NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4659 8.3193 116.7961 57.6898 64.3054 173.2654 3 P 4.5215 0.0000 0.0000 61.9798 32.2253 174.7848 4 G 3.8376 8.3846 108.1617 48.5945 0.0000 174.2791 5 S 5.4304 7.9105 115.2413 55.7805 66.9769 172.3719 6 V 4.8645 8.5382 120.1831 61.4709 35.2783 173.7260 7 V 5.0035 8.9112 127.5285 61.1479 34.3499 174.1503 8 V 4.9516 9.3605 129.0003 61.3173 33.5068 174.9586 9 T 4.7683 7.9963 118.3662 60.1974 70.0798 174.7559 10 G 3.8799 8.1719 109.0056 47.1871 0.0000 173.8559 11 A 4.7538 8.0900 115.6340 51.8307 20.2146 177.5830 12 N 4.4213 8.0622 118.3011 57.2956 39.1985 174.4517 13 R 4.5464 7.7773 113.8730 56.2484 34.8151 176.2763 14 G 3.9026 8.5343 106.6767 47.5335 0.0000 176.7868 15 I 3.8676 8.4435 121.1604 63.9458 37.0286 177.9162 16 G 3.8819 8.0507 107.6776 47.2823 0.0000 175.1881 17 L 4.0815 7.9918 123.1786 57.5472 41.7069 179.1198 18 G 3.7311 7.8585 105.4839 47.4888 0.0000 175.6684 19 L 4.0069 8.0792 121.2014 57.4749 41.5752 179.6104 20 V 3.5929 7.8497 118.1927 65.9369 31.1859 178.1117 21 Q 4.0523 7.9308 117.8433 58.8102 28.1499 178.3410 22 Q 4.0063 7.7488 118.4470 58.5651 28.6194 178.6300 23 L 4.0391 8.1847 120.6431 57.8198 41.4781 179.8085 24 V 3.6776 7.4549 110.8754 63.7801 31.5215 178.1767 25 K 4.3932 7.6281 116.3482 57.0305 32.3711 176.5041 26 D 4.7051 7.9582 120.2736 52.1439 40.3911 176.6427 27 K 4.0738 8.4151 126.4497 59.1239 32.3316 178.5970 28 N 4.4888 7.7353 114.1035 54.9500 38.5976 175.1596 29 I 4.3469 7.3189 119.6715 60.7978 38.3186 175.7895 30 R 4.3143 8.4896 124.0808 58.4128 30.9898 176.7078 31 H 5.3073 8.0319 114.7936 53.9579 32.9685 172.7057 32 I 4.7889 8.6613 122.1666 59.8055 40.6312 174.3484 33 I 4.9129 9.4914 129.8623 59.5528 39.2572 174.7341 34 A 5.3399 9.6051 129.6749 50.2456 21.9936 175.0456 35 T 5.7063 8.9412 111.0209 59.3763 72.6802 172.8617 36 A 4.8820 8.0315 121.9543 50.2897 22.1654 177.5119 37 R 3.9222 8.7777 121.2532 59.1457 30.2711 176.3115 38 D 4.4566 7.6676 117.2249 51.8716 41.5043 175.3801 39 V 3.8027 8.3373 128.0563 64.6056 31.1092 177.8118 40 E 4.0826 7.7456 118.5134 58.0966 29.3599 178.0886 41 K 4.4441 7.9098 115.9611 55.9093 33.1303 177.5972 42 A 4.2720 8.0518 123.8413 55.1758 18.3465 181.0694 43 T 3.2343 8.3332 103.5858 63.3481 71.0909 173.8310 44 E 3.9825 8.0545 122.8939 58.5332 30.1943 178.8199 45 L 4.1139 7.9378 119.5963 58.0034 42.2951 177.9538 46 K 3.9540 8.2580 116.4341 59.2930 32.1422 177.5456 47 S 4.1597 8.1219 113.4413 57.8287 63.6417 173.1252 *50 D 4.4436 8.2877 122.1785 54.3138 42.0432 174.7019 51 S 4.6190 8.7887 115.9577 58.9237 65.2355 175.2859 52 R 4.7333 8.2023 116.7069 56.2667 30.3322 175.9191 53 V 4.8253 7.4349 118.7249 60.9771 33.5758 174.7451 54 H 4.8330 9.7292 120.8173 54.0188 32.0735 172.6876 55 V 4.7386 8.6628 123.4879 61.4533 32.6419 174.3353 56 L 5.0805 9.0233 128.6075 52.0366 45.0371 174.6431 57 P 4.9213 0.0000 0.0000 63.0090 32.7570 175.5025 58 L 4.1318 8.1455 121.5186 54.9602 45.5466 175.2501 59 T 4.4455 8.5599 124.2987 60.9433 68.2967 174.7084 60 V 3.1820 8.2190 119.4909 64.5507 31.8527 177.9307 61 T 4.0782 7.7773 106.7079 62.2973 69.3035 174.0082 62 C 4.6203 8.6879 124.9023 57.7221 33.1205 173.5968 63 D 4.3840 8.6282 128.6223 57.4416 40.4913 178.4196 64 K 4.0110 8.0832 118.4604 59.8229 32.0293 179.0007 65 S 4.2319 8.1171 112.5137 61.0760 62.3084 176.3961 66 L 4.0859 7.8520 121.8726 58.1054 41.5980 178.9453 67 D 4.4240 8.9299 119.4711 57.6124 40.5758 178.7386 68 T 3.8216 8.3678 116.7032 66.8675 68.5337 175.9871 69 F 4.1705 8.1375 122.2744 61.5724 39.2480 177.6318 70 V 3.2446 7.6281 117.0938 65.9901 31.4195 177.9516 71 S 4.0673 7.8304 114.8042 61.6844 62.6155 177.0253 72 K 3.8834 7.6430 120.7999 59.5301 31.7997 179.8273 73 V 3.5125 7.2044 112.2370 64.3498 31.4497 178.8261 74 G 3.6650 8.0275 105.4348 47.6464 0.0000 175.3717 75 E 3.8834 7.8096 120.5979 59.3405 29.8377 178.6819 76 I 3.7184 7.7262 118.7213 64.1990 37.0849 178.2862 77 V 3.9894 8.4391 112.9363 60.4444 31.8061 177.6046 78 G 3.8603 8.4115 106.8555 47.0062 0.0000 176.0927 79 S 4.8753 8.6202 115.5019 57.0154 63.3939 172.3737 80 D 4.3349 7.1263 128.0046 54.6244 43.5283 177.2263 *83 S 4.5316 8.8177 118.6021 58.5847 64.5788 172.9845 84 L 4.9491 7.7204 122.8331 53.6543 45.2311 174.0783 85 L 4.7477 9.3032 130.5356 53.8335 43.8410 175.5253 86 I 4.6213 8.7993 129.8554 59.9136 38.4324 175.0642 87 N 4.8581 9.6168 127.5424 52.7271 38.7798 175.5856 88 N 4.9688 9.6209 120.9200 52.3261 40.8473 174.4549 89 A 3.9931 8.1657 121.0526 52.9931 18.8293 176.8458 90 G 4.0041 8.0286 110.1698 46.3999 0.0000 172.2874 91 V 4.3535 8.2891 116.5438 60.9954 34.0449 171.8881 92 L 4.9058 8.7449 122.6716 53.3024 43.6603 175.4180 93 L 4.7526 8.5518 125.9616 52.5474 43.6206 176.3980 94 S 4.4219 8.7878 119.8015 59.7975 63.5265 173.4855 95 Y 4.3356 8.8239 121.2449 57.0275 42.9705 172.9067 96 G 4.4956 8.4195 114.0735 44.0132 0.0000 173.5954 97 T 3.9243 8.2464 109.9873 63.9240 68.6822 175.0020 98 N 4.7572 7.8168 117.5852 53.1079 38.8832 174.7183 99 T 4.0163 7.2709 115.8488 62.3214 69.1605 174.2417 100 E 3.7893 8.7712 125.7307 56.0145 29.7380 174.6029 101 P 4.2265 0.0000 0.0000 63.2586 31.6541 175.8231 102 N 4.8734 9.3320 121.2570 50.9489 41.7170 174.6704 103 R 3.8704 8.6156 128.1091 59.5173 30.4483 177.8619 104 A 3.9246 8.0838 120.1156 55.3229 18.3268 179.6220 105 V 3.4889 7.6901 116.6606 66.0679 31.5986 178.4610 106 I 3.3967 7.0480 117.8778 64.1959 36.9702 178.2111 107 A 3.9435 8.0718 121.8804 55.0736 18.1464 179.3647 108 E 3.8061 8.2658 117.7867 59.3704 29.7541 178.6042 109 Q 3.9792 7.8944 119.5283 59.4412 29.0477 178.5798 110 L 3.9683 7.9685 119.7805 57.5302 41.6981 178.8666 111 D 4.2228 8.5869 118.4244 57.2598 40.9467 178.6134 112 V 3.5075 7.9444 117.8376 66.1340 31.7441 177.3882 113 N 4.5541 7.9550 114.0385 55.1187 38.5837 174.9237 114 T 4.1720 8.5817 116.0038 63.8957 71.4155 176.2722 115 T 3.7601 8.1865 113.5196 65.7947 68.9779 176.2792 116 S 4.1011 8.3939 118.8305 61.0550 62.8368 177.1858 117 V 3.5512 7.5276 120.1041 65.8645 31.4381 178.0195 118 V 2.7595 7.4093 117.8777 65.6619 31.1993 177.7302 119 L 3.9158 8.1100 118.9859 57.8304 41.2991 179.1696 120 L 3.9983 7.3845 118.2627 58.7363 42.0956 178.8138 121 T 4.1184 7.9438 115.4072 66.7481 68.3302 176.7209 122 Q 4.1268 8.2822 119.8559 58.9083 28.6236 178.5175 123 K 4.4821 8.1694 114.9864 57.2703 32.0380 177.3158 124 L 4.8026 7.6733 117.4810 53.3823 44.0188 178.2450 125 L 3.9997 8.3022 120.9405 57.4483 41.5016 177.4422 126 P 4.2823 0.0000 0.0000 65.7264 31.1009 178.6654 127 L 4.0390 7.7749 115.7997 57.8384 41.9059 179.0493 128 L 4.0878 8.3633 119.4367 57.7489 41.6257 179.4678 129 K 3.8991 9.0014 119.2375 59.7535 31.8493 178.8696 130 N 4.2757 8.3599 116.5589 56.7114 38.9184 176.5273 131 A 4.1184 7.8754 121.0095 54.8289 18.5310 179.1818 132 A 4.1128 7.8048 118.5366 54.4704 19.3772 178.8067 133 S 4.5550 7.7063 113.9803 57.7586 62.0746 174.6088 134 K 4.7825 7.3167 114.9611 56.2633 34.5194 176.8362 135 E 4.7562 7.5249 128.5107 57.1235 33.9003 176.0738 *138 D 4.6359 9.1709 113.3841 53.9797 42.4441 175.4936 139 Q 4.4619 7.8381 114.6891 55.7306 30.0014 175.7831 140 L 4.2158 8.3962 117.8175 57.1538 43.7223 178.8578 141 S 3.8375 7.3919 108.6166 58.6036 61.3115 173.0382 142 V 3.8113 8.2936 124.0192 63.4438 31.6383 177.5699 143 S 4.2192 7.7182 116.2944 61.3640 62.4473 175.2381 144 R 3.8496 7.3498 119.4981 57.5725 30.2423 175.5574 145 A 5.5229 7.3114 115.0174 51.0401 23.8079 175.2855 146 A 4.8766 8.1482 119.9580 51.3337 23.0023 175.4480 147 V 4.7177 9.0315 120.6805 61.3087 34.2590 174.3680 148 I 4.9780 9.2546 130.4161 59.8436 39.7777 174.8255 149 T 5.0278 8.4885 123.3316 61.9232 71.3177 173.9049 150 I 4.3603 8.9133 128.1640 59.8208 36.6742 176.1317 151 S 4.8041 8.5525 130.4514 57.2360 63.5187 174.6677 152 S 4.6950 8.5694 109.2630 57.1561 64.7787 176.9039 153 G 3.4885 8.5717 114.4911 48.5697 0.0000 175.7459 154 L 3.9949 8.1725 118.7678 57.1260 41.7804 178.6000 155 G 3.4264 8.1055 107.4333 47.5378 0.0000 173.8044 156 S 4.1167 8.2938 115.5766 57.8561 62.5255 173.8331 157 I 3.8779 8.4350 129.5604 64.8087 37.1898 178.5626 158 T 3.8496 8.1551 113.9027 64.9338 67.1548 174.1469 159 D 4.5337 7.9544 118.2202 54.4159 41.4773 175.3897 160 N 4.5688 8.0571 117.7319 54.6238 38.3066 174.1602 161 T 4.6580 8.4160 114.6208 