NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2890 8.4444 120.2325 53.5679 31.8743 174.8341 3 N 4.5525 6.8785 120.0548 52.7514 42.5916 167.5597 4 V 4.7352 8.0998 126.0782 61.1810 35.2728 172.9507 5 E 4.5605 9.3510 130.3607 54.9318 30.9917 174.2762 6 Q 5.1376 8.6037 127.8642 54.6854 31.7841 174.1187 7 H 5.1508 9.1968 122.3566 53.5838 33.4667 171.4448 8 P 5.0171 0.0000 0.0000 61.6571 32.9775 176.1603 9 S 4.6652 8.5299 113.7368 61.0735 64.1540 173.9893 10 T 5.1724 7.6990 108.5961 59.9306 71.9099 173.3323 11 L 4.6921 9.1932 125.4587 53.6418 45.9090 174.4559 12 S 5.2815 8.7762 120.4589 56.6463 64.7483 173.3314 13 V 4.5967 8.5985 119.4631 59.4006 36.2232 174.9590 14 Q 4.3486 8.6619 123.1436 55.5731 29.9397 175.2840 15 E 3.8588 8.4283 124.4693 58.4220 29.6439 175.7929 16 G 4.0780 9.4443 114.7637 45.8266 0.0000 173.4167 17 D 4.8295 8.2427 119.4118 53.9882 42.6654 175.7215 18 S 5.2744 8.4583 114.4105 57.3040 65.7866 173.4840 19 A 4.7138 8.7708 122.8563 50.2127 22.4328 175.3627 20 V 4.6112 8.1722 119.4078 61.0762 34.9414 174.5829 21 I 4.5762 8.3285 127.6253 59.4321 40.3052 174.5092 22 K 4.9798 8.9887 126.2365 54.8926 35.0993 174.7332 23 C 5.4433 8.9758 122.3325 56.2089 43.7202 173.7963 24 T 5.8795 9.3667 115.9812 58.9054 71.9611 172.8265 25 Y 5.3936 8.8962 124.6395 54.2125 40.7481 176.4000 26 S 4.3613 8.8394 114.4693 60.2953 65.0056 174.2364 27 D 4.5686 8.2019 122.2313 53.2556 41.0673 176.5365 28 S 4.5728 8.7864 121.1707 60.0114 63.3710 174.9491 29 A 4.1991 8.8909 124.2193 54.0803 18.5253 178.2265 30 S 4.2190 7.8107 112.6739 59.4302 63.3866 173.9681 31 N 4.9344 9.1957 119.3494 51.9996 39.6474 172.9941 32 Y 4.6836 6.9615 121.1447 55.8918 42.1192 173.8758 33 F 5.2050 8.6228 125.2198 53.7100 40.2094 172.4833 34 P 4.7089 0.0000 0.0000 61.4612 33.8632 174.9096 35 W 5.1500 9.1606 120.6110 55.2659 32.6467 174.2733 36 Y 5.4301 9.9354 120.7711 56.1600 41.7267 174.2483 37 K 4.4330 9.1212 124.1879 54.5171 34.8743 174.4519 38 Q 4.8734 8.8873 128.5957 54.4047 32.1488 173.9380 39 E 4.8637 8.6439 124.9902 54.1358 32.5735 175.3191 40 L 4.0029 8.6513 121.0456 56.7828 41.9542 177.4935 41 G 3.9868 8.9332 110.7992 46.2072 0.0000 172.3900 42 K 4.5724 8.0278 121.0689 54.5900 35.4707 175.9837 *43 R 4.5240 8.1522 121.6702 55.0197 30.9516 173.5634 44 P 4.8125 0.0000 0.0000 63.6293 32.2553 176.0434 45 Q 4.8261 9.3081 122.8045 53.9058 31.0832 174.5355 46 L 3.8518 8.9339 126.3964 55.4842 41.9129 176.0825 47 I 4.4034 8.0547 119.9795 61.4308 39.6925 175.4938 48 I 4.2656 7.3651 120.6609 60.7932 41.0605 171.9924 49 D 5.3477 8.7174 124.9849 52.6416 42.9909 173.8108 50 I 4.7058 8.3477 117.6495 60.0097 41.9166 173.5789 51 R 5.3696 8.6634 126.9255 54.1899 32.9827 177.0335 52 S 4.5026 8.7057 116.3610 60.3172 62.9979 174.6451 53 N 4.8673 8.1565 117.2956 52.7857 37.5208 175.0966 54 V 4.5619 7.4372 110.8039 60.2527 35.7912 174.9639 55 G 4.0465 8.5922 108.5391 47.1865 0.0000 172.6642 56 E 5.2838 7.8961 119.1546 55.2933 33.2956 174.3495 57 K 4.4037 8.5635 122.6575 55.6872 36.0719 174.2594 58 K 5.0380 8.7292 126.7420 55.0683 35.3159 176.4446 59 D 4.4955 9.2193 123.2574 54.0602 43.1438 176.3039 60 Q 3.6112 8.0338 128.7566 57.0645 27.0924 177.0802 61 R 4.0996 8.5997 127.3060 58.6748 30.4587 175.4765 62 I 4.8763 7.4946 119.2822 60.0517 39.4930 174.7021 63 A 5.1887 8.6778 126.1232 50.6163 23.0756 175.6045 64 V 4.9200 8.7700 120.6074 60.0722 35.2308 174.6955 65 T 5.2511 8.7282 112.1299 60.1403 72.6067 172.2763 66 L 5.0078 8.7716 123.3910 53.9023 45.6655 175.3557 67 N 4.8377 9.3602 124.2847 51.3645 39.8423 174.5631 68 K 4.4409 9.1800 123.6292 58.7570 32.6847 178.6208 69 T 3.9475 8.1619 106.6834 64.6830 68.4702 175.0746 70 A 4.0161 8.0730 123.2808 51.8652 19.2771 176.9924 71 K 3.2317 8.1812 115.0868 58.0528 29.6317 174.9684 72 H 5.8131 7.9889 114.4617 54.0593 32.6958 173.6300 73 F 5.4215 9.3098 116.8190 55.5632 41.4882 173.7206 74 S 5.3729 