NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2589 7.8827 121.4512 61.2289 38.6623 173.7761 17 V 4.3601 8.7509 126.2509 61.7625 32.6656 174.3957 18 G 3.8173 8.4148 114.1984 46.4955 0.0000 173.3331 19 G 4.2374 7.8110 110.3620 44.0938 0.0000 172.6051 20 Y 4.9560 7.9335 117.1692 55.2352 42.3142 174.8728 21 T 4.2274 8.6058 116.9558 63.9379 68.4428 175.1132 22 C 4.2572 8.6524 125.5658 61.1006 36.4317 173.8779 23 G 3.9940 8.6777 105.4746 43.3418 0.0000 172.8876 24 A 4.2257 8.6834 126.5713 53.8606 18.4592 176.8335 25 N 4.2817 8.8669 119.5051 54.7038 35.9815 175.3856 26 T 4.2417 7.7391 107.8542 62.5799 69.9739 175.2474 27 V 4.0980 7.0199 122.0399 59.8710 31.3684 173.5954 28 P 4.5351 0.0000 0.0000 63.9063 31.8317 178.1811 29 Y 5.1102 6.6454 115.5623 56.5669 38.8727 174.6870 30 Q 4.6051 7.2170 123.2317 56.3301 29.3398 175.5352 31 V 4.8470 8.9479 119.1017 59.6353 36.0728 174.2256 32 S 4.8304 8.7222 117.4060 56.5407 64.7268 172.7626 33 L 4.4471 8.6117 127.9914 53.6280 42.7721 175.1270 34 N 5.7802 9.0958 123.3501 50.0071 41.9219 174.8746 *37 S 4.1909 8.3040 119.6785 58.2910 64.0415 174.5263 38 G 3.9908 9.9228 108.3886 45.9896 0.0000 172.3299 39 Y 4.4864 6.5748 115.1071 56.2786 39.9733 172.5323 40 H 4.5149 8.8637 121.6740 55.9781 30.2414 174.6494 41 F 5.0114 7.7050 120.8947 57.0994 39.9088 174.1607 42 C 4.7359 6.7662 115.0005 56.3583 44.7534 173.0869 43 G 4.2806 8.6003 109.2011 45.6011 0.0000 172.0731 44 G 4.3500 7.9555 105.4166 46.4300 0.0000 172.6400 45 S 5.4610 8.7354 115.1531 56.5095 67.0129 173.6471 46 L 4.8331 9.3057 127.7251 54.6809 42.4193 177.0056 47 I 4.4224 8.4805 119.9467 60.8510 38.4656 174.4425 48 N 4.5547 7.5362 117.6788 52.3408 39.3875 175.1104 49 S 4.3300 8.5163 112.0146 60.8149 63.1557 175.0372 50 Q 4.6418 8.2007 117.3305 54.9840 31.1613 174.6974 51 W 5.5594 8.2983 118.2429 54.8205 33.5343 174.4322 52 V 5.0460 9.1170 122.9850 61.1538 34.7017 174.1044 53 V 4.9135 8.8459 126.8363 61.6349 33.6153 174.6535 54 S 5.2200 9.2581 121.1256 57.4516 66.3639 172.1235 55 A 4.5895 8.4939 121.1356 50.9372 19.9607 178.5940 56 A 3.8406 8.2951 124.1739 55.2219 18.4959 179.1934 57 H 4.5431 8.3059 109.4291 57.2630 28.6928 175.3195 58 C 4.6759 7.7456 117.1605 57.1140 40.5799 173.3334 59 Y 4.1077 7.6895 122.3056 57.7547 38.7684 175.2607 60 K 3.6814 6.5156 123.2552 56.0661 34.6150 174.5350 61 S 4.2460 8.1891 114.8072 58.1662 64.5156 173.3026 62 G 3.7031 8.2465 106.2295 46.7079 0.0000 173.9174 63 I 4.2909 7.4042 119.4236 59.8424 39.4888 175.5628 64 Q 4.7282 8.9588 128.8490 54.1953 31.3423 174.2442 65 V 4.3001 8.8388 127.6179 62.1686 33.2357 174.6439 66 R 5.0137 9.0283 127.7560 54.7333 32.0835 175.3583 67 L 4.7121 9.0013 124.7860 52.6990 44.7315 177.5864 *69 G 3.9925 8.2423 107.5764 45.4260 0.0000 172.7202 70 E 4.4645 8.2316 118.3855 55.3678 30.1287 174.1506 71 D 4.8077 7.9969 118.0662 54.8877 43.9747 174.3471 72 N 4.9090 8.9388 121.9910 52.4331 38.9575 176.2550 73 I 3.8712 8.5970 120.3859 62.4306 37.7721 176.3511 74 N 4.7969 8.5351 117.8601 53.0587 39.2564 174.8002 75 V 4.3780 7.4210 117.1311 60.7611 34.6103 174.8112 76 V 4.1635 8.4118 126.2919 62.4048 31.4276 175.2080 77 E 4.4928 9.4173 126.8206 54.9881 31.3336 176.3970 78 G 4.0461 8.6491 106.1597 45.6295 0.0000 174.0866 79 N 4.6419 9.0301 117.1920 52.8311 36.9962 174.6098 80 E 4.5292 7.6756 116.6320 56.4621 30.7096 176.5679 81 Q 4.3437 9.0617 120.9012 54.5067 32.9640 173.9657 82 F 5.4673 8.8237 123.5220 56.1684 40.5804 175.4732 83 I 4.6898 8.7960 124.9183 59.3200 40.8717 175.5186 84 S 4.5986 8.6686 122.1408 58.2354 64.2183 173.2926 85 A 4.3632 8.3100 125.7778 52.3434 18.3531 177.5091 86 S 4.3566 9.3336 118.7045 60.2823 63.3799 174.6248 87 K 4.7689 7.6474 117.1013 54.8009 36.7612 175.3700 88 S 5.1201 8.8559 118.9147 57.1312 65.7282 173.9982 89 I 4.4045 9.3815 127.7459 59.4416 37.8429 175.0421 90 V 4.1368 8.1636 126.9595 62.3665 32.5882 175.0503 91 H 3.9163 8.7018 127.4629 