60.9123 70.5511 174.8265 162 S 4.4894 8.2403 116.3833 57.8773 65.0878 175.2037 163 G 3.9688 7.9779 109.1152 47.0962 0.0000 174.1593 164 S 5.2226 8.9115 118.0251 56.8258 63.5967 175.0272 165 A 4.1005 7.8483 126.5140 55.8284 18.3764 180.1064 166 Q 3.9748 8.1556 113.5221 58.1708 29.5825 176.2123 167 F 4.8373 7.7839 115.4942 54.7601 43.1422 173.5953 168 P 4.9000 0.0000 0.0000 62.9431 29.2974 177.1217 169 V 4.8034 7.3375 112.7540 61.6171 33.1788 178.7563 170 L 4.0309 9.0186 122.7772 58.3142 41.8589 177.5078 171 A 4.0524 8.2497 119.8518 55.7144 18.6921 178.1995 172 Y 4.0417 8.3274 117.3764 60.6238 38.8321 178.1202 173 R 3.9412 8.9685 118.8480 60.0099 30.4382 178.9196 174 M 4.0692 8.1185 118.2605 58.3282 31.9108 179.0095 175 S 4.1183 7.9406 115.8294 60.8520 63.0468 176.7149 176 K 3.8397 7.6465 121.2374 58.6401 31.9634 179.0356 177 A 3.9213 7.8910 121.1415 54.8592 18.1983 179.6088 178 A 3.8409 7.8745 119.3974 55.3616 18.4381 179.7724 179 I 3.6994 7.6821 117.1712 64.2382 37.9094 177.8787 180 N 4.4515 8.2991 119.2129 55.7572 38.2331 177.0532 181 M 3.8968 7.8278 119.7448 58.1311 32.2058 178.0106 182 F 4.3974 8.3471 121.1817 61.4191 39.6438 177.2558 183 G 3.3301 8.2193 105.4325 47.6531 0.0000 175.4308 184 R 3.7777 7.6122 120.5966 59.4614 30.0899 178.8140 185 T 3.8578 7.8468 115.3507 66.5946 68.5417 176.2604 186 L 3.7646 8.2060 122.4084 58.1711 41.6503 178.6646 187 A 3.8946 7.4714 119.4147 55.3685 18.4980 179.3963 188 V 3.6300 7.2554 114.8333 66.4615 31.4726 177.9294 189 D 4.4537 7.9522 117.0554 56.2536 40.7445 177.3700 190 L 4.8909 7.3839 117.7280 53.4352 42.4934 178.0703 191 K 3.9281 8.3336 122.4947 59.8266 32.1417 178.9751 192 D 4.3853 8.0022 116.7133 57.1706 41.2199 177.2043 193 D 4.4467 7.8668 117.7451 54.4063 41.0909 177.2888 194 N 4.2487 8.1209 115.6459 53.4457 36.9251 174.0040 195 V 4.1921 7.1502 118.0246 60.6866 32.4779 175.9872 196 L 4.5057 8.7331 128.3095 54.9462 43.6107 176.2260 197 V 5.2498 8.9406 124.6752 59.9048 34.3146 174.0378 198 V 5.0018 8.4580 124.4088 61.1412 35.3700 173.2368 199 N 5.6321 9.3683 123.2525 51.9185 41.7176 173.9730 200 F 5.6817 9.0084 120.9361 55.5639 43.6897 173.4833 201 C 4.7844 8.6038 119.4158 58.5770 33.7778 172.1790 202 P 4.5989 0.0000 0.0000 61.2676 32.5421 176.7807 203 G 3.8997 8.4079 108.5509 46.0151 0.0000 174.4447 204 W 3.5930 8.0416 127.2517 57.5677 29.3795 174.1772 205 V 4.4225 7.6350 126.6913 61.8644 31.8268 175.8044 *219 E 4.1818 8.5042 117.1335 55.5815 31.7959 176.2397 220 Q 4.0591 8.3080 116.7020 58.3977 28.5610 178.4077 221 S 4.0375 7.8863 115.8710 61.7679 62.7607 175.8806 222 T 3.8131 7.8026 111.7533 64.3387 68.6151 176.2528 223 A 3.8217 8.0460 123.7624 55.1148 18.2548 179.1565 224 E 3.9106 8.0648 117.7037 59.6480 29.6317 178.3954 225 L 3.6917 7.7244 118.9247 57.9585 41.4977 179.2178 226 I 2.6214 7.3403 117.9799 63.8427 37.7586 177.9057 227 S 4.0192 7.9983 113.8801 60.7155 62.3128 175.4378 228 S 4.6873 7.7371 113.9695 58.2911 62.9041 175.8971 229 F 4.3615 8.2874 123.2214 60.6603 38.4483 176.5681 230 N 4.6220 8.1871 113.5903 54.5791 38.7189 175.5159 231 K 4.3244 7.5124 116.3062 55.8847 32.5732 176.5030 232 L 4.1344 7.5800 120.3363 54.2583 41.6039 175.1242 233 D 5.2851 8.4338 128.3744 53.4806 39.3178 178.1981 234 N 4.5938 8.7512 112.0298 55.3855 39.0240 176.9851 235 S 4.3645 9.1804 112.5205 60.3638 63.4788 174.5171 236 H 4.9452 7.9637 117.3670 56.0305 29.5581 174.3652 237 N 4.4821 7.7504 118.7035 55.0823 38.9559 174.5342 238 G 3.9415 9.1696 113.5164 46.2997 0.0000 172.9659 239 R 4.9306 7.9029 117.0940 53.9334 34.3638 174.1985 240 F 5.4404 7.8613 122.2750 56.7499 41.9910 174.2901 241 F 4.9375 8.6520 123.2832 56.1399 43.9582 173.4967 242 M 4.8052 8.4885 119.8054 53.8594 33.3635 177.8819 243 R 4.1305 8.3611 118.3468 59.6081 29.3974 177.4134 244 N 4.6913 7.9770 112.1031 52.3756 37.5123 175.5413 245 L 3.7564 8.6700 118.6695 54.6505 40.2761 174.2002 246 K 4.1259 7.8282 121.6041 55.0187 32.6938 174.6147 247 P 4.5682 0.0000 0.0000 63.0493 31.8811 174.9588 248 Y 4.4635 7.4567 117.3356 56.7851 40.1119 175.6938 249 E 4.2574 8.7744 117.9465 55.8586 30.2927 176.5963 250 F 4.4073 7.9335 124.1416 57.9627 38.5395 