67 1.59 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 -0.21 0.00 0.00 0.16 0.00 0.00 89 D 9.28 5.21 0.00 2.84 2.62 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 90 V 8.63 4.34 2.12 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 1.07 0.00 0.00 0.99 0.00 0.00 91 V 8.69 4.85 2.21 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 0.75 0.00 0.00 0.95 0.00 0.00 92 S 8.62 4.99 0.00 4.15 4.01 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 93 E 8.83 4.17 0.00 1.91 2.07 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 2.50 0.00 94 N 7.15 4.86 0.00 2.81 2.78 0.00 0.00 7.03 7.57 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 95 Q 8.19 3.46 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 96 A 7.83 4.18 1.26 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 97 Q 8.69 4.45 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.18 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 98 V 8.83 4.07 2.19 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 1.01 0.00 0.00 0.95 0.00 0.00 99 V 7.97 4.36 2.09 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 0.95 0.00 0.00 0.99 0.00 0.00 100 S 9.04 5.35 0.00 3.98 3.99 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 0.00 101 N 8.66 4.77 0.00 2.76 2.91 0.00 0.00 5.96 7.26 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 0.00 102 A 8.41 3.99 0.72 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 0.00 0.00 103 V 8.09 4.51 2.04 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 0.72 0.00 0.00 1.00 0.00 0.00 104 T 8.22 5.04 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 0.94 0.00 0.00 105 T 8.11 4.30 4.20 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 0.00 0.00 1.32 0.00 0.00 106 A 7.15 4.05 1.03 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 0.00 107 P 0.00 4.17 0.00 2.05 2.01 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 *119 S 8.21 4.40 0.00 4.01 3.97 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 0.00 120 E 8.76 4.11 0.00 2.00 2.19 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 2.33 2.33 0.00 121 C 7.79 4.85 0.00 2.97 3.16 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 0.00 122 K 8.02 4.76 0.00 1.86 1.85 0.00 1.53 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.44 7.81 123 P 0.00 4.43 0.00 2.02 2.01 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 124 G 8.91 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.55 4.07 0.96 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 0.00 126 T 8.21 4.72 4.19 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 1.25 0.00 0.00 127 F 8.88 5.28 0.00 2.98 2.80 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 0.00 128 E 8.48 5.04 0.00 1.96 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 2.20 2.56 0.00 129 N 9.09 4.29 0.00 2.93 2.89 0.00 0.00 6.78 7.03 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 0.00 130 R 7.38 4.54 0.00 1.78 1.98 0.00 2.78 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 131 T 8.39 5.04 4.20 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 0.00 0.00 1.17 0.00 0.00 132 V 8.62 4.08 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 0.51 0.00 0.00 -0.12 0.00 0.00 133 D 8.54 4.96 0.00 2.68 2.53 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 0.00 134 C 9.49 4.44 0.00 3.31 3.09 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 0.00 135 G 9.39 3.82 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 0.00 136 G 8.59 3.88 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 0.00 137 V 7.53 3.97 2.07 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 0.73 0.00 0.00 0.96 0.00 0.00 138 T 8.30 5.16 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 1.21 0.00 0.00 139 I 9.09 4.70 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.90 0.92 0.00 0.00 140 G 7.87 4.11 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 0.00 141 T 8.82 4.48 4.21 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 1.18 0.00 0.00 142 S 7.49 4.63 0.00 3.96 3.96 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 0.00 143 C 7.95 5.40 0.00 2.87 2.99 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 0.00 144 P 0.00 4.60 0.00 2.56 2.06 0.00 3.92 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 145 N 8.37 4.78 0.00 2.74 2.83 0.00 0.00 6.73 8.06 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 0.00 146 D 7.26 4.65 0.00 2.71 2.63 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 0.00 147 S 8.45 4.56 0.00 3.99 3.99 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 0.00 148 D 8.51 4.33 0.00 2.72 2.67 