NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2703 7.8827 121.4508 61.2096 38.7178 173.7699 17 V 4.3642 8.8110 125.8814 61.7471 32.8242 174.4753 18 G 3.7086 8.4523 113.9098 46.5234 0.0000 173.3446 19 G 4.1686 7.7115 109.7833 44.0978 0.0000 172.6495 20 Y 4.9637 7.8230 116.6297 55.1396 42.1735 174.9388 21 T 4.2095 8.6209 117.2404 64.0653 68.4488 175.0429 22 C 4.3295 8.6385 125.5002 61.2374 35.0044 174.2628 23 G 4.0565 8.7254 106.1584 43.4813 0.0000 172.7744 24 A 4.2233 8.7187 126.0989 53.7232 18.3876 176.8083 25 N 4.2522 8.8432 119.6912 54.8074 36.0626 175.4407 26 T 4.1879 7.6622 107.1636 62.6188 70.0799 174.8981 27 V 4.0717 7.0219 121.5757 59.9640 31.4821 173.7902 28 P 4.4467 0.0000 0.0000 64.3874 31.6867 178.1370 29 Y 5.0823 6.7862 115.1250 56.8027 38.8569 174.7422 30 Q 4.6109 7.4663 123.4783 56.3398 29.1766 175.4899 31 V 4.9104 8.8739 118.5975 59.6662 36.4276 174.1229 32 S 4.9741 8.7497 116.7456 56.5656 64.9928 172.6544 33 L 4.6465 8.5892 127.5919 53.4679 43.1508 175.0222 34 N 5.7641 9.2601 122.8731 49.9869 41.9230 174.9566 *37 S 4.2467 8.3928 120.8410 58.4076 64.1261 174.3632 38 G 4.0151 9.7751 109.1053 46.5215 0.0000 172.7604 39 Y 4.5317 6.5547 115.2272 56.1813 40.0796 172.6703 40 H 4.5958 8.8162 121.3287 56.2055 30.3285 174.6950 41 F 5.0282 7.5838 119.3667 56.6184 39.5671 173.6391 42 C 4.6945 6.7937 114.9246 56.4318 44.6730 173.1545 43 G 4.2737 8.7139 109.3427 45.4471 0.0000 172.1332 44 G 4.5661 7.9428 105.1747 46.4787 0.0000 172.4686 45 S 5.4713 8.8403 115.4155 56.4718 67.0455 173.6645 46 L 4.8264 9.1987 127.5736 54.8143 42.3528 177.0931 47 I 4.3881 8.4397 119.9685 61.0401 38.7870 174.5907 48 N 4.5147 7.6609 117.4623 52.1126 39.3215 175.1810 49 S 4.2282 8.5162 112.6657 60.8912 62.9452 175.2068 50 Q 4.6151 9.1380 118.2554 55.0767 30.9480 175.0426 51 W 5.4785 8.5165 119.5315 54.7551 33.4528 174.4496 52 V 5.0576 9.0774 122.7525 61.1876 34.5581 174.1729 53 V 4.8681 8.8790 127.1913 61.8010 33.9937 174.7268 54 S 4.8195 8.8989 120.1961 57.8262 66.0755 171.8558 55 A 4.7569 8.5523 120.8567 50.6782 20.3512 178.4940 56 A 3.8161 8.4047 125.0007 55.2805 18.4928 178.9866 57 H 4.5489 8.4318 109.2968 57.1883 28.7231 175.2698 58 C 4.6948 7.8933 117.2862 57.0556 40.5241 173.3209 59 Y 4.2124 7.5525 121.8632 57.9455 38.8492 175.1854 60 K 3.8004 6.5070 124.4309 55.0644 34.9706 174.8658 61 S 4.0406 8.0820 118.4916 58.6235 63.6245 173.7132 62 G 3.7985 8.2563 112.5372 46.4680 0.0000 173.1075 63 I 4.3549 7.0356 119.6003 60.1349 40.1285 176.0820 64 Q 4.7892 8.8195 127.4183 54.2301 31.7471 174.1472 65 V 4.4891 8.9615 126.9029 61.7993 33.6618 174.5641 66 R 5.1584 8.9602 127.1310 54.6834 32.4542 175.1975 67 L 4.7709 9.1933 124.6201 52.7071 44.9193 177.5591 *69 G 4.0071 8.2628 107.3214 45.3772 0.0000 172.7720 70 E 4.4237 8.1750 118.4532 55.5152 29.8987 174.2065 71 D 4.8088 7.9366 117.9915 54.9295 44.0460 174.2144 72 N 5.0496 8.9595 120.7839 52.7163 39.1420 176.1825 73 I 3.8111 8.5263 119.9402 62.2304 37.7523 176.2531 74 N 4.8725 8.6784 117.9784 52.9139 39.1485 174.4011 75 V 4.2784 7.5136 117.9253 60.7636 34.2682 175.0319 76 V 3.9831 8.5077 127.0587 63.0423 30.9258 175.1002 77 E 4.2966 9.6504 128.3081 55.9776 30.0914 177.3046 78 G 4.0614 8.1024 105.1005 45.3525 0.0000 173.8925 79 N 5.0316 8.1005 115.3646 52.7290 40.9042 174.0738 80 E 5.0647 8.0019 118.1022 55.8967 30.9662 176.3779 81 Q 4.2748 8.4279 119.8352 54.4608 32.9483 173.8652 82 F 5.6277 8.7606 123.4226 56.0592 40.8028 175.3803 83 I 4.6614 8.8403 125.0762 59.4030 40.7089 175.6919 84 S 4.7470 8.7072 122.3746 58.2456 64.2675 173.3107 85 A 4.6195 8.3339 124.9281 51.9658 18.5778 177.6741 86 S 4.5302 8.7677 115.6696 59.3546 64.8633 174.4900 87 K 4.6486 7.5722 119.8315 55.1661 35.4967 174.5202 88 S 5.2348 8.7757 121.6938 56.8870 66.2575 173.8269 89 I 4.5909 9.2949 124.3719 59.4808 39.9283 174.7395 90 V 