9.0377 116.7470 56.6342 67.3213 172.3748 75 L 4.4759 8.4570 122.8488 53.3153 44.7511 174.6819 76 H 5.1527 9.4224 123.6594 53.9816 31.9585 172.6415 77 I 4.7328 8.5340 124.9628 59.7644 39.2422 174.9030 78 T 4.6383 8.6009 117.9632 59.2483 70.8366 174.3281 79 E 4.4457 8.8155 119.6760 56.0990 27.1394 175.4153 80 T 4.1500 7.7834 108.3595 62.3111 69.8789 173.5238 81 Q 4.9282 9.0038 122.2475 53.0447 32.5091 174.7196 82 P 4.2206 0.0000 0.0000 66.1174 30.9741 178.2282 83 E 4.0511 8.1598 114.9708 58.3846 29.3929 177.4889 84 D 4.5831 8.3542 118.9579 56.2082 41.1480 176.6073 85 S 4.4950 8.2104 116.2649 59.1922 63.3257 173.7769 86 A 4.2210 8.2835 125.5462 52.0933 24.0613 174.1230 87 V 4.6047 7.7989 117.9320 61.7472 33.5121 174.6646 88 Y 5.1976 8.7135 125.2571 56.3457 41.0376 174.7390 89 F 5.6379 9.6545 121.1014 56.0465 43.4422 171.8761 90 C 4.5149 8.8678 116.5507 54.0303 38.9797 171.8928 91 A 4.9211 7.9113 119.1991 51.1200 23.0109 174.9886 92 A 4.6810 8.3159 119.2811 50.3718 22.5984 175.3551 93 S 4.9061 8.2534 114.0159 56.6326 66.6083 172.7125 94 S 4.7490 8.3374 117.5535 56.0392 65.4429 173.7915 95 F 3.9911 9.1972 122.8539 61.1933 39.1409 176.5323 96 G 3.7439 8.2081 107.5131 46.5235 0.0000 172.5131 97 N 4.7191 8.2854 119.3811 51.6233 38.7473 174.5029 98 E 4.2556 8.7097 123.7003 56.3707 30.0203 177.8754 99 K 4.1974 7.4513 118.6063 56.5588 33.4430 176.2976 100 L 4.7116 8.2185 121.0861 53.7367 43.6069 176.0176 101 T 4.5435 8.0578 112.7290 60.0932 70.7363 174.0177 102 F 5.0157 9.1067 125.3736 56.3421 40.8485 175.5204 103 G 4.1695 8.6314 110.5345 44.2627 0.0000 174.2527 104 T 4.0455 8.3442 108.4945 62.7877 69.0889 175.9368 105 G 3.8049 9.2854 107.3902 45.7629 0.0000 172.8189 106 T 4.6077 7.9565 113.6666 60.1297 70.7869 172.9847 107 R 4.3815 8.9905 130.9188 55.8597 31.0161 174.5470 108 L 4.9925 9.1330 130.5170 54.0450 44.0908 175.1595 109 T 4.7450 9.4603 123.9399 61.8959 71.5448 173.1634 110 I 4.6676 8.5628 128.9186 59.6063 38.1939 175.9647 111 I 3.9574 8.3562 130.1681 60.4182 37.7212 174.5319 112 P 4.7745 0.0000 0.0000 62.7869 32.2866 175.4183 113 N 4.5939 9.0055 121.0646 52.1550 39.3867 174.5580 114 I 4.0332 8.0810 127.4303 60.0236 37.3570 175.4528 115 Q 4.0338 8.4258 125.4611 58.5993 28.9150 177.6398 116 N 4.9496 7.4502 118.1576 49.8462 39.1309 171.6263 117 P 4.4459 0.0000 0.0000 63.1955 32.5792 177.5566 118 D 4.9275 8.9397 121.1514 51.6001 40.6279 172.6351 119 P 4.7831 0.0000 0.0000 63.7882 32.0674 177.0936 120 A 4.7306 9.3476 125.3390 50.1183 23.1348 174.4604 121 V 4.8446 8.0571 119.7378 61.3720 33.8591 174.3721 122 Y 4.9989 9.2483 124.4510 56.2342 42.4483 173.8665 123 Q 5.1180 8.7877 121.4060 54.5354 31.3587 174.8805 124 L 4.7907 8.5652 126.2071 53.2074 43.4599 176.9127 125 R 4.1372 8.4230 117.6356 55.8915 30.2390 176.4585 126 D 4.5472 8.4783 119.8415 54.5650 41.7929 175.5629 127 S 4.7031 8.2479 115.3934 56.5067 63.7118 175.3835 128 K 4.0436 8.7639 126.6562 58.7970 31.9261 177.6075 129 S 4.8104 7.8513 112.3785 57.2841 63.3935 173.5641 130 S 4.5950 7.8862 114.3465 57.8432 65.1941 173.5442 131 D 4.5928 8.6947 125.8532 54.2768 39.9833 176.4798 132 K 4.7350 7.4003 118.3959 56.6574 34.5043 176.2965 133 S 4.9674 9.4758 117.1961 56.8170 66.0390 173.3236 134 V 5.1817 8.6039 123.6207 61.4511 34.2137 174.7106 135 C 5.6695 10.0753 125.0458 55.0913 43.1578 172.6143 136 L 5.2808 9.3315 124.5301 53.4352 44.6318 174.8193 137 F 5.5131 9.3472 129.9983 57.4997 40.7704 174.4229 138 T 4.9401 9.0719 120.3070 60.5516 71.9162 173.0022 139 D 4.0573 8.2861 120.2799 55.0317 38.9011 174.2976 140 F 4.9132 6.6354 113.1177 55.1436 39.8991 174.7697 141 D 4.5424 8.4351 120.3398 54.0985 41.6102 177.3592 142 S 4.2963 8.5060 119.8078 61.2878 63.0904 175.7575 143 Q 4.0843 8.7132 121.4141 58.5602 29.0246 176.5961 144 T 3.8193 7.5876 114.3566 64.1041 68.8566 172.9125 145 N 4.5479 8.4759 124.6214 52.4799 40.0175 174.7202 146 V 4.0744 