56.0046 29.9356 174.3347 92 P 4.2550 0.0000 0.0000 65.3782 31.3507 177.1541 93 S 4.6878 7.8757 111.4805 58.0722 62.7787 173.3143 94 Y 4.3240 8.1936 123.5480 57.7204 39.1157 174.4500 95 N 4.6928 8.3112 125.6705 51.3397 40.2664 175.2219 96 S 4.1279 7.8453 120.0459 59.6690 63.5805 174.8658 97 N 4.4495 8.7283 118.8705 54.9661 38.9077 176.1694 98 T 3.9354 7.7825 105.9245 61.1137 69.7885 175.2892 99 L 3.7692 8.1033 120.6193 55.2506 39.8872 173.8404 100 N 4.4838 7.7063 117.9236 54.6638 39.3540 174.7026 101 N 5.0143 8.7794 120.5112 54.7002 35.7697 175.2734 102 D 4.7206 8.0567 117.3617 53.2952 39.2729 174.4872 103 I 4.7927 7.1239 120.8596 59.3227 42.5352 173.0614 104 M 5.3841 9.1728 126.9169 54.3039 36.1467 173.2425 105 L 5.3938 9.0888 125.1149 53.2874 44.8446 175.4243 106 I 4.9563 9.2016 123.2797 59.4581 40.6872 174.2818 107 K 3.6052 8.7331 129.1614 54.7325 33.4002 175.7569 108 L 4.4364 8.1812 128.0264 54.1466 41.9259 177.1747 109 K 4.1484 8.8497 124.8261 59.1182 32.6067 177.1100 110 S 4.6150 7.6900 111.2200 55.9159 66.0840 173.2075 111 A 4.4148 8.3559 123.2803 51.9986 18.7552 177.4033 112 A 4.2285 8.9799 123.6094 51.8199 19.7447 177.8946 113 S 4.4719 9.2806 117.1566 57.4291 63.1160 174.5888 114 L 4.4837 8.4932 125.8152 54.6044 42.7598 176.8614 115 N 4.6649 8.8768 118.4731 52.8018 40.2207 174.8403 116 S 4.1996 8.8636 111.6104 61.7478 63.0472 175.4214 117 R 4.0982 8.6949 120.0620 57.0388 30.5607 175.8300 118 V 4.4019 7.8326 116.2250 60.8965 33.1456 173.7030 119 A 5.1449 8.5620 128.5430 50.2094 22.9164 175.1635 120 S 5.0639 8.7396 114.0968 57.9142 64.7635 173.1170 121 I 4.4373 8.3404 121.4419 59.3131 39.8535 175.3753 122 S 4.4904 8.3329 123.4053 58.1415 64.1989 173.7808 123 L 4.2995 8.3438 123.2009 53.4006 42.4741 175.2859 124 P 4.5259 0.0000 0.0000 62.9778 32.1719 176.2329 125 T 4.2541 8.1957 108.0083 61.9869 70.0458 174.3555 *127 S 4.4465 7.5636 115.2433 58.1330 64.0457 174.2054 128 C 4.4110 8.4325 118.2967 56.7939 40.7135 173.3581 129 A 4.4581 8.0101 124.7856 51.2504 19.8139 177.3858 130 S 4.3850 8.0679 114.5535 56.7916 65.1037 173.1636 *132 A 4.3180 8.1753 123.1824 53.4715 19.2438 176.6918 133 G 4.0277 9.1773 110.3013 45.4679 0.0000 174.5286 134 T 3.9235 7.6258 117.0636 63.8455 69.4223 173.3613 135 Q 4.7049 8.5666 127.3624 55.6792 30.2210 175.2630 136 C 5.2593 9.2745 122.5713 55.1753 45.1821 172.2959 137 L 5.1618 9.0662 122.8419 53.5725 43.9736 175.0558 138 I 5.2141 9.2022 127.2477 58.8294 39.9855 174.8336 139 S 4.9475 8.7475 119.3248 56.3460 66.6431 173.0396 140 G 3.8098 7.3671 108.7620 46.1712 0.0000 172.8610 141 W 4.6893 8.5915 117.0268 56.2676 29.3538 177.0447 142 G 4.1396 8.2660 108.9447 44.3352 0.0000 173.4974 143 N 3.8253 8.6912 118.3565 54.4218 38.9004 174.5271 144 T 5.0631 8.4138 113.6967 60.5721 69.5487 174.3107 145 K 4.6035 7.7549 121.9143 54.6877 34.4259 176.3959 146 S 4.1610 8.7317 118.1470 60.1751 63.4594 173.8213 147 S 4.3624 7.9971 115.2002 59.8327 63.0466 171.7498 148 G 3.7838 8.7651 113.7143 44.2616 0.0000 170.9328 149 T 4.6216 7.8471 114.0948 61.8329 71.6628 174.6902 150 S 4.2763 8.9662 119.6132 58.2059 65.1720 172.6184 151 Y 5.0013 8.5676 125.6814 55.7814 39.2239 174.4258 152 P 4.7125 0.0000 0.0000 62.3448 33.0615 175.7969 153 D 4.6211 8.7385 118.1521 56.3282 41.4695 177.2042 154 V 5.6838 7.3900 109.7654 58.5232 34.2785 175.9163 155 L 3.1854 8.1699 125.0211 55.2336 42.9666 176.0069 156 K 4.8462 8.1667 125.0018 54.9173 35.0374 174.6517 157 C 5.2768 8.6911 120.2522 55.2422 41.2892 172.9949 158 L 4.8755 8.4382 122.1040 54.0817 45.6402 174.1339 159 K 5.1408 8.9934 125.7901 55.2831 33.4403 175.8441 160 A 4.8132 9.1037 126.3221 49.7714 23.1403 173.3527 161 P 5.0738 0.0000 0.0000 61.6645 34.1108 174.9434 162 I 4.4311 8.4126 122.8183 61.3464 38.0760 176.0344 163 L 4.7727 8.7809 127.7442 53.4227 43.2760 176.9447 164 S 4.3680 8.4316 114.6990 58.0980 63.9537 175.1285 165 D 4.4619 8.7494 122.2409 57.5304 