174.5806 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 2 S 8.32 4.47 0.00 3.88 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 3 P 0.00 4.52 0.00 2.27 2.18 0.00 3.78 0.00 0.00 3.68 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 4 G 8.38 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 5 S 7.91 5.43 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 6 V 8.54 4.86 2.13 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 0.96 0.00 0.00 0.97 0.00 0.00 7 V 8.91 5.00 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 1.26 0.00 0.00 1.00 0.00 0.00 8 V 9.36 4.95 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 0.98 0.00 0.00 0.99 0.00 0.00 9 T 8.00 4.77 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 1.14 0.00 0.00 10 G 8.17 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 11 A 8.09 4.75 1.27 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 0.00 0.00 12 N 8.06 4.42 0.00 2.74 2.84 0.00 0.00 6.92 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 7.78 4.55 0.00 1.84 1.86 0.00 3.39 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 14 G 8.53 3.90 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 0.00 0.00 0.00 15 I 8.44 3.87 1.87 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 1.57 0.79 0.92 0.00 0.00 16 G 8.05 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 17 L 7.99 4.08 0.00 2.01 1.70 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.86 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 0.00 0.00 0.00 19 L 8.08 4.01 0.00 1.88 1.73 0.99 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.85 3.59 2.25 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 1.05 0.00 0.00 0.99 0.00 0.00 21 Q 7.93 4.05 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.65 0.00 22 Q 7.75 4.01 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.63 2.45 0.00 23 L 8.18 4.04 0.00 2.04 1.73 0.96 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.45 3.68 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 0.78 0.00 0.00 0.97 0.00 0.00 25 K 7.63 4.39 0.00 1.89 1.85 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.67 7.81 26 D 7.96 4.71 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 27 K 8.42 4.07 0.00 1.78 1.86 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.41 7.81 28 N 7.74 4.49 0.00 2.92 2.88 0.00 0.00 7.01 7.33 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 29 I 7.32 4.35 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.79 0.97 0.00 0.00 30 R 8.49 4.31 0.00 1.48 1.79 0.00 3.05 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 31 H 8.03 5.31 0.00 3.05 3.12 0.00 5.58 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 8.66 4.79 1.93 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 1.27 1.05 0.96 0.00 0.00 33 I 9.49 4.91 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.98 1.16 0.00 0.00 34 A 9.61 5.34 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.94 5.71 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 0.89 0.00 0.00 36 A 8.03 4.88 1.20 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 0.00 0.00 37 R 8.78 3.92 0.00 1.77 1.98 0.00 3.27 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 38 D 7.67 4.46 0.00 2.67 2.49 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 39 V 8.34 3.80 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 0.85 0.00 0.00 0.94 0.00 0.00 40 E 7.75 4.08 0.00 2.26 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 2.35 2.35 0.00 41 K 7.91 4.44 0.00 1.73 1.83 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.65 7.81 42 A 8.05 4.27 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 43 T 8.33 3.23 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 44 E 8.05 3.98 0.00 2.08 2.08 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 2.33 2.33 0.00 45 L 7.94 4.11 0.00 1.63 1.69 0.95 0.53 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 46 K 8.26 3.95 0.00 1.90 1.90 0.00 1.82 0.00 0.00 1.90 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.41 7.81 47 S 8.12 4.16 0.00 3.94 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 *50 D 8.29 4.44 0.00 2.69 2.66 