7.8765 123.7630 60.7775 32.5244 175.1331 147 S 4.3934 7.8610 121.1058 57.3113 64.0909 174.4154 148 Q 4.2578 8.2098 120.5313 55.2288 29.3236 176.3449 149 S 4.3554 8.3288 115.0819 58.3583 63.6765 174.4311 150 K 4.5116 8.3853 121.9139 56.4169 33.1261 176.5824 151 D 4.4588 7.7350 120.5427 54.1091 42.8873 176.6388 152 S 3.8567 8.3569 119.8902 61.3389 63.3619 175.8811 153 D 4.3497 7.7930 118.5423 54.9219 41.0522 176.1075 154 V 4.1076 7.3586 119.4140 59.6887 33.7886 174.9038 155 Y 4.3889 8.0881 120.8151 55.8290 40.7311 174.6327 156 I 5.1396 8.0421 116.9857 59.3153 40.4506 175.0837 157 T 4.5851 8.8517 116.3470 60.3388 70.8965 173.6486 158 D 4.8497 8.5352 122.5711 53.2852 42.4551 175.5406 159 K 4.7190 8.5110 120.2647 57.4163 33.6778 175.9292 160 C 4.7506 8.6717 120.4412 58.0707 35.5079 172.7052 161 V 4.3126 8.3239 125.8955 61.8593 32.3781 174.7339 162 L 4.3600 9.2808 131.3270 54.7599 43.5535 175.0842 163 D 4.2765 8.4712 124.2502 52.4898 41.2938 177.6862 164 M 4.6477 9.1180 121.3510 54.7031 32.8215 177.6512 165 R 3.7544 8.4143 119.0691 57.8134 29.8155 177.5419 166 S 4.6504 8.5932 117.4332 59.3273 64.9458 174.0116 167 M 4.3061 8.1395 118.7338 54.2947 32.5555 175.2315 168 D 4.3684 8.0793 116.5163 55.5518 39.4152 172.9166 169 F 4.9625 8.0345 120.8620 56.3829 43.3353 174.2969 170 K 5.0359 7.3443 125.2564 54.8500 35.4456 175.1789 171 S 4.3729 8.1028 117.7589 57.2746 66.6785 173.3633 172 N 5.2596 8.3293 119.2721 52.0311 40.8476 173.9247 173 S 5.1477 7.9170 112.7895 57.6100 66.3788 173.1822 174 A 5.1728 9.4409 122.7295 50.4271 22.9631 175.0719 175 V 5.1981 8.7678 118.9284 61.1129 35.1179 174.3086 176 A 5.5638 9.3493 128.3271 50.1118 22.3361 174.9324 177 W 6.2021 8.7655 117.9034 55.3658 32.5253 173.4001 178 S 4.8832 8.1377 113.6975 58.2857 64.8882 175.5171 179 N 5.0232 8.7861 117.2318 51.6776 37.9861 174.6629 180 K 3.9729 7.8651 121.7460 56.7748 32.7898 177.4910 181 S 4.2445 8.9140 122.0305 61.1672 63.2942 175.0423 182 D 4.9548 7.2841 116.3240 52.2410 38.9599 176.2125 183 F 4.8782 8.0345 120.2133 58.3623 40.8898 174.4743 184 A 4.4412 7.5956 127.5769 50.9103 19.6249 177.5021 185 C 3.6310 7.0651 111.4954 58.2715 39.2924 174.2648 186 A 4.1943 8.2501 121.0423 52.0455 17.9220 176.9305 187 N 4.7587 7.4216 112.7807 51.9654 38.8274 175.6859 188 A 4.4368 8.4152 129.6654 52.0412 19.4715 176.5224 189 F 3.9624 7.3408 123.3057 58.9113 39.4241 174.4276 190 N 4.3950 8.0161 128.7867 53.2677 41.3982 174.8620 191 N 4.6316 8.7237 121.4652 52.4415 40.4449 175.3314 192 S 4.0410 8.5938 112.7088 59.2552 64.5905 171.9551 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 E 8.44 4.29 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 3 N 6.88 4.55 0.00 2.93 2.74 0.00 0.00 6.36 6.83 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 4 V 8.10 4.74 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 1.09 0.00 0.00 1.13 0.00 0.00 5 E 9.35 4.56 0.00 2.10 1.84 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 2.23 2.24 0.00 6 Q 8.60 5.14 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.52 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 7 H 9.20 5.15 0.00 3.05 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 5.02 0.00 2.33 2.05 0.00 3.77 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 9 S 8.53 4.67 0.00 3.95 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 T 7.70 5.17 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 1.23 0.00 0.00 11 L 9.19 4.69 0.00 1.65 1.46 0.90 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.78 5.28 0.00 3.87 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.60 4.60 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.90 0.00 0.00 14 Q 8.66 4.35 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.29 0.00 15 E 8.43 3.86 0.00 2.14 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 16 G 9.44 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 17 D 8.24 4.83 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.46 5.27 0.00 3.72 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 19 A 8.77 4.