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 0.00 149 K 8.58 4.01 0.00 1.71 1.72 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.46 7.81 150 Q 8.58 4.41 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 151 K 8.37 4.84 0.00 1.65 1.64 0.00 1.64 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.38 7.81 152 P 0.00 4.67 0.00 2.05 1.56 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.72 0.00 153 L 9.21 4.24 0.00 1.64 1.69 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.55 4.90 1.81 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.70 0.00 0.00 155 I 8.45 4.82 1.78 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.77 0.90 0.00 0.00 156 L 9.19 5.21 0.00 1.56 1.60 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.79 4.70 0.00 1.68 1.71 0.00 1.92 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.37 7.81 158 N 9.22 5.03 0.00 2.88 2.95 0.00 0.00 6.66 7.68 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 0.00 159 A 7.51 4.98 1.35 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 0.00 160 T 8.83 5.29 4.23 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 1.21 0.00 0.00 161 V 8.79 5.07 2.30 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 0.86 0.00 0.00 1.05 0.00 0.00 162 K 8.42 5.46 0.00 1.86 1.87 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.23 7.81 163 N 8.60 4.16 0.00 3.06 2.93 0.00 0.00 6.27 6.74 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 0.00 164 L 7.90 5.11 0.00 1.62 1.28 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 165 R 8.84 4.91 0.00 1.84 1.67 0.00 3.09 0.00 0.00 3.30 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 166 I 8.57 4.83 1.66 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.15 0.92 0.00 0.00 167 S 8.90 4.47 0.00 3.82 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 0.00 168 A 8.74 4.07 1.37 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 0.00 169 S 7.72 2.96 0.00 3.39 3.51 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 0.00 170 G 7.59 4.04 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 0.00 171 G 8.45 3.60 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 0.00 172 A 7.21 4.08 1.13 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 0.00 173 D 8.96 4.74 0.00 2.67 2.67 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 0.00 174 G 8.21 3.86 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 0.00 175 I 8.74 4.99 2.08 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.84 1.03 0.00 0.00 176 H 9.14 5.22 0.00 3.06 3.36 0.00 5.59 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 C 9.14 5.22 0.00 2.99 3.07 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 0.00 178 D 8.91 4.77 0.00 2.59 2.68 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 0.00 179 S 8.22 4.38 0.00 3.84 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 0.00 180 G 8.13 4.07 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 0.00 181 N 8.49 5.37 0.00 2.66 2.75 0.00 0.00 6.64 7.66 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 0.00 182 C 9.20 6.13 0.00 2.83 3.04 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 0.00 183 T 8.43 5.11 4.24 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 0.00 0.00 0.00 1.20 0.00 0.00 184 I 9.05 4.79 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.78 1.06 0.00 0.00 185 E 9.05 4.73 0.00 1.99 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 0.00 2.18 2.19 0.00 186 N 8.50 4.10 0.00 2.96 2.76 0.00 0.00 6.25 7.29 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 0.00 187 V 7.19 4.40 1.59 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 -0.45 0.00 0.00 0.73 0.00 0.00 188 I 8.38 5.11 1.83 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 1.29 0.68 1.00 0.00 0.00 189 W 9.62 4.89 0.00 3.29 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 0.00 190 E 9.15 4.01 0.00 2.08 2.06 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 2.43 2.41 0.00 191 D 8.04 4.58 0.00 2.79 2.88 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 0.00 192 I 8.73 3.65 1.84 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.81 0.89 0.00 0.00 193 C 9.25 4.25 0.00 2.97 2.99 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 0.00 194 E 5.90 4.26 0.00 2.08 1.99 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 2.45 2.41 0.00 195 D 7.86 4.65 0.00 2.72 2.62 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 0.00 196 A 8.70 4.01 0.22 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 0.00 0.00 197 A 7.53 5.31 1.26 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 0.00 198 T 8.90 4.88 4.18 