40.4925 179.3142 166 S 4.1422 8.0135 114.4225 61.6967 63.2086 176.6821 167 S 4.2206 7.9454 119.8267 60.5538 62.5149 175.7956 168 C 4.3173 8.3265 121.2101 59.8935 39.6518 175.9691 169 K 3.9715 8.5199 120.5012 59.2186 31.5157 179.3657 170 S 4.2036 8.2274 114.2881 60.7334 62.8888 176.2921 171 A 4.0326 7.5867 123.5929 53.6403 19.8501 177.2229 172 Y 4.8897 7.9115 114.0382 55.1167 38.4152 172.7857 173 P 4.6138 0.0000 0.0000 63.6355 31.9759 177.9584 174 G 3.9932 9.0861 110.3699 45.7965 0.0000 173.4438 175 Q 4.5238 8.1401 116.7745 55.4733 30.1759 175.3784 176 I 4.3807 7.8451 119.8395 60.0054 38.3504 175.4984 177 T 4.5437 8.2247 115.8806 59.6643 70.7586 175.4918 178 S 4.3317 8.5437 115.3262 60.4576 63.1475 174.4496 179 N 4.9987 8.0754 118.8475 53.2894 38.5689 173.8452 180 M 5.5768 7.9108 116.4343 53.8729 36.2586 174.6310 181 F 5.1174 8.6842 115.0775 55.8609 42.0531 172.5704 182 C 5.5001 9.0437 116.9187 55.9026 42.2144 172.5405 183 A 5.0244 9.2217 122.2111 51.0561 22.4271 175.5490 184A G 3.9807 6.9674 107.2036 44.6491 0.0000 172.7929 184 Y 4.6452 8.4211 119.4706 56.0493 41.2292 176.3395 185 L 4.1460 8.6442 124.9632 57.2605 42.0056 178.7925 186 E 4.1476 8.2401 116.8767 57.0321 29.7558 177.3735 187 G 3.8290 7.8684 106.2819 45.2094 0.0000 173.2578 188A G 4.0241 9.6170 106.4215 44.8627 0.0000 173.4617 188 K 5.5219 7.2375 117.4593 54.2310 35.8355 175.1039 189 D 4.6234 8.4023 122.7140 53.8915 44.6754 174.9169 190 S 4.9193 8.8250 117.1264 58.0366 65.2787 172.8929 191 C 4.8055 9.5833 119.2249 55.2427 46.2945 172.5232 192 Q 4.4761 8.5952 119.6089 57.5826 28.6046 177.2698 193 G 4.2960 9.3264 110.9969 46.2746 0.0000 174.7621 194 D 4.6485 8.5884 118.9431 55.8588 41.6121 176.6561 195 S 4.3300 8.0525 114.7287 60.1984 63.3092 175.5507 196 G 4.1490 8.9031 112.6705 46.4827 0.0000 173.7573 197 G 4.0445 8.0545 107.5791 45.2381 0.0000 171.2552 198 P 5.1258 0.0000 0.0000 62.4501 33.4975 175.8535 199 V 4.6269 8.4585 120.6075 61.4835 34.3113 173.8121 200 V 4.7636 8.8450 128.9354 61.2294 34.0773 173.7326 201 C 5.0662 8.7544 124.6901 55.3233 43.6282 174.6256 202 S 3.5563 9.5568 121.5660 59.7790 59.8119 173.2569 203 G 3.9228 8.3208 104.0885 45.7194 0.0000 173.4699 204 K 4.7462 7.5572 117.8583 52.9749 35.2247 175.4125 *209 L 4.2047 8.3240 123.2775 55.3944 42.2876 175.6889 210 Q 4.5018 8.9149 126.0765 56.7138 30.9317 175.8397 211 G 5.3308 8.0317 104.2924 45.6225 0.0000 171.4023 212 I 5.1671 8.1693 119.1982 58.9095 41.2596 175.3591 213 V 3.5581 9.0256 127.5933 64.0205 31.7496 174.0751 214 S 4.9145 8.5362 121.5588 58.5372 64.3390 175.7337 215 W 4.9831 7.5191 115.6692 57.3882 31.7624 172.6407 216 G 3.6811 8.2127 105.3222 47.2434 0.0000 171.9967 217 S 4.7898 8.0355 116.9236 56.8334 64.1280 173.2126 *219 G 4.2784 8.1007 116.2572 45.5501 0.0000 171.5980 220 C 4.8724 8.4200 117.2816 56.7640 44.8656 173.8278 221A A 3.9963 9.3896 127.1930 53.2124 16.7780 176.7491 221 Q 4.5397 7.3279 117.8341 56.0236 29.9055 175.9704 222 K 4.2006 8.4982 122.5662 58.0721 32.6100 176.2413 223 N 4.2661 9.3044 121.6691 53.9321 36.9747 175.2039 224 K 4.3100 7.6137 117.7403 53.6135 32.1907 173.8563 225 P 4.6366 0.0000 0.0000 61.9293 33.2464 177.0911 226 G 3.6319 8.4625 106.3229 46.1343 0.0000 172.7177 227 V 4.4313 7.5587 122.0606 60.7210 34.0520 174.1538 228 Y 4.8522 8.2153 124.1989 55.9950 42.4342 174.8071 229 T 4.5006 8.5507 119.4039 63.4830 70.0208 174.4600 230 K 5.0660 9.2590 128.5131 55.5253 31.4432 177.0794 231 V 3.9502 8.8386 126.5975 65.8927 31.4165 174.8544 232 C 4.5711 8.3895 112.5272 58.2431 41.3783 174.7722 233 N 4.2767 7.9382 116.8912 54.2014 38.6044 174.9585 234 Y 4.8466 8.1924 117.5591 57.4224 39.4937 177.4907 235 V 3.6739 8.1206 121.2069 66.3807 31.4574 177.9648 236 S 4.1335 8.1328 114.2234 61.2781 62.6330 176.3530 237 W 4.1542 8.3002 130.4456 60.5485 30.5356 177.7250 238 I 3.1932 8.4067 120.1095 64.2614 36.5848 178.5490 239 K 3.7539 8.0385 119.0462 59.6579 