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.17 4.61 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 0.66 0.00 0.00 0.73 0.00 0.00 21 I 8.33 4.58 1.73 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.46 1.20 0.00 0.00 22 K 8.99 4.98 0.00 1.67 1.65 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.34 7.81 23 C 8.98 5.44 0.00 1.52 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 0.00 0.00 0.00 0.00 24 T 9.37 5.88 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 1.21 0.00 0.00 25 Y 8.90 5.39 0.00 3.15 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 26 S 8.84 4.36 0.00 3.93 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 27 D 8.20 4.57 0.00 2.78 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 28 S 8.79 4.57 0.00 4.10 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 29 A 8.89 4.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.81 4.22 0.00 3.85 3.25 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 31 N 9.20 4.93 0.00 2.66 2.97 0.00 0.00 6.09 7.96 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 32 Y 6.96 4.68 0.00 2.80 2.54 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 0.00 0.00 0.00 0.00 33 F 8.62 5.20 0.00 2.73 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 34 P 0.00 4.71 0.00 1.94 1.73 0.00 3.29 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 35 W 9.16 5.15 0.00 3.41 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 36 Y 9.94 5.43 0.00 3.23 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 37 K 9.12 4.43 0.00 1.83 1.66 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.15 0.68 7.81 38 Q 8.89 4.87 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.51 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 39 E 8.64 4.86 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 40 L 8.65 4.00 0.00 1.63 1.67 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.93 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.03 4.57 0.00 1.79 1.68 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 *43 R 8.15 4.52 0.00 1.63 1.70 0.00 3.32 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.22 0.00 44 P 0.00 4.81 0.00 1.79 2.08 0.00 3.51 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.98 0.00 45 Q 9.31 4.83 0.00 2.13 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 46 L 8.93 3.85 0.00 1.58 1.65 0.60 1.10 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 47 I 8.05 4.40 1.95 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.95 1.09 0.00 0.00 48 I 7.37 4.27 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 1.48 1.20 0.95 0.00 0.00 49 D 8.72 5.35 0.00 2.42 2.54 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 0.00 0.00 0.00 0.00 50 I 8.35 4.71 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.28 1.15 0.00 0.00 51 R 8.66 5.37 0.00 2.03 1.88 0.00 3.26 0.00 0.00 3.43 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 52 S 8.71 4.50 0.00 4.02 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 0.00 53 N 8.16 4.87 0.00 2.91 2.99 0.00 0.00 6.68 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.44 4.56 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 0.76 0.00 0.00 1.07 0.00 0.00 55 G 8.59 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 56 E 7.90 5.28 0.00 1.94 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 57 K 8.56 4.40 0.00 1.88 1.63 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.42 7.81 58 K 8.73 5.04 0.00 1.63 1.65 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.62 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.37 7.81 59 D 9.22 4.50 0.00 2.66 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 60 Q 8.03 3.61 0.00 2.24 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 61 R 8.60 4.10 0.00 