NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7309 8.3049 120.6136 55.5107 33.7894 174.2868 2 I 4.1021 8.6360 126.5857 59.7939 39.1114 173.2234 3 R 4.9547 8.1882 126.4724 54.3819 32.3157 174.8443 4 L 5.2196 8.8680 124.3128 53.7976 44.0445 175.3458 5 I 5.1309 8.7127 121.3348 59.4083 41.4983 173.7781 6 F 5.0707 9.3143 128.4916 56.5446 40.6157 174.6041 7 L 5.0678 9.1581 124.9082 52.8263 43.9640 176.2549 8 D 4.8364 8.8934 123.9968 54.0342 42.0417 174.4448 9 I 3.9528 8.2171 118.7903 62.5152 39.4171 175.1591 10 D 4.2327 7.5220 117.8436 55.4616 41.5797 177.1160 11 K 4.0050 8.1832 122.9981 57.3230 29.9672 175.5388 12 T 4.4316 6.9256 112.0895 64.9697 71.1352 175.2334 13 L 4.1380 8.2186 124.4258 56.9101 42.8538 177.3813 14 I 4.6861 7.0830 109.9709 58.0504 40.7215 174.1832 15 P 4.4236 0.0000 0.0000 65.2443 32.5466 176.9469 16 G 4.0989 7.3210 103.5699 45.7064 0.0000 174.6317 17 Y 4.6701 8.9169 122.8398 57.7262 39.4882 175.5522 18 E 4.4644 8.1783 119.5284 55.4840 30.4514 175.2609 19 P 4.5755 0.0000 0.0000 65.5254 32.2888 178.3740 20 D 4.4461 8.4536 118.3120 57.3198 40.4911 177.4723 21 P 4.2804 0.0000 0.0000 65.2971 31.5005 177.8341 22 A 4.2261 8.4044 119.0223 53.3862 18.5350 179.3291 23 K 3.8103 7.8969 117.8996 59.4138 32.1513 177.3830 24 P 4.2402 0.0000 0.0000 65.4154 31.1805 178.7135 25 I 3.6214 7.6565 118.1389 64.4897 37.0448 178.3154 26 I 3.6784 7.9281 120.6435 64.4107 36.8900 178.2989 27 E 3.9337 8.3027 119.4137 59.4271 29.3282 179.1192 28 E 3.8938 8.3105 119.2641 59.3369 29.7174 178.8476 29 L 3.8945 8.1539 119.3486 57.6632 41.6140 179.7226 30 K 4.0464 8.3529 118.7533 59.5970 31.7747 179.2022 31 D 4.4392 8.1466 118.3174 57.3559 40.8134 177.9022 32 M 4.4542 7.9763 116.5737 55.3686 32.0698 176.7673 33 G 3.8169 8.0100 107.3428 46.1065 0.0000 173.6725 34 F 4.6126 8.2123 117.3656 56.3473 40.5589 175.3963 35 E 4.4745 9.0098 122.1000 55.2325 30.9431 175.2605 36 I 4.5026 8.2888 126.4065 60.0091 38.5526 175.4523 37 I 4.4380 8.3279 129.5979 59.3045 39.0357 175.5409 38 F 5.2056 8.4568 126.5835 57.9253 40.1365 174.7322 39 N 5.5680 9.4952 121.3198 52.4589 40.4821 172.7474 40 S 5.0335 9.0895 118.8061 55.8606 66.5462 174.4314 41 S 4.5614 8.7863 116.6394 59.7468 63.7557 174.6869 42 K 4.4132 8.0622 121.9853 56.4576 32.5010 176.6599 43 T 4.6120 9.1668 112.8765 61.2469 70.8912 175.7575 44 R 3.9320 8.6305 120.7548 59.6369 29.5792 178.2755 45 A 3.9991 7.9767 120.0144 55.1709 18.3086 179.3682 46 E 4.0047 8.2022 117.0111 59.8205 29.5947 179.6718 47 Q 4.2047 8.4236 118.1377 58.8775 28.6918 178.6158 48 E 3.8880 8.2812 119.9065 59.0831 29.2965 178.7620 49 Y 3.9704 7.6278 118.5495 60.9670 38.8784 177.5781 50 Y 3.7432 7.5306 117.2884 60.9092 37.8248 178.8796 51 R 4.1112 8.5037 119.3787 59.2983 30.0943 179.2972 52 K 3.9430 8.0531 118.1251 59.6116 31.8548 179.3316 53 E 3.8750 8.0129 117.7865 58.4800 29.3406 178.4324 54 L 4.5099 7.8285 115.8904 53.1167 42.7824 176.0043 55 E 3.7299 7.6576 117.3253 57.4336 27.5025 174.9217 56 V 4.2526 8.0435 117.5288 61.5094 32.9712 174.8238 57 E 4.7114 8.6871 125.6209 56.2303 30.4618 175.9154 58 T 3.8827 7.5973 109.7289 59.5639 70.3786 172.2208 59 P 4.6334 0.0000 0.0000 62.8921 32.1777 175.7973 60 F 5.3096 8.6040 115.6749 55.7573 42.3702 173.1277 61 I 5.2390 9.2546 120.0843 59.6541 40.4512 175.0996 62 S 5.2713 9.1309 121.0274 56.1534 66.3007 173.3898 63 E 4.2863 9.0360 117.2981 56.8128 27.8972 175.0612 64 N 4.0382 8.5064 110.1384 54.6242 36.6224 175.9281 65 G 4.0821 8.1044 99.0641 46.8795 0.0000 174.9771 66 S 4.1261 8.2315 117.8741 60.2571 63.4924 174.0320 67 A 4.6503 7.2918 119.9748 50.6053 22.4262 174.9653 68 I 4.6137 8.0991 122.0417 59.4057 40.1143 174.6224 69 F 4.6747 8.7275 126.2550 55.5611 41.0576 174.6577 70 I 4.6668 8.5958 125.3498 58.4536 39.9873 173.5298 71 P 4.8956 0.0000 0.0000 62.6759 32.4008 176.1119 72 K 4.0165 8.9382 123.0724 58.3559 32.2983 176.6580 73 G 3.9502 8.8434 111.7571 46.9325 0.0000 174.3006 74 Y 3.9412 8.2473 122.9279 59.1063 39.0833 175.5784 75 F 4.7747 7.9166 117.6624 54.9438 40.9179 175.5714 76 P 4.4856 0.0000 0.0000 62.7221 29.7008 175.0021 *87 Y 4.8696 7.3839 114.2515 59.0960 40.0725 175.9740 88 I 4.4357 9.2734 122.9097 60.0737 38.9931 175.0286 