31.7921 179.5476 240 Q 3.9223 8.1811 118.4942 59.0750 28.3136 179.0657 241 T 3.5872 7.3786 116.3428 66.5063 68.5417 176.6799 242 I 2.7990 7.2477 121.5796 63.8541 36.6885 178.3962 243 A 4.0120 7.6552 121.1680 54.1945 18.2302 178.7479 244 S 4.5985 7.3434 110.4283 58.3899 63.5451 174.1325 245 N 4.6790 7.8674 125.6211 53.8505 39.2537 174.0185 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 16 I 7.88 4.26 1.80 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 1.35 0.70 0.86 0.00 0.00 17 V 8.75 4.36 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 1.02 0.00 0.00 0.97 0.00 0.00 18 G 8.41 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 19 G 7.81 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 0.00 0.00 0.00 20 Y 7.93 4.96 0.00 2.99 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 21 T 8.61 4.23 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 1.23 0.00 0.00 22 C 8.65 4.26 0.00 2.75 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 23 G 8.68 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 0.00 0.00 0.00 24 A 8.68 4.23 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 25 N 8.87 4.28 0.00 2.90 2.93 0.00 0.00 7.16 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 26 T 7.74 4.24 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 27 V 7.02 4.10 1.74 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 0.34 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.54 0.00 2.38 2.42 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 29 Y 6.65 5.11 0.00 3.30 3.44 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 30 Q 7.22 4.61 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 1.91 2.50 0.00 31 V 8.95 4.85 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 0.84 0.00 0.00 0.92 0.00 0.00 32 S 8.72 4.83 0.00 2.92 3.28 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 33 L 8.61 4.45 0.00 0.48 0.73 0.75 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.10 5.78 0.00 2.36 2.42 0.00 0.00 6.77 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 *37 S 8.30 4.19 0.00 3.78 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 38 G 9.92 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 0.00 0.00 0.00 39 Y 6.57 4.49 0.00 3.04 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 40 H 8.86 4.51 0.00 2.82 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.71 5.01 0.00 3.03 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 42 C 6.77 4.74 0.00 2.24 2.83 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 0.00 0.00 0.00 43 G 8.60 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 0.00 0.00 0.00 0.00 44 G 7.96 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 0.00 0.00 0.00 45 S 8.74 5.46 0.00 3.83 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 46 L 9.31 4.83 0.00 1.86 1.69 1.08 0.72 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 47 I 8.48 4.42 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 1.56 0.90 0.96 0.00 0.00 48 N 7.54 4.55 0.00 2.94 3.00 0.00 0.00 6.00 7.64 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 49 S 8.52 4.33 0.00 4.05 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 0.00 50 Q 8.20 4.64 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 51 W 8.30 5.56 0.00 3.39 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 52 V 9.12 5.05 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 0.99 0.00 0.00 0.98 0.00 0.00 53 V 8.85 4.91 2.17 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 0.96 0.00 0.00 1.02 0.00 0.00 54 S 9.26 5.22 0.00 3.86 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 55 A 8.49 4.59 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 56 A 8.30 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.31 4.54 0.00 3.38 3.55 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.75 4.68 0.00 3.18 3.29 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 59 Y 7.69 4.11 0.00 3.05 2.97 