1.85 2.12 0.00 3.24 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 62 I 7.49 4.88 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.43 0.81 0.00 0.00 63 A 8.68 5.19 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.77 4.92 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 0.88 0.00 0.00 1.33 0.00 0.00 65 T 8.73 5.25 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 1.18 0.00 0.00 66 L 8.77 5.01 0.00 1.57 1.53 0.40 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 67 N 9.36 4.84 0.00 2.80 2.79 0.00 0.00 6.99 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 68 K 9.18 4.44 0.00 1.84 1.98 0.00 2.11 0.00 0.00 2.48 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.58 1.48 7.81 69 T 8.16 3.95 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 1.23 0.00 0.00 70 A 8.07 4.02 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 71 K 8.18 3.23 0.00 1.51 0.92 0.00 1.44 0.00 0.00 1.33 0.00 0.00 2.75 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.98 1.12 7.81 72 H 7.99 5.81 0.00 3.09 3.16 0.00 5.57 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 9.31 5.42 0.00 3.33 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 9.04 5.37 0.00 3.81 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.46 4.48 0.00 0.27 0.33 0.28 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 76 H 9.42 5.15 0.00 3.06 3.07 0.00 5.81 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 77 I 8.53 4.73 1.69 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.48 0.84 0.00 0.00 78 T 8.60 4.64 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 1.22 0.00 0.00 79 E 8.82 4.45 0.00 2.08 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 2.20 2.21 0.00 80 T 7.78 4.15 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 1.21 0.00 0.00 81 Q 9.00 4.93 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 82 P 0.00 4.22 0.00 2.19 2.33 0.00 3.69 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 2.08 1.97 0.00 83 E 8.16 4.05 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 84 D 8.35 4.58 0.00 2.78 2.82 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 85 S 8.21 4.50 0.00 3.83 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 86 A 8.28 4.22 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 87 V 7.80 4.60 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.89 0.00 0.00 88 Y 8.71 5.20 0.00 3.03 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 89 F 9.65 5.64 0.00 3.22 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 90 C 8.87 4.51 0.00 2.07 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 91 A 7.91 4.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.32 4.68 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.25 4.91 0.00 3.84 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 94 S 8.34 4.75 0.00 4.02 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 95 F 9.20 3.99 0.00 2.99 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 96 G 8.21 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 0.00 0.00 0.00 97 N 8.29 4.72 0.00 2.67 2.68 0.00 0.00 7.13 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 98 E 8.71 4.26 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 99 K 7.45 4.20 0.00 1.99 1.79 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.54 1.39 7.81 100 L 8.22 4.71 0.00 1.30 0.89 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.06 4.54 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 102 F 9.11 5.02 0.00 2.76 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 0.00 103 G 8.63 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 0.00 104 T 8.34 4.05 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 1.25 0.00 0.00 105 G 9.29 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 0.00 106 T 7.96 4.61 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 107 R 8.99 4.38 0.00 1.94 1.83 0.00 3.14 0.00 0.00 3.