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 1.15 0.00 0.00 199 N 9.31 4.76 0.00 2.68 2.51 0.00 0.00 6.61 6.27 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 0.00 200 N 9.14 5.01 0.00 2.84 2.72 0.00 0.00 6.72 7.25 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 0.00 201 G 8.61 4.08 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 0.00 202 K 8.72 4.30 0.00 1.88 1.89 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.48 7.81 203 T 8.36 5.04 4.38 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 1.21 0.00 0.00 204 M 9.00 4.92 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 205 T 8.99 5.01 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 1.18 0.00 0.00 206 I 8.86 4.58 1.52 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.51 0.05 0.00 0.00 207 V 8.62 4.31 2.05 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 0.91 0.00 0.00 0.90 0.00 0.00 208 G 9.44 3.87 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 0.00 209 G 9.38 4.30 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 0.00 210 I 8.89 5.07 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.86 0.75 0.00 0.00 211 A 9.06 5.33 1.07 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 0.00 212 H 9.18 5.31 0.00 3.23 3.37 0.00 5.83 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 N 8.11 5.22 0.00 2.41 2.45 0.00 0.00 6.91 8.34 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 0.00 214 A 8.05 5.61 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 215 K 9.08 3.93 0.00 1.73 1.86 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.40 7.81 216 D 8.01 4.73 0.00 2.71 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 0.00 217 G 7.46 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 0.00 0.00 0.00 218 Y 8.34 4.06 0.00 3.03 2.91 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 0.00 219 G 8.86 3.92 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 0.00 220 G 7.30 3.70 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 0.00 0.00 0.00 221 K 8.54 3.79 0.00 1.70 1.74 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.46 7.81 222 P 0.00 4.35 0.00 2.02 1.98 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.16 0.00 223 D 7.93 4.94 0.00 2.63 1.78 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 0.00 0.00 0.00 0.00 224 K 8.79 4.56 0.00 1.85 1.63 0.00 1.44 0.00 0.00 1.48 0.00 0.00 2.80 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.32 7.81 225 V 8.78 3.81 2.29 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 0.98 0.00 0.00 0.91 0.00 0.00 226 L 8.31 5.12 0.00 1.90 1.69 0.98 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 227 Q 8.86 4.59 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 2.24 2.54 0.00 228 H 8.27 4.98 0.00 3.19 2.83 0.00 5.65 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 N 8.95 4.83 0.00 2.60 2.78 0.00 0.00 7.06 7.19 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 0.00 230 S 8.15 4.38 0.00 4.00 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 0.00 231 K 8.08 4.58 0.00 1.70 1.67 0.00 1.81 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.24 1.36 7.81 232 N 8.98 4.40 0.00 2.85 2.95 0.00 0.00 6.71 7.44 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 0.00 233 S 7.77 5.06 0.00 4.05 4.07 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 0.00 234 T 9.07 5.38 4.29 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 1.23 0.00 0.00 235 T 9.04 4.95 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 1.23 0.00 0.00 236 V 8.89 4.75 2.04 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 0.89 0.00 0.00 0.89 0.00 0.00 237 V 8.97 4.82 2.07 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 1.16 0.00 0.00 0.88 0.00 0.00 238 K 8.79 4.81 0.00 1.80 1.85 0.00 1.44 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.37 7.81 239 G 9.09 3.87 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 0.00 240 N 7.75 4.22 0.00 2.86 2.87 0.00 0.00 6.98 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 F 8.18 4.54 0.00 3.01 2.95 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 0.00 242 T 8.71 4.85 4.11 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 1.06 0.00 0.00 243 L 8.57 4.91 0.00 1.25 1.03 0.62 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 244 T 8.69 4.58 4.07 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 0.29 0.00 0.00 245 G 8.93 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 0.00 0.00 0.00 246 E 8.90 5.15 0.00 1.86 1.80 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 2.19 2.27 0.00 247 H 9.27 4.62 0.00 2.97 3.11 0.00 5.60 