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 60 K 6.52 3.68 0.00 1.48 1.32 0.00 0.67 0.00 0.00 1.27 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 0.91 7.81 61 S 8.19 4.25 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 62 G 8.25 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 63 I 7.40 4.29 1.84 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 1.39 0.57 0.92 0.00 0.00 64 Q 8.96 4.73 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 65 V 8.84 4.30 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 0.97 0.00 0.00 0.89 0.00 0.00 66 R 9.03 5.01 0.00 1.47 1.71 0.00 2.63 0.00 0.00 2.53 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.15 0.00 67 L 9.00 4.71 0.00 1.63 1.64 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 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 0.00 0.00 0.00 70 E 8.23 4.46 0.00 2.14 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 0.00 2.36 2.09 0.00 71 D 8.00 4.81 0.00 2.78 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 72 N 8.94 4.91 0.00 2.90 2.93 0.00 0.00 7.16 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 73 I 8.60 3.87 1.44 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.55 -0.42 0.00 0.00 74 N 8.54 4.80 0.00 2.84 2.88 0.00 0.00 6.62 8.53 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 75 V 7.42 4.38 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.41 4.16 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 0.83 0.00 0.00 0.96 0.00 0.00 77 E 9.42 4.49 0.00 1.95 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 0.00 2.26 2.43 0.00 78 G 8.65 4.05 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 0.00 0.00 0.00 79 N 9.03 4.64 0.00 2.93 3.14 0.00 0.00 6.95 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 80 E 7.68 4.53 0.00 1.60 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 2.65 2.48 0.00 81 Q 9.06 4.34 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.82 5.47 0.00 2.80 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 83 I 8.80 4.69 1.87 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 1.25 0.72 0.94 0.00 0.00 84 S 8.67 4.60 0.00 3.75 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 85 A 8.31 4.36 1.25 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 0.00 0.00 0.00 86 S 9.33 4.36 0.00 3.80 3.79 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 87 K 7.65 4.77 0.00 1.67 1.64 0.00 1.59 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.37 7.81 88 S 8.86 5.12 0.00 4.09 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 89 I 9.38 4.40 2.06 0.00 0.00 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 1.24 1.20 1.07 0.00 0.00 90 V 8.16 4.14 1.97 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 0.66 0.00 0.00 0.75 0.00 0.00 91 H 8.70 3.92 0.00 2.90 3.07 0.00 5.66 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.26 0.00 2.05 2.15 0.00 3.20 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 2.16 2.23 0.00 93 S 7.88 4.69 0.00 4.02 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 94 Y 8.19 4.32 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 95 N 8.31 4.69 0.00 2.57 2.43 0.00 0.00 6.65 6.98 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 96 S 7.85 4.13 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 97 N 8.73 4.45 0.00 2.67 2.78 0.00 0.00 6.91 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 98 T 7.78 3.94 4.14 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 1.10 0.00 0.00 99 L 8.10 3.77 0.00 1.50 1.89 0.75 1.15 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 0.00 100 N 7.71 4.48 0.00 2.74 2.65 0.00 0.00 7.27 7.51 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 0.00 101 N 8.78 5.01 0.00 2.96 2.70 0.00 0.00 7.24 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 0.00 102 D 8.06 4.72 0.00 3.09 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 0.00 103 I 7.12 4.79 1.40 