89 V 4.4259 8.4443 127.0107 61.0612 33.6600 174.9311 90 I 4.2989 8.1573 128.6751 59.5553 39.0574 174.2850 91 E 4.4064 8.5419 127.1937 55.7535 29.7680 176.7247 92 L 4.5305 8.9735 122.8636 53.9778 43.8231 177.8582 93 G 4.1824 7.7132 109.7199 44.7485 0.0000 172.6859 94 I 4.7445 8.0683 114.2587 58.5225 40.7027 175.4619 95 R 4.4721 8.4949 121.1357 56.2249 30.6836 178.4739 96 V 3.6957 8.5562 122.3022 64.7928 31.3690 178.6743 97 E 3.9571 8.1651 117.9460 59.2290 28.8977 179.1805 98 K 4.1150 7.9612 119.7196 59.2022 32.0184 179.4562 99 I 3.4347 7.6113 119.7962 64.3583 37.1536 178.5558 100 R 3.7624 8.2623 118.9527 58.8394 29.7949 179.0269 101 E 3.9703 7.9548 118.6846 59.3387 29.3383 178.8265 102 E 4.0982 7.8235 118.2273 58.9728 29.6974 178.6977 103 L 3.7579 7.8680 119.3976 57.3212 41.2738 179.2220 104 K 4.0288 7.9092 118.9352 59.6523 32.2026 178.7290 105 K 4.1511 7.5759 116.1731 58.9884 32.2176 178.6167 106 L 4.4983 7.7314 118.0174 55.4333 42.0533 178.2579 107 E 3.9768 8.3758 121.2292 59.4946 29.4660 178.1083 108 N 4.8514 8.1103 111.5902 53.4085 39.0044 175.6981 109 I 3.9445 7.8391 120.4944 62.8512 38.0010 176.3639 110 Y 4.6600 7.8950 115.0357 56.9024 38.6214 175.8229 111 G 4.4778 8.0657 107.1516 45.6244 0.0000 173.6723 112 L 4.6512 7.7983 118.6348 54.3023 42.6206 177.2689 113 K 4.7404 8.8324 122.4493 54.8711 35.1606 175.1037 114 Y 4.2480 8.6068 121.8999 55.3478 41.5065 175.2741 115 Y 4.1962 9.0308 115.7427 61.5165 38.0103 179.2715 116 G 3.8377 8.9501 107.6702 47.7241 0.0000 173.6078 117 N 4.8880 7.0832 115.4837 52.2836 37.6409 174.1831 118 S 4.9300 7.6371 113.6648 57.2216 66.4948 174.6311 119 T 4.3814 9.1523 113.8762 60.6396 71.2032 176.0161 120 K 3.8331 8.5513 121.2827 59.9585 32.0538 179.1757 121 E 3.8535 8.0668 117.9005 59.4809 29.4282 179.1445 122 E 3.5573 7.9102 118.4033 59.3134 29.4866 179.4083 123 I 3.2110 7.9028 120.1089 64.2654 37.1550 178.2992 124 E 3.8093 8.1677 119.3889 59.2153 29.0790 179.3676 125 K 3.7845 7.5102 118.1565 59.4104 32.2975 178.5457 126 F 4.4900 7.9511 117.2612 60.6855 38.8820 177.2118 127 T 4.6818 8.1623 107.6445 61.6857 69.1589 175.8283 128 G 3.9527 8.3706 109.1350 46.1490 0.0000 173.2296 129 M 3.1701 7.3384 118.7890 53.3392 32.8112 174.8916 130 P 4.2691 0.0000 0.0000 62.2022 32.3715 175.3222 131 P 4.1906 0.0000 0.0000 65.9038 31.0712 178.8750 132 E 3.9341 8.0393 113.8569 58.8507 29.7758 178.2503 133 L 3.9891 7.6434 119.1981 56.3392 41.8751 178.6670 134 V 3.5875 7.3444 118.8974 65.8950 31.0324 176.2151 135 P 4.2828 0.0000 0.0000 65.4263 31.5558 178.2218 136 L 4.0910 7.9593 117.8636 57.5702 41.3137 179.2792 137 A 4.1374 7.8459 119.4403 55.0677 18.5062 178.7888 138 M 4.0527 7.7069 115.3833 56.3270 33.5535 177.2168 139 E 4.3025 7.3686 120.8309 54.9688 28.1920 175.9841 140 R 4.2946 7.4180 118.7264 55.5191 31.8993 176.6472 141 E 4.2798 9.5337 120.3241 57.1770 31.7502 177.3046 142 Y 5.5868 8.8480 111.6732 56.1028 40.1422 174.2380 143 S 4.8584 7.6632 113.0357 57.9456 65.8549 173.3065 144 E 4.9587 9.0261 119.0502 54.9037 34.0194 174.9645 145 T 4.9424 8.6008 116.7394 61.9309 72.1453 173.6012 146 I 4.0855 8.2415 127.3956 59.9717 37.0336 175.7518 147 F 4.0058 8.2856 128.3863 60.0829 39.3813 175.5487 148 E 4.8199 7.8219 114.2787 55.7121 32.3897 174.2646 149 W 5.9999 8.2402 116.0188 55.8699 30.9992 174.4726 150 S 4.8132 9.5062 114.2490 58.3107 64.2785 173.7538 151 R 4.9746 8.2377 120.1919 55.3081 32.8894 174.1338 152 D 4.6629 8.8473 125.0225 54.8576 41.2960 175.9055 153 G 4.2904 8.3137 108.0807 45.7024 0.0000 176.4036 154 W 3.3064 7.1934 117.8923 58.8919 27.9066 177.7673 155 E 3.2109 5.9000 119.5291 58.9454 28.9610 178.3519 156 E 3.7390 7.5475 117.8992 59.4627 29.2511 179.5164 157 V 3.5524 6.9544 116.2912 65.9566 31.8929 177.8365 158 L 4.2467 8.0676 118.9766 57.6454 41.4767 179.5236 159 V 4.1022 7.9229 119.9196 65.6608 31.3037 177.9095 160 E 4.2110 8.1503 116.2454 58.2235 29.3311 178.3670 161 G 4.0235 7.7881 104.6139 44.5113 0.0000 174.5254 162 G 3.7074 8.0622 109.3258 44.6231 0.0000 173.7489 163 F 4.7258 7.5961 118.0680 56.2744 41.6663 174.5094 164 K 4.7541 9.1330 119.9362 54.7560 34.6637 175.8091 165 V 4.8479 8.3076 123.1219 61.5291 33.9507 174.6844 166 T 4.7910 9.1250 