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 0.00 0.00 0.00 0.00 51 S 8.79 4.62 0.00 3.97 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 52 R 8.20 4.73 0.00 2.23 2.21 0.00 3.18 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.66 0.00 53 V 7.43 4.83 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 0.70 0.00 0.00 0.95 0.00 0.00 54 H 9.73 4.83 0.00 3.17 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.66 4.74 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 0.83 0.00 0.00 0.95 0.00 0.00 56 L 9.02 5.08 0.00 1.80 1.69 1.05 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.92 0.00 2.08 2.05 0.00 3.88 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 58 L 8.15 4.13 0.00 1.22 1.29 0.75 0.20 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 59 T 8.56 4.45 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 1.20 0.00 0.00 60 V 8.22 3.18 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 0.64 0.00 0.00 0.90 0.00 0.00 61 T 7.78 4.08 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 1.19 0.00 0.00 62 C 8.69 4.62 0.00 2.90 2.96 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 63 D 8.63 4.38 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.08 4.01 0.00 1.77 1.86 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.46 7.81 65 S 8.12 4.23 0.00 3.89 4.17 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 66 L 7.85 4.09 0.00 2.01 1.74 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.93 4.42 0.00 2.66 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 68 T 8.37 3.82 4.31 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 1.26 0.00 0.00 69 F 8.14 4.17 0.00 3.13 3.38 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 70 V 7.63 3.24 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 0.99 0.00 0.00 1.09 0.00 0.00 71 S 7.83 4.07 0.00 4.05 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 72 K 7.64 3.88 0.00 1.74 1.79 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.64 7.81 73 V 7.20 3.51 1.85 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 -0.10 0.00 0.00 0.70 0.00 0.00 74 G 8.03 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 7.81 3.88 0.00 2.18 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 2.29 2.46 0.00 76 I 7.73 3.72 1.83 0.00 0.00 0.58 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 0.74 0.56 0.00 0.00 77 V 8.44 3.99 2.22 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 0.84 0.00 0.00 0.96 0.00 0.00 78 G 8.41 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 79 S 8.62 4.88 0.00 3.97 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 80 D 7.13 4.33 0.00 2.47 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 0.00 0.00 0.00 *83 S 8.82 4.53 0.00 3.93 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 84 L 7.72 4.95 0.00 1.75 1.63 0.95 0.51 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 85 L 9.30 4.75 0.00 1.79 1.56 1.05 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.80 4.62 2.02 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 1.24 0.95 1.01 0.00 0.00 87 N 9.62 4.86 0.00 2.66 2.81 0.00 0.00 6.13 5.12 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 88 N 9.62 4.97 0.00 2.58 2.99 0.00 0.00 7.21 8.15 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 89 A 8.17 3.99 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.03 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 91 V 8.29 4.35 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 0.67 0.00 0.00 1.01 0.00 0.00 92 L 8.74 4.91 0.00 1.50 1.68 0.78 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.55 4.75 0.00 1.72 1.63 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.79 4.42 0.00 3.82 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 95 Y 8.82 4.34 0.00 3.04 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 96 G 8.42 4.50 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 0.00 0.00 0.00 97 T 8.25 3.92 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 1.22 0.00 0.00 98 N 7.82 4.76 0.00 2.65 2.80 0.00 0.00 6.96 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 99 T 7.27 4.02 3.50 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 