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 0.00 248 G 8.83 4.00 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 0.00 249 K 8.46 5.77 0.00 1.64 1.65 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.19 7.81 250 L 8.76 4.04 0.00 1.79 1.99 1.06 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 251 W 8.51 5.96 0.00 3.39 2.93 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 0.00 252 R 7.53 4.33 0.00 1.50 1.39 0.00 3.02 0.00 0.00 2.74 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.23 0.00 253 S 7.17 3.50 0.00 3.43 3.40 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 0.00 254 C 8.35 3.69 0.00 3.05 2.94 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 0.00 255 G 8.73 3.59 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 0.00 256 D 7.49 5.85 0.00 2.59 2.63 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 0.00 257 C 8.54 4.48 0.00 2.86 3.00 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 0.00 258 S 8.58 4.40 0.00 3.86 3.74 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 0.00 259 N 8.82 4.07 0.00 2.79 2.78 0.00 0.00 7.01 7.79 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 0.00 260 N 8.28 4.41 0.00 3.02 2.78 0.00 0.00 7.08 7.98 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 0.00 261 G 7.37 2.93 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 0.00 262 G 7.52 4.13 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 0.00 263 P 0.00 4.93 0.00 1.28 2.11 0.00 3.97 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 264 R 8.82 4.89 0.00 1.78 1.65 0.00 2.89 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.46 0.00 265 F 9.17 5.38 0.00 3.05 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 L 8.37 4.59 0.00 0.27 0.43 0.31 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 267 T 8.86 4.90 4.16 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 0.00 268 V 8.71 4.83 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 0.98 0.00 0.00 0.84 0.00 0.00 269 T 8.67 4.54 4.23 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 1.18 0.00 0.00 270 S 7.88 4.77 0.00 3.88 3.71 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 0.00 271 A 8.48 4.81 1.28 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 0.00 272 T 8.87 4.96 4.20 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 0.00 0.00 1.24 0.00 0.00 273 V 8.92 4.34 2.06 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 1.05 0.00 0.00 0.86 0.00 0.00 274 N 9.16 4.81 0.00 2.75 2.78 0.00 0.00 6.95 7.82 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 0.00 275 G 8.26 4.91 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 0.00 276 T 8.42 4.83 4.25 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 1.22 0.00 0.00 277 I 7.74 5.37 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.16 0.94 0.00 0.00 278 D 9.00 4.70 0.00 2.89 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 0.00 279 S 7.67 4.57 0.00 3.89 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 0.00 280 I 8.34 4.05 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.18 0.92 0.00 0.00 281 A 8.96 5.58 1.38 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 0.00 282 G 9.10 4.49 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 0.00 283 V 8.98 4.90 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 1.09 0.00 0.00 1.11 0.00 0.00 284 N 9.52 5.17 0.00 2.78 2.71 0.00 0.00 6.78 7.40 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 0.00 285 R 8.92 4.01 0.00 2.23 2.24 0.00 2.64 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.53 0.00 286 N 8.07 4.48 0.00 2.76 2.92 0.00 0.00 5.91 7.55 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 0.00 287 Y 8.00 4.78 0.00 3.14 2.87 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 0.00 288 G 8.09 4.06 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 0.00 289 D 7.84 4.47 0.00 2.73 2.80 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 0.00 290 V 8.41 4.74 2.51 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 1.10 0.00 0.00 1.24 0.00 0.00 291 A 9.05 4.94 1.16 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 0.00 292 T 8.97 4.90 4.19 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 1.18 0.00 0.00 293 I 8.37 5.14 1.83 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.51 0.87 0.00 0.00 294 S 9.05 4.47 0.00 3.85 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 0.00 295 G 8.54 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 0.00 0.00 0.00 296 L 7.73 4.91 0.00 1.77 1.64 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 297 K 9.00 5.15 0.00 1.73 1.66 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.41 