124.5921 61.7569 71.9940 173.1262 167 M 4.2296 8.9467 126.5258 55.6621 32.6548 175.5221 168 G 4.8006 8.5426 116.4530 45.0507 0.0000 174.2416 169 S 4.3172 8.6898 114.7447 60.9259 63.2877 175.2572 170 R 4.1436 7.5465 112.7282 56.8295 33.0908 174.9660 171 F 5.0307 7.6325 113.7118 55.5042 43.5330 173.1049 172 Y 4.8552 8.7112 119.0810 58.6690 39.1761 175.1237 173 T 5.1271 9.3440 119.4807 61.8604 72.0463 173.0901 174 V 4.8612 8.8855 126.9086 61.7493 33.7043 174.4530 175 H 5.1278 9.1626 122.6942 54.7614 32.2795 172.3389 176 G 4.0201 8.5109 109.6485 45.8320 0.0000 174.0133 177 N 4.6341 8.5109 114.7140 53.0236 38.4363 173.9601 178 S 4.5609 7.6274 111.3874 56.8349 66.1554 171.5039 179 D 5.1434 7.9739 121.6039 52.1025 42.8524 175.9874 180 K 4.0152 8.6435 118.6434 59.4233 31.8188 179.8548 181 G 3.8768 7.9716 106.9567 46.9608 0.0000 175.5388 182 K 3.8906 8.8786 122.5706 59.1629 32.1764 178.7532 183 A 3.9636 7.9180 120.3833 54.9803 18.2988 179.4121 184 A 3.8234 7.8590 119.3241 55.0624 18.2135 179.5787 185 K 3.8622 8.5188 118.4021 60.0080 32.0303 179.0389 186 I 3.7861 7.4595 118.1301 64.2890 37.3177 177.9317 187 L 4.4410 8.3042 121.3899 57.9989 41.9551 178.6523 188 L 4.3677 8.8196 120.9933 58.4107 42.0299 178.7288 189 D 4.4164 8.1583 118.8651 57.2282 40.4189 178.7783 190 F 3.8280 7.9447 117.8392 60.5082 39.0804 177.0184 191 Y 4.3014 8.0779 116.0131 60.9088 37.7039 178.1096 192 K 4.5307 8.4158 120.8494 58.7437 31.9080 178.8795 193 R 4.0150 7.5305 116.1115 58.1221 30.0495 177.3322 194 L 4.6176 8.9882 117.4058 55.3162 42.4873 176.6011 195 G 3.9416 7.0049 105.1879 45.4568 0.0000 171.2990 196 Q 4.3225 7.9541 117.9576 55.9389 30.0881 175.5501 197 I 5.0665 8.2696 121.9186 59.5263 41.1874 174.6221 198 E 4.7520 9.3522 127.9107 54.7014 31.3646 174.4394 199 S 5.5619 9.1580 122.7509 57.1959 65.6098 172.9297 200 Y 5.9907 9.5623 118.8595 55.5305 42.5436 174.2486 201 A 5.4232 8.6998 121.4134 50.8546 23.2521 175.2219 202 V 4.9499 9.4510 122.3787 61.4254 34.7845 174.8940 203 G 4.7628 9.1137 114.5117 45.9781 0.0000 171.8515 204 D 4.9034 9.9702 115.3604 53.0987 42.5604 174.2271 205 S 4.2885 7.8861 113.1716 56.5453 65.9347 173.2391 206 Y 2.6046 7.8403 117.5376 60.5610 37.4049 178.3763 207 N 4.5116 7.8100 115.5117 54.5065 37.8033 176.1745 208 D 4.3703 7.9332 119.4629 55.6062 41.0293 178.1952 209 F 3.8365 7.3980 118.6670 60.3514 39.0832 175.8147 210 P 4.2877 0.0000 0.0000 65.6243 30.9089 178.6495 211 M 3.9361 7.7908 117.8661 58.3691 31.8742 178.4740 212 F 4.4627 7.6441 118.0288 60.8458 38.8646 177.0074 213 E 4.2317 8.2220 115.2247 57.4699 29.5806 177.1581 214 V 4.3266 7.8788 117.2555 62.2867 32.7853 175.0161 215 V 4.6313 7.1120 110.6383 60.1578 34.5467 175.7493 216 D 4.4659 8.7823 121.4283 57.0582 41.0225 176.9447 217 K 4.4704 8.0840 119.7095 54.3181 35.2797 174.6653 218 V 4.8421 7.8760 125.1719 61.0627 34.9720 173.9115 219 F 5.2422 9.2553 125.7089 55.6600 42.9861 173.9756 220 I 4.9876 8.6979 123.0931 59.5241 40.1705 174.7508 221 V 4.1617 8.7794 128.8408 64.1250 31.8763 174.2144 222 G 3.8175 8.8695 115.5244 44.4404 0.0000 172.4795 223 S 4.4224 8.4360 111.7270 58.8188 63.9672 174.2714 224 L 3.9296 7.9517 123.1950 55.5739 42.0401 176.1084 225 K 4.5645 8.5061 125.0723 55.5813 33.9761 175.4420 226 H 4.5853 8.1944 120.1363 54.2613 32.5604 173.4630 227 K 3.6734 7.9629 125.1141 60.3716 32.1272 177.9681 228 K 4.2016 7.8424 114.7181 56.7542 31.8703 176.4220 229 A 4.6511 7.5575 120.8063 49.9818 21.4556 176.1899 230 Q 4.2951 8.2905 123.2410 54.7497 30.5604 174.5455 231 N 5.2320 8.6736 124.0387 53.2042 39.9986 174.6871 232 V 4.7256 8.7649 114.7918 60.0888 36.3771 176.1911 233 S 4.5479 8.6260 116.3952 60.3115 63.1921 174.3839 234 S 4.5054 7.5030 113.5432 56.1410 66.1994 174.5169 235 I 3.6687 8.1513 123.6046 63.8001 37.6625 177.7139 236 I 3.6089 7.8203 121.0172 64.4094 36.8617 177.8367 237 D 4.3086 8.0265 119.0719 57.4188 40.7024 178.6731 238 V 2.9235 7.1667 117.6186 66.0281 31.3081 178.0909 239 L 3.7457 7.3991 118.1093 57.6204 41.1947 179.2693 240 E 3.8711 7.7342 117.3828 59.4002 29.7773 179.1768 241 V 3.6278 7.8256 118.2186 66.2137 31.3723 177.9243 242 I 3.8055 7.4691 117.9172 64.5321 37.0224 178.0786 243 K 3.9709 7.6469 118.1189 