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.19 0.01 0.00 0.00 104 M 9.17 5.38 0.00 2.25 1.83 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 105 L 9.09 5.39 0.00 1.86 1.93 0.21 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.20 4.96 1.92 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 1.19 0.89 0.93 0.00 0.00 107 K 8.73 3.61 0.00 0.79 1.11 0.00 1.37 0.00 0.00 1.35 0.00 0.00 2.62 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.68 0.21 7.81 108 L 8.18 4.44 0.00 1.45 1.58 0.95 0.72 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 0.00 109 K 8.85 4.15 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.69 4.61 0.00 3.93 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 0.00 111 A 8.36 4.41 1.25 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 0.00 0.00 0.00 112 A 8.98 4.23 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 0.00 113 S 9.28 4.47 0.00 3.86 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 0.00 114 L 8.49 4.48 0.00 1.64 1.62 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.88 4.66 0.00 2.84 2.92 0.00 0.00 6.60 7.64 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 0.00 116 S 8.86 4.20 0.00 4.01 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 0.00 117 R 8.69 4.10 0.00 1.91 2.19 0.00 3.24 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.45 0.00 4.00 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 0.00 128 C 8.43 4.41 0.00 2.93 2.98 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 0.00 129 A 8.01 4.46 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 0.00 130 S 8.07 4.38 0.00 3.98 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 *132 A 8.18 4.32 1.25 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 0.00 0.00 0.00 133 G 9.18 4.03 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 0.00 134 T 7.63 3.92 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 1.14 0.00 0.00 135 Q 8.57 4.70 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 136 C 9.27 5.26 0.00 2.78 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 0.00 137 L 9.07 5.16 0.00 1.75 1.57 1.00 1.12 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 0.00 138 I 9.20 5.21 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.58 0.98 0.00 0.00 139 S 8.75 4.95 0.00 3.49 3.57 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 0.00 140 G 7.37 3.81 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 0.00 0.00 0.00 141 W 8.59 4.69 0.00 3.08 2.97 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 0.00 142 G 8.27 4.14 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 0.00 0.00 0.00 143 N 8.69 3.83 0.00 2.31 2.65 0.00 0.00 7.13 7.88 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 0.00 144 T 8.41 5.06 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 1.28 0.00 0.00 145 K 7.75 4.60 0.00 1.91 1.85 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.28 1.29 7.81 146 S 8.73 4.16 0.00 4.02 4.03 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 0.00 147 S 8.00 4.36 0.00 3.80 3.79 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 0.00 148 G 8.77 3.78 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 0.00 0.00 0.00 149 T 7.85 4.62 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 1.33 0.00 0.00 150 S 8.97 4.28 0.00 3.77 3.61 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 0.00 151 Y 8.57 5.00 0.00 2.99 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 0.00 152 P 0.00 4.71 0.00 2.46 2.11 0.00 4.18 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 2.19 2.05 0.00 153 D 8.74 4.62 0.00 2.80 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 0.00 154 V 7.39 5.68 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 0.64 0.00 0.00 0.97 0.00 0.00 155 L 8.17 3.19 0.00 1.20 1.26 -0.58 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.17 4.85 0.00 1.69 1.51 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.48 7.81 157 C 