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 108 L 9.13 4.99 0.00 1.86 1.93 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 109 T 9.46 4.74 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 0.00 110 I 8.56 4.67 1.88 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 1.25 0.95 0.92 0.00 0.00 111 I 8.36 3.96 1.86 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 1.29 0.68 0.90 0.00 0.00 112 P 0.00 4.77 0.00 1.99 2.00 0.00 3.73 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 1.93 1.91 0.00 113 N 9.01 4.59 0.00 2.65 2.73 0.00 0.00 7.14 8.80 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 0.00 114 I 8.08 4.03 1.80 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.97 0.79 0.00 0.00 115 Q 8.43 4.03 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.20 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 116 N 7.45 4.95 0.00 2.70 2.75 0.00 0.00 6.90 8.02 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 0.00 117 P 0.00 4.45 0.00 2.21 2.06 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 118 D 8.94 4.93 0.00 2.67 2.65 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 0.00 119 P 0.00 4.78 0.00 2.40 2.38 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 120 A 9.35 4.73 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 0.00 121 V 8.06 4.84 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 0.88 0.00 0.00 0.74 0.00 0.00 122 Y 9.25 5.00 0.00 3.00 2.82 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 0.00 123 Q 8.79 5.12 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.64 0.00 124 L 8.57 4.79 0.00 1.64 1.61 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.42 4.14 0.00 1.94 1.95 0.00 3.05 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 126 D 8.48 4.55 0.00 2.72 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 0.00 127 S 8.25 4.70 0.00 3.83 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.76 4.04 0.00 1.78 1.88 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.45 7.81 129 S 7.85 4.81 0.00 3.93 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 0.00 130 S 7.89 4.60 0.00 3.79 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 0.00 131 D 8.69 4.59 0.00 2.86 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 7.40 4.73 0.00 2.04 2.03 0.00 1.32 0.00 0.00 1.43 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.40 7.81 133 S 9.48 4.97 0.00 4.09 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 0.00 134 V 8.60 5.18 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 1.20 0.00 0.00 1.00 0.00 0.00 135 C 10.08 5.67 0.00 3.00 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 0.00 136 L 9.33 5.28 0.00 1.84 1.71 1.10 0.96 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 0.00 137 F 9.35 5.51 0.00 3.15 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 9.07 4.94 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 139 D 8.29 4.06 0.00 3.16 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 F 6.64 4.91 0.00 3.04 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.44 4.54 0.00 2.83 2.65 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 0.00 142 S 8.51 4.30 0.00 3.90 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 0.00 143 Q 8.71 4.08 0.00 1.98 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 144 T 7.59 3.82 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 145 N 8.48 4.55 0.00 2.60 2.89 0.00 0.00 6.88 7.71 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 0.00 146 V 7.88 4.