59.2208 31.9394 176.4564 244 H 4.6292 7.9957 120.0249 55.8440 28.8679 174.5890 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 1 M 8.30 4.73 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 2 I 8.64 4.10 1.91 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.90 0.00 0.00 3 R 8.19 4.95 0.00 0.76 0.69 0.00 2.83 0.00 0.00 2.82 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.34 0.00 4 L 8.87 5.22 0.00 1.48 1.42 0.15 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.71 5.13 1.80 0.00 0.00 0.54 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 1.85 0.81 0.00 0.00 6 F 9.31 5.07 0.00 3.21 3.08 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 7 L 9.16 5.07 0.00 1.86 1.70 1.03 0.65 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 8 D 8.89 4.84 0.00 2.89 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 9 I 8.22 3.95 1.58 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.19 0.21 0.00 0.00 10 D 7.52 4.23 0.00 2.61 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.18 4.01 0.00 2.07 1.87 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.47 7.81 12 T 6.93 4.43 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 1.30 0.00 0.00 13 L 8.22 4.14 0.00 1.64 1.63 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.08 4.69 1.80 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.69 0.87 0.00 0.00 15 P 0.00 4.42 0.00 2.03 2.12 0.00 3.58 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 16 G 7.32 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.92 4.67 0.00 3.06 3.17 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 18 E 8.18 4.46 0.00 2.03 1.98 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 2.39 2.51 0.00 19 P 0.00 4.58 0.00 2.18 2.20 0.00 3.75 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.17 0.00 20 D 8.45 4.45 0.00 2.78 2.77 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 21 P 0.00 4.28 0.00 2.00 2.12 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.17 0.00 22 A 8.40 4.23 1.32 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 0.00 0.00 0.00 23 K 7.90 3.81 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.59 7.81 24 P 0.00 4.24 0.00 2.13 2.08 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 25 I 7.66 3.62 1.99 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 1.60 0.94 0.82 0.00 0.00 26 I 7.93 3.68 2.02 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 1.76 1.03 0.96 0.00 0.00 27 E 8.30 3.93 0.00 2.16 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 2.33 2.43 0.00 28 E 8.31 3.89 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 29 L 8.15 3.89 0.00 1.75 1.56 0.72 0.27 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 30 K 8.35 4.05 0.00 2.02 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 31 D 8.15 4.44 0.00 2.81 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 32 M 7.98 4.45 0.00 2.23 2.50 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.60 0.00 33 G 8.01 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 34 F 8.21 4.61 0.00 3.00 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 35 E 9.01 4.47 0.00 1.78 1.69 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 2.28 2.45 0.00 36 I 8.29 4.50 1.69 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 1.27 0.51 0.74 0.00 0.00 37 I 8.33 4.44 1.56 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.61 1.16 0.00 0.00 38 F 8.46 5.21 0.00 3.16 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 39 N 9.50 5.57 0.00 3.07 2.83 0.00 0.00 6.50 6.94 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 40 S 9.09 5.03 0.00 3.93 3.69 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 41 S 8.79 4.56 0.00 4.13 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 0.00 42 K 8.06 4.41 0.00 1.94 1.98 0.00 1.59 0.00 0.00 1.91 0.00 0.00 2.77 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.60 1.43 7.81 43 T 9.17 4.61 4.37 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 1.22 0.00 0.00 44 R 8.63 3.93 0.00 1.50 2.03 0.00 2.94 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 45 A 7.98 4.00 1.40 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 0.00 0.00 46 E 8.20 4.00 0.00 2.35 2.23 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 2.39 2.45 0.00 47 Q 8.42 4.20 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.74 0.00 48 E 8.28 3.89 0.00 2.14 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 2.15 2.54 0.00 49 Y 7.63 3.97 0.00 2.94 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 50 Y 7.53 3.74 0.00 3.04 2.79 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 0.00 0.00 0.00 0.00 51 R 8.50 4.11 0.00 1.91 2.17 0.00 2.21 0.00 0.00 2.