8.69 5.28 0.00 1.54 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 0.00 158 L 8.44 4.88 0.00 1.71 1.46 1.02 0.74 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 0.00 159 K 8.99 5.14 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.64 7.81 160 A 9.10 4.81 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 0.00 161 P 0.00 5.07 0.00 2.02 2.08 0.00 3.12 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 1.74 1.75 0.00 162 I 8.41 4.43 1.88 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.76 0.72 0.00 0.00 163 L 8.78 4.77 0.00 1.55 1.61 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.43 4.37 0.00 4.00 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 0.00 165 D 8.75 4.46 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 0.00 166 S 8.01 4.14 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 0.00 167 S 7.95 4.22 0.00 4.06 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 0.00 168 C 8.33 4.32 0.00 3.23 3.32 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 0.00 169 K 8.52 3.97 0.00 1.86 1.90 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.62 7.81 170 S 8.23 4.20 0.00 4.06 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 0.00 171 A 7.59 4.03 1.19 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 0.00 0.00 172 Y 7.91 4.89 0.00 3.18 3.15 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 0.00 173 P 0.00 4.61 0.00 2.21 2.12 0.00 3.58 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 174 G 9.09 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 0.00 0.00 0.00 175 Q 8.14 4.52 0.00 2.47 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.62 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 176 I 7.85 4.38 1.98 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 1.85 0.94 0.99 0.00 0.00 177 T 8.22 4.54 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 1.25 0.00 0.00 178 S 8.54 4.33 0.00 4.00 4.05 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 0.00 179 N 8.08 5.00 0.00 2.84 3.08 0.00 0.00 6.59 8.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.91 5.58 0.00 1.86 2.09 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 181 F 8.68 5.12 0.00 3.09 3.11 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 0.00 182 C 9.04 5.50 0.00 2.99 3.10 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 0.00 183 A 9.22 5.02 1.15 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 0.00 0.00 0.00 184A G 6.97 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 0.00 184 Y 8.42 4.65 0.00 3.06 3.12 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 0.00 185 L 8.64 4.15 0.00 1.74 1.73 0.92 0.97 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 0.00 186 E 8.24 4.15 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 2.36 2.44 0.00 187 G 7.87 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.62 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 0.00 188 K 7.24 5.52 0.00 1.44 1.69 0.00 0.81 0.00 0.00 1.98 0.00 0.00 2.54 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.37 1.02 7.81 189 D 8.40 4.62 0.00 2.78 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 0.00 190 S 8.82 4.92 0.00 4.00 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 0.00 191 C 9.58 4.81 0.00 2.90 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 0.00 192 Q 8.60 4.48 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.54 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 193 G 9.33 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 0.00 194 D 8.59 4.65 0.00 3.02 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 0.00 195 S 8.05 4.33 0.00 3.98 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 0.00 196 G 8.90 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 0.00 0.00 0.00 0.00 197 G 8.05 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 0.00 198 P 0.00 5.13 0.00 2.34 2.38 0.00 3.71 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 