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.76 0.00 0.00 147 S 7.86 4.39 0.00 3.97 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 0.00 148 Q 8.21 4.26 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.99 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 149 S 8.33 4.36 0.00 3.88 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 0.00 150 K 8.39 4.51 0.00 1.84 1.91 0.00 1.81 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.32 1.36 7.81 151 D 7.73 4.46 0.00 2.55 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.36 3.86 0.00 3.90 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 0.00 153 D 7.79 4.35 0.00 2.56 2.65 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 0.00 154 V 7.36 4.11 1.71 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 0.58 0.00 0.00 0.80 0.00 0.00 155 Y 8.09 4.39 0.00 1.43 1.57 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 0.00 156 I 8.04 5.14 1.90 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 1.51 0.50 0.87 0.00 0.00 157 T 8.85 4.59 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 158 D 8.54 4.85 0.00 2.76 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 0.00 159 K 8.51 4.72 0.00 1.97 2.10 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.52 7.81 160 C 8.67 4.75 0.00 3.06 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 0.00 161 V 8.32 4.31 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 0.74 0.00 0.00 0.90 0.00 0.00 162 L 9.28 4.36 0.00 1.78 1.57 0.94 1.41 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 0.00 163 D 8.47 4.28 0.00 2.74 2.59 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 0.00 164 M 9.12 4.65 0.00 1.94 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.35 0.00 165 R 8.41 3.75 0.00 1.98 1.67 0.00 3.30 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 166 S 8.59 4.65 0.00 3.80 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 0.00 167 M 8.14 4.31 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 168 D 8.08 4.37 0.00 2.80 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 0.00 169 F 8.03 4.96 0.00 3.17 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 0.00 170 K 7.34 5.04 0.00 1.52 1.33 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.74 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 1.31 7.81 171 S 8.10 4.37 0.00 3.90 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 N 8.33 5.26 0.00 1.44 2.05 0.00 0.00 7.15 7.60 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 0.00 173 S 7.92 5.15 0.00 3.92 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 9.44 5.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.77 5.20 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 nan 0.00 0.00 1.09 0.00 0.00 176 A 9.35 5.56 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 W 8.77 6.20 0.00 3.50 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 0.00 178 S 8.14 4.88 0.00 2.91 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.79 5.02 0.00 2.87 3.03 0.00 0.00 5.95 7.13 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 0.00 180 K 7.87 3.97 0.00 1.77 1.64 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.42 7.81 181 S 8.91 4.24 0.00 3.92 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 0.00 182 D 7.28 4.95 0.00 2.85 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 0.00 183 F 8.03 4.88 0.00 3.07 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 0.00 184 A 7.60 4.44 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 0.00 185 C 7.07 3.63 0.00 2.99 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 0.00 186 A 8.25 4.19 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 0.00 187 N 7.42 4.76 0.00 2.82 2.78 0.00 0.00 6.62 7.14 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 0.00 188 A 8.42 4.44 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 F 7.34 3.96 0.00 2.86 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 0.00 190 N 8.02 4.39 0.00 2.46 2.56 0.00 0.00 7.20 8.00 0.00 0.00 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 N 8.72 4.63 0.00 2.71 2.80 0.00 0.00 7.33 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 0.00 192 S 8.59 4.04 0.00 4.07 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 * Residues marked with a * may have inaccurate shift predictions.