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.99 0.00 52 K 8.05 3.94 0.00 1.91 1.80 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.52 7.81 53 E 8.01 3.87 0.00 1.75 1.79 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 0.00 1.63 1.47 0.00 54 L 7.83 4.51 0.00 1.81 1.76 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.66 3.73 0.00 2.05 2.00 0.00 0.00 0.00 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 2.21 0.00 56 V 8.04 4.25 2.00 0.00 0.00 0.00 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 57 E 8.69 4.71 0.00 2.03 1.98 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 2.23 2.28 0.00 58 T 7.60 3.88 4.10 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 0.00 0.00 0.00 1.27 0.00 0.00 59 P 0.00 4.63 0.00 1.97 1.97 0.00 3.42 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.40 0.00 60 F 8.60 5.31 0.00 3.41 3.06 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 61 I 9.25 5.24 2.15 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.28 1.00 0.00 0.00 62 S 9.13 5.27 0.00 4.33 4.35 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 63 E 9.04 4.29 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 64 N 8.51 4.04 0.00 2.85 2.69 0.00 0.00 6.99 7.54 0.00 0.00 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 G 8.10 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 66 S 8.23 4.13 0.00 3.93 3.53 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 67 A 7.29 4.65 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 68 I 8.10 4.61 1.68 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 1.19 0.62 0.79 0.00 0.00 69 F 8.73 4.67 0.00 1.51 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 0.00 0.00 0.00 70 I 8.60 4.67 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.80 0.92 0.00 0.00 89 V 8.44 4.43 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 0.36 0.00 0.00 1.15 0.00 0.00 90 I 8.16 4.30 1.73 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.46 0.87 0.00 0.00 91 E 8.54 4.41 0.00 1.82 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 2.28 2.32 0.00 92 L 8.97 4.53 0.00 1.44 1.58 0.85 0.82 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 93 G 7.71 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 0.00 0.00 0.00 0.00 94 I 8.07 4.74 1.97 0.00 0.00 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 1.64 0.91 0.93 0.00 0.00 95 R 8.49 4.47 0.00 1.92 2.30 0.00 3.36 0.00 0.00 3.43 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.61 0.00 96 V 8.56 3.70 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 0.94 0.00 0.00 0.96 0.00 0.00 97 E 8.17 3.96 0.00 2.20 2.26 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 2.38 2.36 0.00 98 K 7.96 4.11 0.00 2.05 2.06 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.54 7.81 99 I 7.61 3.43 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.79 0.58 0.00 0.00 100 R 8.26 3.76 0.00 1.84 2.02 0.00 3.15 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 101 E 7.95 3.97 0.00 2.30 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 2.35 2.51 0.00 102 E 7.82 4.10 0.00 2.18 1.73 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 2.31 2.28 0.00 103 L 7.87 3.76 0.00 1.16 0.79 -0.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 104 K 7.91 4.03 0.00 1.98 2.03 0.00 1.95 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.57 7.81 105 K 7.58 4.15 0.00 1.99 1.90 0.00 1.95 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.68 7.81 106 L 7.73 4.50 0.00 1.70 1.99 0.