1.11 0.00 0.00 100 E 8.77 3.79 0.00 1.90 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 0.00 2.31 2.43 0.00 101 P 0.00 4.23 0.00 2.12 2.11 0.00 3.69 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 2.07 2.15 0.00 102 N 9.33 4.87 0.00 3.01 2.77 0.00 0.00 6.40 7.67 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 0.00 103 R 8.62 3.87 0.00 1.91 1.89 0.00 3.23 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 104 A 8.08 3.92 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 0.00 105 V 7.69 3.49 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 1.01 0.00 0.00 1.02 0.00 0.00 106 I 7.05 3.40 1.79 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 0.52 0.21 0.79 0.00 0.00 107 A 8.07 3.94 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 0.00 108 E 8.27 3.81 0.00 2.21 1.93 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 2.29 2.30 0.00 109 Q 7.89 3.98 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 110 L 7.97 3.97 0.00 1.69 1.63 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.59 4.22 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 0.00 112 V 7.94 3.51 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 0.89 0.00 0.00 0.96 0.00 0.00 113 N 7.96 4.55 0.00 2.87 2.73 0.00 0.00 6.97 7.63 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 0.00 114 T 8.58 4.17 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 1.09 0.00 0.00 115 T 8.19 3.76 4.15 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 0.00 0.00 1.24 0.00 0.00 116 S 8.39 4.10 0.00 4.08 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 0.00 117 V 7.53 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 1.08 0.00 0.00 0.90 0.00 0.00 118 V 7.41 2.76 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 0.58 0.00 0.00 -0.18 0.00 0.00 119 L 8.11 3.92 0.00 1.60 1.69 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.38 4.00 0.00 1.60 1.89 1.12 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 121 T 7.94 4.12 4.70 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 1.35 0.00 0.00 122 Q 8.28 4.13 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.96 0.00 0.00 0.00 0.00 0.00 2.47 2.66 0.00 123 K 8.17 4.48 0.00 1.78 1.87 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.64 7.81 124 L 7.67 4.80 0.00 1.67 1.63 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.30 4.00 0.00 1.77 1.74 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.28 0.00 2.15 2.10 0.00 3.54 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 127 L 7.77 4.04 0.00 1.70 1.71 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.36 4.09 0.00 1.88 1.69 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 129 K 9.00 3.90 0.00 1.81 1.87 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.60 7.81 130 N 8.36 4.28 0.00 2.89 2.97 0.00 0.00 7.21 7.84 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 0.00 131 A 7.88 4.12 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 0.00 132 A 7.80 4.11 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 0.00 133 S 7.71 4.56 0.00 4.06 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 0.00 134 K 7.32 4.78 0.00 1.78 1.77 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.50 7.81 135 E 7.52 4.76 0.00 1.87 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 2.03 2.11 0.00 *138 D 9.17 4.64 0.00 2.70 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 0.00 139 Q 7.84 4.46 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 140 L 8.40 4.22 0.00 1.87 1.68 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 141 S 7.39 3.84 0.00 3.93 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 0.00 142 V 8.29 3.81 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 0.64 0.00 0.00 0.96 0.00 0.00 143 S 7.72 4.22 0.00 3.86 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 0.00 144 R 7.35 3.85 0.00 1.78 2.09 0.00 3.26 0.00 0.00 3.23 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 145 A 7.31 5.52 1.21 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 0.00 0.00 146 A 8.15 4.88 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 0.00 147 V 9.03 4.72 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 