4.2071 8.4299 127.2509 62.1906 32.6084 175.1476 91 H 3.4849 8.6286 126.9572 55.8849 29.9785 174.2245 92 P 4.2385 0.0000 0.0000 65.5417 31.0230 177.0757 93 S 4.6807 7.8390 112.3146 57.9865 63.0899 173.2149 94 Y 4.3056 7.8392 122.4440 57.9516 38.9779 175.1263 95 N 4.5062 8.0739 125.6218 51.3838 40.0128 175.1429 96 S 3.9626 7.9520 120.8996 60.2616 63.5190 175.0513 97 N 4.4486 8.1324 118.5494 54.7291 38.6207 175.8170 98 T 4.1179 7.4882 104.9496 60.1446 70.4861 174.4492 99 L 3.7642 8.1285 121.0156 55.3895 39.7926 173.9129 100 N 4.4543 7.6392 118.2669 54.7531 39.4028 174.6546 101 N 4.6538 8.7567 120.4918 54.2502 35.8363 175.4649 102 D 4.8079 8.0642 117.8270 53.1552 39.7681 174.4852 103 I 4.8163 7.2963 121.1083 59.4897 42.1941 172.5555 104 M 5.4265 9.2768 126.5515 54.3134 36.3126 173.2791 105 L 5.3935 9.3466 124.1987 53.1952 45.2382 175.5493 106 I 5.0085 9.0068 122.6174 59.5573 40.9751 174.1975 107 K 3.7655 8.5945 128.9616 54.6163 32.8392 175.5556 108 L 4.4668 8.2193 127.2987 54.0007 42.5907 178.1473 109 K 4.2457 8.7476 122.5664 59.0940 32.4828 177.5641 110 S 4.5789 7.4662 108.8004 55.8956 66.1153 173.4951 111 A 4.3873 8.3916 123.4890 52.0587 18.7100 177.3861 112 A 4.1852 8.9448 124.1191 51.8085 19.6420 177.3609 113 S 4.4564 9.0655 116.3795 57.0904 62.9040 173.9722 114 L 4.5032 8.5073 128.4708 54.4353 42.4370 176.2930 115 N 4.8966 8.7097 119.8624 52.0790 39.6863 174.8020 116 S 4.1928 8.7542 111.4462 60.9673 63.1759 174.7732 117 R 4.3486 7.9357 118.5563 55.9192 31.2967 175.4544 118 V 4.5415 7.6293 117.4785 60.9003 33.1472 173.5797 119 A 5.2407 8.4235 128.0427 50.0679 22.8930 175.0482 120 S 5.0872 8.7257 113.9189 57.7100 64.9337 173.1014 121 I 4.4594 8.1945 121.1845 59.2132 39.5159 175.4270 122 S 4.4516 8.3733 123.8415 58.2624 64.1076 173.8927 123 L 4.2706 8.3102 122.8037 53.4319 42.5235 175.3377 124 P 4.4793 0.0000 0.0000 62.9363 31.9816 176.5741 125 T 4.2104 8.2552 109.8158 62.3133 70.2394 174.6034 *127 S 4.5545 7.5704 114.5073 58.0104 64.0448 173.9061 128 C 4.4130 8.3856 117.8061 56.5793 40.7409 173.6329 129 A 4.4352 8.0431 125.1802 51.3492 19.8815 176.9531 130 S 4.5188 8.0331 113.4090 56.3129 65.6814 173.1979 *132 A 4.2681 8.1911 123.1373 53.3866 19.2262 176.9529 133 G 4.0064 9.0606 109.8901 45.4295 0.0000 174.4025 134 T 4.0809 7.4817 116.9058 63.4197 69.5365 173.7164 135 Q 4.7338 8.5713 127.4179 55.8484 30.1635 175.2926 136 C 5.2741 9.4427 122.6087 55.1143 46.4987 172.3156 137 L 5.1489 9.1000 122.7091 53.5631 43.9601 175.0476 138 I 5.1371 9.2812 127.2653 58.8009 40.0293 174.8517 139 S 4.9314 8.5418 119.2858 56.5364 66.4688 173.0383 140 G 3.8063 7.4686 108.4895 46.2151 0.0000 173.0105 141 W 4.5954 8.7304 117.0573 56.2792 29.3960 177.0716 142 G 4.1642 8.5686 109.3358 44.3133 0.0000 173.5316 143 N 3.6780 8.7289 118.4691 54.2744 38.9406 174.5061 144 T 5.1012 8.1340 112.9145 60.4470 69.4046 174.1534 145 K 4.6155 7.7564 121.3919 54.7888 34.5710 176.4171 146 S 4.2902 8.6098 117.2051 59.9688 63.6594 174.3293 147 S 4.4085 8.0450 116.2031 58.7129 65.2451 173.3079 148 G 3.8463 9.3350 112.4192 44.1336 0.0000 171.2889 149 T 4.6523 7.8568 113.8577 61.8796 72.1706 174.4120 150 S 4.2984 8.9987 120.4459 58.1453 65.2115 172.4364 151 Y 4.9722 8.5619 125.9566 55.6868 38.9702 174.4979 152 P 4.6339 0.0000 0.0000 62.7795 32.6210 175.7039 153 D 4.7653 8.6848 117.8664 54.9509 42.0396 176.7825 154 V 5.3740 7.4624 110.7059 58.2517 34.5619 175.5938 155 L 3.1439 8.2002 125.0974 55.1340 42.9598 175.9910 156 K 4.8237 8.1937 125.1841 54.8993 35.0006 174.6386 157 C 5.2013 8.6984 120.0249 55.2155 40.2768 172.9478 158 L 4.8768 8.4527 122.1159 54.0181 45.6198 174.1854 159 K 5.1387 8.9694 125.5427 55.2219 33.7023 175.7486 160 A 4.8985 9.3366 125.6910 49.4299 23.1779 173.3216 161 P 5.0812 0.0000 0.0000 61.5828 34.1372 174.9792 162 I 4.4069 8.3151 122.4713 61.3636 38.2062 175.3051 