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.38 3.98 0.00 2.26 2.18 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 2.38 2.59 0.00 108 N 8.11 4.85 0.00 2.76 2.83 0.00 0.00 6.85 7.45 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 0.00 109 I 7.84 3.94 1.75 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 1.21 0.49 0.23 0.00 0.00 110 Y 7.89 4.66 0.00 3.15 3.27 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 0.00 111 G 8.07 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 0.00 0.00 0.00 0.00 112 L 7.80 4.65 0.00 1.72 1.60 0.69 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.83 4.74 0.00 1.48 1.59 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.37 1.76 7.81 114 Y 8.61 4.25 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 0.00 115 Y 9.03 4.20 0.00 3.53 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 0.00 116 G 8.95 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 0.00 0.00 0.00 117 N 7.08 4.89 0.00 2.56 2.31 0.00 0.00 6.74 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 S 7.64 4.93 0.00 3.91 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 0.00 119 T 9.15 4.38 4.40 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 1.18 0.00 0.00 120 K 8.55 3.83 0.00 1.78 1.89 0.00 1.65 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.55 7.81 121 E 8.07 3.85 0.00 1.96 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 2.34 2.40 0.00 122 E 7.91 3.56 0.00 2.21 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 2.10 2.22 0.00 123 I 7.90 3.21 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.61 0.92 0.00 0.00 124 E 8.17 3.81 0.00 2.05 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 2.23 2.47 0.00 125 K 7.51 3.78 0.00 1.51 1.50 0.00 1.56 0.00 0.00 1.22 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.31 7.81 126 F 7.95 4.49 0.00 2.35 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 0.00 0.00 0.00 127 T 8.16 4.68 4.45 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 1.17 0.00 0.00 128 G 8.37 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 0.00 129 M 7.34 3.17 0.00 1.70 1.73 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.58 0.00 130 P 0.00 4.27 0.00 2.09 1.95 0.00 3.28 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 2.19 2.15 0.00 131 P 0.00 4.19 0.00 2.10 2.06 0.00 3.55 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.30 0.00 132 E 8.04 3.93 0.00 2.03 2.03 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 2.14 2.26 0.00 133 L 7.64 3.99 0.00 1.72 1.57 0.90 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 134 V 7.34 3.59 2.15 0.00 0.00 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 0.86 0.00 0.00 135 P 0.00 4.28 0.00 2.00 2.07 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 136 L 7.96 4.09 0.00 1.70 1.74 0.63 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 137 A 7.85 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 138 M 7.71 4.05 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.78 0.00 139 E 7.37 4.30 0.00 2.12 1.88 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 2.29 2.42 0.00 140 R 7.42 4.29 0.00 1.73 1.94 0.00 2.30 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 141 E 9.53 4.28 0.00 1.41 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 0.00 0.00 0.00 2.06 2.15 0.00 142 Y 8.85 5.59 0.00 2.94 3.06 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 0.00 143 S 7.66 4.86 0.00 4.04 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 0.00 144 E 9.03 4.96 0.00 1.71 1.67 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 2.19 2.22 0.00 145 T 8.60 4.94 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 1.08 0.00 0.00 146 I 8.24 4.09 1.76 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.10 0.44 0.00 0.00 147 F 8.29 4.01 0.00 1.69 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 0.00 148 E 7.82 4.82 0.00 1.85 1.94 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 2.14 2.27 0.00 149 W 8.24 6.00 0.00 3.49 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 0.00 150 S 9.51 4.81 0.00 3.94 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 0.00 151 R 8.24 4.97 0.00 1.89 2.03 0.00 3.31 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 152 D 8.85 4.66 0.00 2.81 2.57 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 0.00 0.00 0.00 0.00 153 G 8.31 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 0.00 0.00 0.00 0.00 154 W 7.19 3.31 