1.00 0.00 0.00 0.93 0.00 0.00 148 I 9.25 4.98 1.68 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.66 0.71 0.00 0.00 149 T 8.49 5.03 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 150 I 8.91 4.36 1.95 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.94 0.93 0.00 0.00 151 S 8.55 4.80 0.00 3.97 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 0.00 152 S 8.57 4.70 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 0.00 153 G 8.57 3.49 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 0.00 154 L 8.17 3.99 0.00 1.90 1.97 1.16 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.11 3.43 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 0.00 156 S 8.29 4.12 0.00 3.60 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 0.00 157 I 8.44 3.88 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.70 0.93 0.00 0.00 158 T 8.16 3.85 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 1.35 0.00 0.00 159 D 7.95 4.53 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 0.00 160 N 8.06 4.57 0.00 2.93 2.95 0.00 0.00 6.89 7.12 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 0.00 161 T 8.42 4.66 4.28 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 1.30 0.00 0.00 162 S 8.24 4.49 0.00 4.12 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 0.00 163 G 7.98 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 0.00 0.00 0.00 164 S 8.91 5.22 0.00 4.09 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 0.00 165 A 7.85 4.10 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 0.00 166 Q 8.16 3.97 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 167 F 7.78 4.84 0.00 3.10 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 0.00 168 P 0.00 4.90 0.00 2.38 2.24 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 169 V 7.34 4.80 2.33 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 0.75 0.00 0.00 1.13 0.00 0.00 170 L 9.02 4.03 0.00 1.80 1.99 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 171 A 8.25 4.05 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 0.00 172 Y 8.33 4.04 0.00 3.19 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 R 8.97 3.94 0.00 2.11 2.05 0.00 3.28 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 174 M 8.12 4.07 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.56 0.00 175 S 7.94 4.12 0.00 3.92 4.12 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 0.00 0.00 0.00 176 K 7.65 3.84 0.00 1.53 1.64 0.00 1.48 0.00 0.00 1.56 0.00 0.00 2.56 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.77 0.93 7.81 177 A 7.89 3.92 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 0.00 178 A 7.87 3.84 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 I 7.68 3.70 1.90 0.00 0.00 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 1.55 1.53 0.82 0.00 0.00 180 N 8.30 4.45 0.00 2.86 2.65 0.00 0.00 6.44 7.86 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 0.00 181 M 7.83 3.90 0.00 2.29 1.95 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 182 F 8.35 4.40 0.00 3.02 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 0.00 183 G 8.22 3.33 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 0.00 0.00 0.00 0.00 184 R 7.61 3.78 0.00 1.72 1.94 0.00 3.09 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.55 0.00 185 T 7.85 3.86 4.36 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 1.24 0.00 0.00 186 L 8.21 3.76 0.00 1.01 1.21 0.87 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 187 A 7.47 3.89 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 0.00 188 V 7.26 3.63 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 1.09 0.00 0.00 0.89 0.00 0.00 189 D 7.95 4.45 0.00 2.79 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 0.00 190 L 7.38 4.89 0.00 1.66 1.61 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 191 K 8.33 3.93 0.00 1.91 1.80 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 192 D 8.00 4.39 0.00 2.70 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 0.00 193 D 7.87 4.45 0.00 2.86 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 0.00 194 N 8.12 4.25 0.00 2.88 2.94 0.00 0.00 6.94 7.20 