199 V 8.46 4.63 2.27 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 0.84 0.00 0.00 0.65 0.00 0.00 200 V 8.85 4.76 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 0.67 0.00 0.00 0.63 0.00 0.00 201 C 8.75 5.07 0.00 2.78 2.98 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 0.00 202 S 9.56 3.56 0.00 3.96 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 0.00 203 G 8.32 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 0.00 204 K 7.56 4.75 0.00 1.73 1.63 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.32 4.20 0.00 1.51 1.63 0.99 0.77 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 0.00 210 Q 8.91 4.50 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.03 5.33 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 0.00 212 I 8.17 5.17 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 1.31 0.89 0.96 0.00 0.00 213 V 9.03 3.56 2.37 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 1.00 0.00 0.00 1.20 0.00 0.00 214 S 8.54 4.91 0.00 3.88 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.52 4.98 0.00 3.38 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 0.00 216 G 8.21 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 0.00 0.00 0.00 217 S 8.04 4.79 0.00 4.15 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 *219 G 8.10 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 0.00 0.00 0.00 0.00 220 C 8.42 4.87 0.00 2.96 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 221A A 9.39 4.00 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 0.00 221 Q 7.33 4.54 0.00 2.28 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.50 4.20 0.00 1.72 1.73 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.30 4.27 0.00 2.82 2.83 0.00 0.00 6.80 7.48 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 0.00 224 K 7.61 4.31 0.00 1.76 1.80 0.00 1.57 0.00 0.00 1.36 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.49 7.81 225 P 0.00 4.64 0.00 2.14 2.11 0.00 3.70 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 226 G 8.46 3.63 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 0.00 0.00 0.00 227 V 7.56 4.43 0.67 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 0.40 0.00 0.00 -0.86 0.00 0.00 228 Y 8.22 4.85 0.00 1.43 2.40 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 0.00 229 T 8.55 4.50 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 1.24 0.00 0.00 230 K 9.26 5.07 0.00 2.14 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.64 7.81 231 V 8.84 3.95 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 0.93 0.00 0.00 1.11 0.00 0.00 232 C 8.39 4.57 0.00 3.16 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 0.00 233 N 7.94 4.28 0.00 2.44 2.35 0.00 0.00 6.79 7.28 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 0.00 234 Y 8.19 4.85 0.00 3.18 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 0.00 235 V 8.12 3.67 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 1.09 0.00 0.00 1.09 0.00 0.00 236 S 8.13 4.13 0.00 3.99 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 0.00 237 W 8.30 4.15 0.00 3.52 3.62 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 0.00 238 I 8.41 3.19 2.04 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 1.65 0.96 0.76 0.00 0.00 239 K 8.04 3.75 0.00 1.87 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.57 7.81 240 Q 8.18 3.92 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 241 T 7.38 3.59 3.31 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 0.79 0.00 0.00 242 I 7.25 2.80 1.39 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.39 0.34 0.00 0.00 243 A 7.66 4.01 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 0.00 244 S 7.34 4.60 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 0.00 245 N 7.87 4.68 0.00 2.99 3.03 0.00 0.00 6.74 8.16 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 * Residues marked with a * may have inaccurate shift predictions.