0.00 3.20 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 0.00 155 E 5.90 3.21 0.00 1.16 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 0.00 0.00 0.00 1.89 1.86 0.00 156 E 7.55 3.74 0.00 2.02 1.86 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 2.24 2.25 0.00 157 V 6.95 3.55 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 0.87 0.00 0.00 0.92 0.00 0.00 158 L 8.07 4.25 0.00 1.85 1.74 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 159 V 7.92 4.10 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 1.34 0.00 0.00 0.88 0.00 0.00 160 E 8.15 4.21 0.00 1.98 1.98 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 2.31 2.45 0.00 161 G 7.79 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 162 G 8.06 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 0.00 163 F 7.60 4.73 0.00 3.17 3.06 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 0.00 164 K 9.13 4.75 0.00 1.36 1.53 0.00 1.74 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.36 7.81 165 V 8.31 4.85 1.90 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 0.61 0.00 0.00 0.90 0.00 0.00 166 T 9.12 4.79 4.35 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 1.25 0.00 0.00 167 M 8.95 4.23 0.00 1.99 1.49 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.48 0.00 168 G 8.54 4.80 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 0.00 0.00 0.00 169 S 8.69 4.32 0.00 3.86 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 0.00 170 R 7.55 4.14 0.00 1.66 1.03 0.00 3.35 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 171 F 7.63 5.03 0.00 3.20 3.21 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 0.00 172 Y 8.71 4.86 0.00 3.20 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 0.00 173 T 9.34 5.13 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 1.31 0.00 0.00 174 V 8.89 4.86 1.95 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 0.78 0.00 0.00 0.84 0.00 0.00 175 H 9.16 5.13 0.00 3.34 3.43 0.00 5.50 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 0.00 176 G 8.51 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 177 N 8.51 4.63 0.00 2.69 2.80 0.00 0.00 6.44 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 0.00 178 S 7.63 4.56 0.00 3.92 3.73 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 0.00 179 D 7.97 5.14 0.00 2.96 2.77 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 0.00 180 K 8.64 4.02 0.00 1.73 1.82 0.00 1.76 0.00 0.00 1.93 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.70 1.48 7.81 181 G 7.97 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 0.00 182 K 8.88 3.89 0.00 1.76 1.80 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.45 7.81 183 A 7.92 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 A 7.86 3.82 0.69 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 0.00 0.00 185 K 8.52 3.86 0.00 1.95 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 186 I 7.46 3.79 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.75 1.04 0.00 0.00 187 L 8.30 4.44 0.00 1.97 2.15 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 188 L 8.82 4.37 0.00 2.25 1.82 1.21 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 189 D 8.16 4.42 0.00 2.79 2.55 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 0.00 0.00 0.00 0.00 190 F 7.94 3.83 0.00 2.80 1.62 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 0.00 191 Y 8.08 4.30 0.00 3.38 3.14 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 0.00 0.00 0.00 0.00 192 K 8.42 4.53 0.00 2.00 1.90 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.63 7.81 193 R 7.53 4.02 0.00 1.75 2.03 0.00 3.15 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 194 L 8.99 4.62 0.00 1.91 1.81 1.14 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 195 G 7.00 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 0.00 196 Q 7.95 4.32 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 197 I 8.27 5.07 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.55 1.02 0.00 0.00 198 E 9.35 4.75 0.00 2.02 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 2.33 2.20 0.00 199 S 9.16 5.56 0.00 4.17 4.09 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 0.00 200 Y 9.56 5.99 0.00 2.98 3.06 