163 L 5.0973 8.7426 126.2970 52.3372 44.7929 176.6583 164 S 4.2963 8.4532 114.6769 58.3292 63.9226 174.9455 165 D 4.4246 8.9607 122.6715 57.9232 40.4893 179.2934 166 S 4.1754 8.2396 113.9177 61.8299 62.3520 176.6096 167 S 4.0888 7.8501 117.8719 61.4224 62.5706 175.3447 168 C 4.4993 8.0433 117.8323 59.1453 35.8685 175.8519 169 K 4.0443 7.9759 119.6334 59.2814 31.4341 178.7219 170 S 3.9859 7.9621 113.0488 61.2640 62.1733 175.0765 171 A 4.6308 7.8461 118.5014 51.7286 19.1134 176.1331 172 S 4.5436 7.7197 112.6354 58.8981 63.0652 174.2927 173 S 4.6470 8.7384 121.0059 58.1569 63.3643 173.5643 174 A 4.8001 7.6744 122.9867 49.6934 21.5881 176.4326 175 I 3.8610 8.1190 120.7703 61.3241 37.6922 176.1593 176 I 4.5773 8.3204 125.4609 59.8157 38.8887 175.5899 177 T 4.4458 8.2917 116.5901 60.1462 70.3639 175.4349 178 S 4.4150 8.5151 114.5344 60.0261 63.2694 174.2516 179 N 4.9328 8.2033 118.5697 53.4396 38.5010 173.8958 180 M 5.5774 7.9434 116.9128 53.6623 36.1514 174.5520 181 F 5.1311 8.9020 115.4788 55.4678 42.4140 172.3420 182 C 5.2685 8.9661 119.4679 55.4202 43.0883 172.1143 183 A 5.0183 8.9894 126.0670 50.9570 22.3901 174.6286 184 G 4.0809 7.0626 108.2488 44.7079 0.0000 172.7012 184A Y 4.7358 8.3854 119.5871 56.1614 41.6118 176.4454 185 L 4.2442 8.5670 122.8069 57.2159 42.2531 178.0188 186 E 4.4818 8.4030 116.6510 55.5947 29.4489 177.9236 187 G 3.8733 8.8952 109.8984 45.3613 0.0000 173.0829 188 G 4.0916 9.1428 105.8341 44.8481 0.0000 173.5417 188A K 5.0580 7.3028 117.3756 54.8285 35.5756 175.2912 189 D 4.6072 8.5892 123.3316 53.9360 45.6754 175.2054 190 S 4.8862 8.8281 117.0346 58.1365 65.2356 173.0987 191 C 4.7768 9.3814 118.7522 55.4876 44.9149 172.3685 192 Q 4.4699 8.6434 118.6019 57.7704 28.5565 177.4913 193 G 4.3302 9.2800 110.5972 45.8288 0.0000 174.1540 194 D 4.6903 8.4217 118.6253 55.5032 41.7169 176.7410 195 S 4.5303 8.0865 115.2935 60.4512 63.5254 175.6271 196 G 4.1725 8.9853 112.2002 46.4145 0.0000 173.7289 197 G 4.4201 7.9283 107.5554 45.2997 0.0000 171.2240 198 P 5.1913 0.0000 0.0000 62.2407 33.7478 175.7433 199 V 4.5603 8.4143 120.2563 61.4527 34.1972 173.7071 200 V 4.8118 8.7235 128.6549 61.3015 33.7581 173.7852 201 C 5.0796 8.6851 124.5895 55.5940 43.9284 174.6080 202 S 3.3543 9.6950 120.3514 59.7690 60.0265 173.1852 203 G 3.9328 8.3792 103.7425 45.8133 0.0000 173.7329 204 K 4.7050 7.4765 117.6485 52.9645 35.3709 175.5934 *209 L 4.3165 8.2490 122.7076 55.4201 41.9634 175.8557 210 Q 4.4246 8.6971 125.8817 56.9297 30.4723 175.7435 211 G 5.3729 7.9772 104.6111 46.0038 0.0000 171.5154 212 I 5.1816 8.2599 119.5393 58.8754 41.1470 175.3424 213 V 3.7973 8.9091 127.2922 64.1220 31.8013 174.2197 214 S 4.8688 8.5428 120.8867 58.6717 64.3122 174.3186 215 W 5.0090 7.4828 114.3098 56.4188 31.9301 172.1230 216 G 3.9975 8.4077 106.0502 46.8609 0.0000 173.7076 217 S 4.6312 8.1424 114.8462 56.3938 62.1831 172.9230 *219 G 4.2431 7.8677 117.4983 45.2783 0.0000 170.5888 220 C 4.8902 8.2688 117.1160 56.6275 45.6197 173.8053 221 A 3.8781 8.9384 126.5656 53.1828 16.8011 176.6049 221A Q 4.6875 7.2640 116.1616 55.8304 30.1431 176.2935 222 K 4.3304 8.3642 120.9092 58.0457 32.5465 177.4567 223 N 4.4813 9.1216 118.8159 53.7041 37.2348 175.3349 224 K 4.4509 7.6631 117.1247 53.6474 32.6464 173.9130 225 P 4.6306 0.0000 0.0000 61.5593 33.3902 176.4095 226 G 3.5681 8.4284 106.6575 46.0410 0.0000 172.7537 227 V 4.4097 7.5111 121.1374 60.7284 33.7955 174.1647 228 Y 4.9301 8.0493 124.4635 55.9248 42.1465 175.0316 229 T 4.4042 8.4890 119.6051 63.6301 70.1163 174.2261 230 K 5.0276 9.3353 128.2943 55.4538 31.8659 177.1825 231 V 3.9749 8.7796 127.2392 66.0538 31.3590 174.9662 232 C 4.5377 8.4145 112.6108 58.5688 41.3096 175.0272 233 N 4.2010 7.9879 116.7586 54.6059 38.4880 175.6405 234 Y 4.8322 8.1714 117.5792 57.5084 38.6357 177.2820 235 V 3.6758 7.9036 121.3293 66.2563 