7.81 298 I 8.66 5.07 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.70 1.04 0.00 0.00 299 K 9.05 4.08 0.00 1.84 1.77 0.00 1.98 0.00 0.00 1.91 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.47 7.81 300 N 9.06 4.24 0.00 2.90 2.87 0.00 0.00 7.02 7.46 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 0.00 301 Y 7.97 4.25 0.00 3.23 2.92 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 0.00 302 K 7.30 4.13 0.00 1.56 1.43 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.78 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.24 1.47 7.81 303 E 7.76 4.11 0.00 1.88 1.83 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 2.41 2.60 0.00 304 G 9.63 4.11 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 0.00 305 K 8.22 4.44 0.00 1.68 1.62 0.00 1.51 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.38 7.81 306 P 0.00 4.73 0.00 2.28 2.24 0.00 4.17 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 307 P 0.00 4.36 0.00 2.10 2.00 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 308 V 9.47 3.96 1.56 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 0.72 0.00 0.00 1.00 0.00 0.00 309 C 7.36 5.30 0.00 2.85 2.80 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 0.00 310 E 9.26 5.14 0.00 1.95 1.42 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 2.11 2.23 0.00 311 E 8.63 5.19 0.00 1.97 1.96 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 2.30 2.27 0.00 312 F 9.42 5.17 0.00 2.89 2.84 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 0.00 0.00 0.00 313 K 8.75 4.72 0.00 1.84 1.63 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.36 7.81 314 G 8.95 3.82 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 0.00 315 V 8.68 4.88 2.10 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 0.98 0.00 0.00 1.01 0.00 0.00 316 V 8.28 4.46 2.11 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 1.04 0.00 0.00 0.95 0.00 0.00 317 K 8.43 3.82 0.00 1.93 1.73 0.00 1.86 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.40 7.81 318 G 9.06 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 0.00 0.00 0.00 319 Q 8.47 4.45 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 320 G 6.82 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 0.00 0.00 0.00 321 S 7.98 4.97 0.00 3.81 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 0.00 322 T 8.29 4.46 4.26 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 0.00 323 E 8.41 4.70 0.00 1.54 1.42 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 2.19 2.23 0.00 324 K 8.28 4.36 0.00 1.43 1.40 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.44 7.81 325 Y 8.29 4.56 0.00 2.86 2.78 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 0.00 0.00 0.00 0.00 326 G 7.71 3.71 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 0.00 0.00 0.00 327 E 8.26 4.57 0.00 2.01 1.82 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 2.11 2.14 0.00 328 K 8.63 4.84 0.00 1.52 1.61 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.83 7.81 329 W 8.61 4.67 0.00 3.15 3.13 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 0.00 330 D 8.55 4.39 0.00 2.88 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 0.00 331 T 7.68 4.62 4.25 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 1.30 0.00 0.00 332 T 8.54 4.01 4.25 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 1.25 0.00 0.00 333 N 8.12 4.84 0.00 3.03 3.01 0.00 0.00 6.92 7.66 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 0.00 334 C 8.02 5.13 0.00 2.83 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 335 K 8.95 4.99 0.00 1.86 1.77 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.41 7.81 336 V 7.56 4.85 2.04 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 0.55 0.00 0.00 1.07 0.00 0.00 337 S 8.74 5.36 0.00 3.96 3.84 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 0.00 0.00 0.00 338 R 8.34 3.51 0.00 1.20 1.68 0.00 2.95 0.00 0.00 2.85 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 339 S 8.05 4.29 0.00 4.02 3.96 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 0.00 340 G 8.39 3.93 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 0.00 341 V 7.45 4.94 1.92 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 -0.05 0.00 0.00 1.00 0.00 0.00 342 S 8.61 4.76 0.00 3.92 3.89 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 0.00 0.00 0.00 0.00 343 K 8.63 4.62 0.00 1.92 1.83 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.69 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.60 7.81 344 L 8.47 4.25 0.00 1.71 1.57 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.