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 0.00 201 A 8.70 5.42 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 0.00 0.00 0.00 0.00 0.00 0.00 202 V 9.45 4.95 2.16 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 0.99 0.00 0.00 0.95 0.00 0.00 203 G 9.11 4.76 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 0.00 0.00 0.00 204 D 9.97 4.90 0.00 2.76 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 0.00 205 S 7.89 4.29 0.00 3.70 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 0.00 206 Y 7.84 2.60 0.00 3.13 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 0.00 207 N 7.81 4.51 0.00 2.96 3.06 0.00 0.00 6.86 7.95 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 0.00 208 D 7.93 4.37 0.00 2.60 2.38 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 0.00 209 F 7.40 3.84 0.00 3.03 3.03 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 0.00 210 P 0.00 4.29 0.00 2.15 2.19 0.00 3.60 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 211 M 7.79 3.94 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 212 F 7.64 4.46 0.00 2.99 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 0.00 213 E 8.22 4.23 0.00 1.97 2.03 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 2.59 2.36 0.00 214 V 7.88 4.33 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 0.83 0.00 0.00 0.98 0.00 0.00 215 V 7.11 4.63 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 1.10 0.00 0.00 1.18 0.00 0.00 216 D 8.78 4.47 0.00 2.56 2.60 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 0.00 217 K 8.08 4.47 0.00 1.47 0.98 0.00 1.13 0.00 0.00 1.36 0.00 0.00 2.39 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.25 7.81 218 V 7.88 4.84 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 -0.43 0.00 0.00 0.87 0.00 0.00 219 F 9.26 5.24 0.00 2.97 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 0.00 220 I 8.70 4.99 1.89 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.54 1.09 0.00 0.00 221 V 8.78 4.16 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 0.71 0.00 0.00 0.94 0.00 0.00 222 G 8.87 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 0.00 223 S 8.44 4.42 0.00 4.00 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 0.00 224 L 7.95 3.93 0.00 1.58 1.70 0.12 0.73 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 0.00 225 K 8.51 4.56 0.00 1.81 1.71 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.65 7.81 226 H 8.19 4.59 0.00 2.78 2.94 0.00 5.89 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 K 7.96 3.67 0.00 1.55 1.71 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.35 7.81 228 K 7.84 4.20 0.00 1.76 1.78 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 229 A 7.56 4.65 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 0.00 230 Q 8.29 4.30 0.00 1.84 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 231 N 8.67 5.23 0.00 2.63 2.86 0.00 0.00 6.91 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 0.00 232 V 8.76 4.73 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 0.90 0.00 0.00 1.07 0.00 0.00 233 S 8.63 4.55 0.00 3.93 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 0.00 234 S 7.50 4.51 0.00 3.84 3.68 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 0.00 235 I 8.15 3.67 2.03 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 1.56 0.94 0.85 0.00 0.00 236 I 7.82 3.61 1.83 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 1.48 0.90 0.87 0.00 0.00 237 D 8.03 4.31 0.00 2.82 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 0.00 238 V 7.17 2.92 1.91 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 -0.02 0.00 0.00 0.70 0.00 0.00 239 L 7.40 3.75 0.00 1.71 1.58 0.73 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 0.00 240 E 7.73 3.87 0.00 2.06 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 2.32 2.45 0.00 241 V 7.83 3.63 2.32 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 1.30 0.00 0.00 1.06 0.00 0.00 242 I 7.47 3.81 1.85 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.60 0.87 0.00 0.00 243 K 7.65 3.97 0.00 1.97 2.00 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.83 1.68 7.81 244 H 8.00 4.63 0.00 3.19 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.