31.5076 177.9198 236 S 4.1198 8.1204 114.1721 61.4692 62.7986 176.2820 237 W 4.2203 8.3662 130.4099 60.5330 30.4710 177.8225 238 I 3.0543 8.2077 119.8589 64.2147 36.5845 178.6278 239 K 3.7991 8.1407 119.4770 59.4293 31.7012 179.5637 240 Q 3.8820 8.1221 118.4438 59.1795 28.4080 178.9098 241 T 3.6221 7.2389 115.5797 66.5502 68.2203 176.5718 242 I 2.5835 7.0047 121.4360 63.8220 36.7460 178.3955 243 A 4.0121 7.5870 120.3686 54.1653 18.2580 178.7393 244 S 4.6311 7.3537 111.1558 58.4819 63.5849 174.0544 245 N 4.7126 7.8744 124.3936 53.4587 39.2472 174.0492 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 4.27 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 1.37 0.62 0.85 0.00 0.00 17 V 8.81 4.36 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 1.02 0.00 0.00 0.93 0.00 0.00 18 G 8.45 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 19 G 7.71 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 0.00 0.00 0.00 20 Y 7.82 4.96 0.00 3.01 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 21 T 8.62 4.21 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 8.64 4.33 0.00 2.76 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.73 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.72 4.22 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 25 N 8.84 4.25 0.00 2.89 2.91 0.00 0.00 7.18 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 7.66 4.19 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 1.25 0.00 0.00 27 V 7.02 4.07 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 0.36 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.45 0.00 2.37 2.30 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.96 0.00 29 Y 6.79 5.08 0.00 3.26 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 7.47 4.61 0.00 1.83 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.74 0.00 0.00 0.00 0.00 0.00 1.91 2.49 0.00 31 V 8.87 4.91 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 0.92 0.00 0.00 0.99 0.00 0.00 32 S 8.75 4.97 0.00 3.02 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 33 L 8.59 4.65 0.00 0.46 0.95 0.79 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.26 5.76 0.00 2.39 2.46 0.00 0.00 6.78 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 *37 S 8.39 4.25 0.00 3.70 3.65 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 0.00 0.00 0.00 0.00 38 G 9.78 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 39 Y 6.55 4.53 0.00 3.06 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 40 H 8.82 4.60 0.00 2.86 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.58 5.03 0.00 3.05 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 42 C 6.79 4.69 0.00 2.21 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 8.71 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.94 4.57 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 0.00 0.00 0.00 45 S 8.84 5.47 0.00 3.80 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 46 L 9.20 4.83 0.00 1.87 1.68 1.08 1.19 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 47 I 8.44 4.39 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.89 0.95 0.00 0.00 48 N 7.66 4.51 0.00 2.98 2.98 0.00 0.00 6.00 7.74 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 49 S 8.52 4.23 0.00 4.18 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 0.00 50 Q 9.14 4.62 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 51 W 8.52 5.48 0.00 3.24 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 52 V 9.08 5.06 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 1.19 0.00 0.00 0.98 0.00 0.00 53 V 8.88 4.87 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 1.07 0.00 0.00 1.00 0.00 0.00 54 S 8.90 4.82 0.00 3.93 3.72 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 55 A 8.55 4.76 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 56 A 8.40 