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 0.00 195 V 7.15 4.19 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 0.66 0.00 0.00 0.97 0.00 0.00 196 L 8.73 4.51 0.00 1.81 1.68 1.09 0.64 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 0.00 197 V 8.94 5.25 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 0.76 0.00 0.00 0.88 0.00 0.00 198 V 8.46 5.00 2.36 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 1.46 0.00 0.00 1.14 0.00 0.00 199 N 9.37 5.63 0.00 2.95 2.96 0.00 0.00 6.87 8.95 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 0.00 200 F 9.01 5.68 0.00 3.16 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 0.00 201 C 8.60 4.78 0.00 3.11 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 0.00 202 P 0.00 4.60 0.00 2.18 2.09 0.00 3.85 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 1.98 1.96 0.00 203 G 8.41 3.90 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 0.00 0.00 0.00 204 W 8.04 3.59 0.00 3.40 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 0.00 205 V 7.64 4.42 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 1.01 0.00 0.00 1.03 0.00 0.00 *219 E 8.50 4.18 0.00 2.26 2.13 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 2.25 2.37 0.00 220 Q 8.31 4.06 0.00 2.28 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 221 S 7.89 4.04 0.00 3.93 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 0.00 222 T 7.80 3.81 4.15 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 0.00 0.00 1.20 0.00 0.00 223 A 8.05 3.82 1.33 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 0.00 0.00 0.00 224 E 8.06 3.91 0.00 2.07 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 2.40 2.33 0.00 225 L 7.72 3.69 0.00 1.47 0.77 0.84 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 226 I 7.34 2.62 1.48 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.40 0.85 0.00 0.00 227 S 8.00 4.02 0.00 3.84 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 0.00 228 S 7.74 4.69 0.00 4.14 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 0.00 229 F 8.29 4.36 0.00 3.06 3.01 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 0.00 230 N 8.19 4.62 0.00 2.72 2.88 0.00 0.00 6.81 7.61 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 0.00 231 K 7.51 4.32 0.00 1.82 1.80 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.52 7.81 232 L 7.58 4.13 0.00 1.82 1.64 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 233 D 8.43 5.29 0.00 2.77 2.49 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 0.00 234 N 8.75 4.59 0.00 2.86 2.91 0.00 0.00 6.61 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 0.00 235 S 9.18 4.36 0.00 3.87 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 0.00 236 H 7.96 4.95 0.00 3.26 3.36 0.00 5.63 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 0.00 237 N 7.75 4.48 0.00 2.82 2.83 0.00 0.00 7.17 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 0.00 238 G 9.17 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 0.00 239 R 7.90 4.93 0.00 2.00 1.12 0.00 3.03 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.91 0.00 240 F 7.86 5.44 0.00 3.01 2.45 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 0.00 241 F 8.65 4.94 0.00 1.74 2.43 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 0.00 242 M 8.49 4.81 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.91 0.00 243 R 8.36 4.13 0.00 1.92 2.20 0.00 3.07 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 244 N 7.98 4.69 0.00 2.85 3.02 0.00 0.00 6.55 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 0.00 245 L 8.67 3.76 0.00 1.77 1.83 0.86 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 246 K 7.83 4.13 0.00 1.72 1.64 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.34 7.81 247 P 0.00 4.57 0.00 2.06 2.17 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 248 Y 7.46 4.46 0.00 2.77 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 0.00 249 E 8.77 4.26 0.00 1.99 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 2.19 2.29 0.00 250 F 7.93 4.41 0.00 3.30 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 * Residues marked with a * may have inaccurate shift predictions.