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.43 4.55 0.00 3.40 3.60 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 7.89 4.69 0.00 3.26 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 0.00 59 Y 7.55 4.21 0.00 2.99 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 60 K 6.51 3.80 0.00 1.11 1.04 0.00 0.71 0.00 0.00 1.14 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.02 7.81 61 S 8.08 4.04 0.00 3.83 3.65 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 0.00 0.00 0.00 0.00 62 G 8.26 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 0.00 0.00 0.00 63 I 7.04 4.35 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 1.32 0.62 0.93 0.00 0.00 64 Q 8.82 4.79 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 65 V 8.96 4.49 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 0.99 0.00 0.00 0.90 0.00 0.00 66 R 8.96 5.16 0.00 1.67 1.82 0.00 2.67 0.00 0.00 2.59 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.25 0.00 67 L 9.19 4.77 0.00 1.59 1.63 0.96 0.69 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 *69 G 8.26 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 0.00 0.00 0.00 70 E 8.18 4.42 0.00 2.15 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 2.55 2.14 0.00 71 D 7.94 4.81 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 72 N 8.96 5.05 0.00 2.84 2.82 0.00 0.00 7.17 7.32 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 73 I 8.53 3.81 1.47 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 1.21 0.52 -0.32 0.00 0.00 74 N 8.68 4.87 0.00 2.81 2.85 0.00 0.00 6.61 7.50 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 75 V 7.51 4.28 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 8.51 3.98 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 0.81 0.00 0.00 0.98 0.00 0.00 77 E 9.65 4.30 0.00 1.97 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 2.30 2.50 0.00 78 G 8.10 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.10 5.03 0.00 2.61 2.76 0.00 0.00 7.14 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 8.00 5.06 0.00 1.42 1.70 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 2.55 2.28 0.00 81 Q 8.43 4.27 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 82 F 8.76 5.63 0.00 2.84 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 83 I 8.84 4.66 1.88 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 1.24 0.77 0.93 0.00 0.00 84 S 8.71 4.75 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 8.33 4.62 1.18 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 86 S 8.77 4.53 0.00 3.78 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 87 K 7.57 4.65 0.00 1.79 1.53 0.00 1.75 0.00 0.00 1.93 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.51 7.81 88 S 8.78 5.23 0.00 3.96 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 89 I 9.29 4.59 2.08 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 1.26 1.03 1.18 0.00 0.00 90 V 8.43 4.21 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 0.63 0.00 0.00 0.85 0.00 0.00 91 H 8.63 3.48 0.00 2.85 3.05 0.00 5.66 0.00 0.00 0.00 0.00 6.64 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 4.24 0.00 2.14 2.16 0.00 2.40 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.78 0.00 93 S 7.84 4.68 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.84 4.31 0.00 2.85 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 95 N 8.07 4.51 0.00 2.59 2.43 0.00 0.00 6.63 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 96 S 7.95 3.96 0.00 3.96 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 97 N 8.13 4.45 0.00 2.78 2.79 0.00 0.00 6.76 7.15 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 98 T 7.49 4.12 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 1.09 0.00 0.00 99 L 8.13 3.76 0.00 1.40 1.87 0.82 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.64 4.45 0.00 2.68 2.65 0.00 0.00 7.25 6.67 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 0.00 101 N 8.76 4.65 0.00 2.94 2.66 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 4.81 0.00 3.15 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 0.00 103 I 7.30 4.82 1.53 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 1.39 1.27 0.26 0.00 0.00 104 M 9.28 5.43 0.00 2.13 1.85 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 105 L 9.35 5.39 0.00 1.75 1.88 0.09 0.63 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 0.00 106 I 9.01 5.01 1.91 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 1.19 0.91 0.88 0.00 0.00 107 K 8.59 3.77 0.00 0.79 1.04 0.00 1.26 0.00 0.00 1.35 0.00 0.00 2.66 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.22 4.47 0.00 1.55 1.54 0.90 0.73 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 0.00 109 K 8.75 4.25 0.00 1.65 1.84 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.50 7.81 110 S 7.47 4.58 0.00 3.88 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 0.00 111 A 8.39 4.39 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 8.94 4.19 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 0.00 113 S 9.07 4.46 0.00 3.87 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 0.00 114 L 8.51 4.50 0.00 1.70 1.61 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.71 4.90 0.00 2.86 2.91 0.00 0.00 6.40 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.75 4.19 0.00 4.01 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 0.00 117 R 7.94 4.35 0.00 1.88 1.99 0.00 3.18 0.00 0.00 3.27 7.31 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.55 0.00 4.00 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 0.00 128 C 8.39 4.41 0.00 2.94 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 8.04 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.03 4.52 0.00 3.95 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.19 4.27 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 9.06 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 0.00 0.00 0.00 134 T 7.48 4.08 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.57 4.73 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 136 C 9.44 5.27 0.00 2.76 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 0.00 137 L 9.10 5.15 0.00 1.75 1.57 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.28 5.14 1.87 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 0.77 1.31 0.97 0.00 0.00 139 S 8.54 4.93 0.00 3.51 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.47 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 8.73 4.60 0.00 3.19 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 8.57 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 0.00 0.00 0.00 143 N 8.73 3.68 0.00 2.13 2.59 0.00 0.00 7.10 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 0.00 144 T 8.13 5.10 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 145 K 7.76 4.62 0.00 1.80 1.86 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.26 1.27 7.81 146 S 8.61 4.29 0.00 4.10 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 0.00 147 S 8.05 4.41 0.00 3.82 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 0.00 148 G 9.33 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.86 4.65 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 150 S 9.00 4.30 0.00 3.82 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 0.00 151 Y 8.56 4.97 0.00 2.97 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 0.00 152 P 0.00 4.63 0.00 2.45 2.10 0.00 4.13 0.00 0.00 3.81 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 8.68 4.77 0.00 2.79 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 0.00 154 V 7.46 5.37 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 1.08 0.00 0.00 0.98 0.00 0.00 155 L 8.20 3.14 0.00 1.13 1.25 -0.74 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.82 0.00 1.69 1.50 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 157 C 8.70 5.20 0.00 1.58 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 0.00 0.00 0.00 0.00 158 L 8.45 4.88 0.00 1.69 1.44 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.97 5.14 0.00 1.82 1.82 0.00 1.84 0.00 0.00 1.94 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.66 7.81 160 A 9.34 4.90 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 0.00 161 P 0.00 5.08 0.00 2.01 2.08 0.00 3.09 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.71 0.00 162 I 8.32 4.41 1.90 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.36 0.85 0.00 0.00 163 L 8.74 5.10 0.00 1.45 1.55 0.89 0.77 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 0.00 164 S 8.45 4.30 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 8.96 4.42 0.00 2.76 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 0.00 166 S 8.24 4.18 0.00 4.05 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 0.00 167 S 7.85 4.09 0.00 4.02 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 0.00 168 C 8.04 4.50 0.00 3.05 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 0.00 169 K 7.98 4.04 0.00 1.82 1.89 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.66 7.81 170 S 7.96 3.99 0.00 3.94 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 0.00 171 A 7.85 4.63 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 S 7.72 4.54 0.00 4.13 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 0.00 173 S 8.74 4.65 0.00 3.91 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 0.00 174 A 7.67 4.80 1.04 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 0.00 175 I 8.12 3.86 1.83 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 1.39 0.82 0.93 0.00 0.00 176 I 8.32 4.58 1.97 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 1.80 1.02 0.99 0.00 0.00 177 T 8.29 4.45 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.52 4.42 0.00 4.02 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 8.20 4.93 0.00 2.94 3.10 0.00 0.00 6.65 7.02 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 0.00 180 M 7.94 5.58 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 181 F 8.90 5.13 0.00 3.05 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 0.00 182 C 8.97 5.27 0.00 3.06 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 0.00 183 A 8.99 5.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.06 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 184A Y 8.39 4.74 0.00 3.07 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 0.00 185 L 8.57 4.24 0.00 1.75 1.74 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.40 4.48 0.00 2.00 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 2.33 2.28 0.00 187 G 8.90 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.14 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 0.00 0.00 0.00 188A K 7.30 5.06 0.00 1.39 1.64 0.00 0.61 0.00 0.00 1.12 0.00 0.00 2.51 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.17 1.14 7.81 189 D 8.59 4.61 0.00 2.79 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 8.83 4.89 0.00 4.01 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 0.00 191 C 9.38 4.78 0.00 2.90 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.64 4.47 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.31 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 193 G 9.28 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 0.00 0.00 0.00 0.00 194 D 8.42 4.69 0.00 3.05 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 0.00 195 S 8.09 4.53 0.00 3.99 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 0.00 196 G 8.99 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 0.00 0.00 0.00 197 G 7.93 4.42 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 0.00 0.00 0.00 198 P 0.00 5.19 0.00 2.29 2.34 0.00 3.71 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 199 V 8.41 4.56 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 0.85 0.00 0.00 0.71 0.00 0.00 200 V 8.72 4.81 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 0.88 0.00 0.00 0.60 0.00 0.00 201 C 8.69 5.08 0.00 2.79 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 0.00 202 S 9.70 3.35 0.00 3.94 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 0.00 203 G 8.38 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.48 4.71 0.00 1.72 1.63 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.40 7.81 *209 L 8.25 4.32 0.00 1.50 1.64 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.70 4.42 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.36 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 7.98 5.37 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 0.00 212 I 8.26 5.18 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.81 0.98 0.00 0.00 213 V 8.91 3.80 2.39 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 0.97 0.00 0.00 1.17 0.00 0.00 214 S 8.54 4.87 0.00 3.95 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 0.00 215 W 7.48 5.01 0.00 3.44 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 0.00 216 G 8.41 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 0.00 217 S 8.14 4.63 0.00 3.96 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 *219 G 7.87 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 0.00 220 C 8.27 4.89 0.00 2.94 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 0.00 221 A 8.94 3.88 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 221A Q 7.26 4.69 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 222 K 8.36 4.33 0.00 1.76 1.77 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.48 7.81 223 N 9.12 4.48 0.00 2.89 3.01 0.00 0.00 6.75 8.28 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 0.00 224 K 7.66 4.45 0.00 1.73 1.70 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.51 7.81 225 P 0.00 4.63 0.00 2.21 2.08 0.00 3.74 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 1.94 1.96 0.00 226 G 8.43 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 0.00 0.00 0.00 227 V 7.51 4.41 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 0.47 0.00 0.00 -0.33 0.00 0.00 228 Y 8.05 4.93 0.00 1.43 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 0.00 229 T 8.49 4.40 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 1.27 0.00 0.00 230 K 9.34 5.03 0.00 2.16 1.93 0.00 1.70 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.61 7.81 231 V 8.78 3.97 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 1.00 0.00 0.00 1.12 0.00 0.00 232 C 8.41 4.54 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 7.99 4.20 0.00 2.41 2.33 0.00 0.00 6.84 6.80 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 0.00 234 Y 8.17 4.83 0.00 3.21 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 0.00 235 V 7.90 3.68 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 1.17 0.00 0.00 1.07 0.00 0.00 236 S 8.12 4.12 0.00 3.99 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 0.00 237 W 8.37 4.22 0.00 3.50 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.21 3.05 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.88 0.73 0.00 0.00 239 K 8.14 3.80 0.00 1.71 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.57 7.81 240 Q 8.12 3.88 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 241 T 7.24 3.62 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 242 I 7.00 2.58 1.37 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.03 0.39 0.00 0.00 243 A 7.59 4.01 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 0.00 244 S 7.35 4.63 0.00 3.75 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 0.00 245 N 7.87 4.71 0.00 3.11 2.98 0.00 0.00 6.77 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.