NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.4305 8.2798 120.4122 63.1040 32.4528 173.9851 3 Q 4.2582 7.9700 125.1035 54.5476 32.4575 171.4852 4 L 5.1398 9.2420 120.2308 53.1616 44.5983 177.2905 5 Q 4.6207 9.1339 122.6466 54.5656 30.5957 174.6089 6 Q 5.1966 8.5564 124.4831 53.7489 32.0131 174.9426 7 S 4.4469 8.4339 118.9691 58.2337 63.7489 174.2768 8 G 4.0219 8.6517 107.9005 45.5067 0.0000 171.6027 9 P 4.9425 0.0000 0.0000 62.7225 32.3352 175.5842 10 E 4.7269 9.0567 119.9148 54.8703 32.9845 173.9647 11 L 4.9676 8.6900 124.0000 53.7774 43.1390 176.3833 12 V 4.7167 8.9553 116.7187 59.1891 36.2352 174.8359 13 K 4.7031 8.3996 122.3286 54.6178 34.3304 174.4414 14 P 4.4596 0.0000 0.0000 64.7779 31.6626 176.3879 15 G 3.8988 8.8257 110.9377 45.0499 0.0000 173.4186 16 A 4.2620 7.6765 121.1106 52.0193 20.1648 176.7440 17 S 4.9129 8.4132 114.2056 57.0468 65.4072 174.5677 18 V 4.2823 8.3115 125.0306 60.1983 34.1888 175.3232 19 R 4.7664 8.1641 120.9264 55.2816 32.5770 174.3600 20 M 4.7688 8.9187 127.2414 54.0727 34.9550 175.0274 21 S 5.5633 9.1470 113.2041 57.4044 67.3739 172.6166 22 C 4.9837 9.0548 120.6959 55.3279 44.5629 172.3583 23 K 4.8528 9.0516 128.4889 54.7026 33.9956 175.7943 24 S 4.7446 9.2364 126.8406 56.9013 61.4797 171.1700 25 S 4.1786 8.6936 117.8266 59.0141 62.6040 174.9771 26 G 3.5257 8.5091 113.2479 46.4466 0.0000 172.5121 27 Y 3.7217 7.8047 118.8894 56.8075 36.2407 175.6351 28 I 3.8666 8.2334 125.9141 60.9683 39.3205 178.2106 29 F 3.1987 7.3160 119.0435 60.2511 39.1413 176.7633 30 T 3.7005 7.3265 115.4117 63.5960 67.6415 173.8953 31 D 4.8212 8.5829 127.9340 53.1207 39.5707 174.7261 32 F 5.3075 8.5999 124.4968 56.4118 42.3550 173.4659 33 Y 4.2148 8.2867 122.0112 56.3253 40.6686 174.3097 34 M 4.4988 8.4391 122.5953 53.9120 35.0718 174.3921 35 N 5.4493 9.1698 121.2042 51.2724 43.4626 173.2619 36 W 5.1700 8.6833 121.8952 54.8863 32.4724 174.8020 37 V 4.8559 9.1619 124.1780 61.0475 34.8936 173.8580 38 R 4.4314 8.9876 125.9963 54.3237 32.9084 174.1954 39 Q 4.9103 8.6828 127.2147 54.4383 32.0960 174.4059 40 S 3.9976 9.3388 124.1060 58.2580 63.7408 173.7737 41 H 3.7300 9.4839 115.1989 57.6584 25.2113 173.6028 42 G 4.4281 9.0659 116.7569 44.7605 0.0000 171.5135 43 K 4.4283 7.0133 114.9946 57.3232 35.2297 176.2045 44 S 4.3208 7.9791 113.3271 58.0560 64.3263 173.0352 45 L 5.3504 8.5675 123.2052 53.2752 44.2426 175.5418 46 D 5.0780 9.0081 120.9010 52.7392 45.3464 174.0251 47 Y 4.5582 8.7491 123.6485 57.4491 39.2758 175.0727 48 I 2.8320 8.5861 128.6564 62.3550 38.4662 176.2310 49 G 3.5097 6.2498 107.0927 46.0023 0.0000 170.3669 50 Y 5.4487 7.1098 116.2472 55.8479 42.0149 174.1752 51 I 4.9211 8.8003 120.2375 60.0638 42.2919 172.9288 52 S 4.5945 8.4720 124.4807 55.6454 63.5633 172.7438 52A P 4.0116 0.0000 0.0000 66.3140 30.9046 177.3434 53 Y 4.8784 7.7393 113.1572 57.8472 37.5335 175.7410 54 S 4.5898 8.3641 113.9533 57.7277 68.5055 175.3540 55 G 4.0331 8.1322 109.4698 46.4987 0.0000 173.0626 56 V 4.3828 6.9912 116.5859 61.2456 33.3396 174.8255 57 T 4.8866 8.1439 123.2838 61.9690 72.1424 173.3247 58 G 3.3003 7.0368 106.6125 45.4880 0.0000 172.2462 59 Y 5.1401 8.2584 119.2266 55.4256 42.1062 174.9047 60 N 4.6458 9.2725 121.7906 53.8866 39.9903 175.9446 61 Q 4.1049 9.2162 125.4746 59.2517 29.0280 178.7291 62 K 4.5117 7.9920 112.0294 57.4893 32.2660 177.0348 63 F 4.7932 8.4977 115.9009 57.2170 40.3791 174.3482 64 K 4.0985 8.3424 123.1524 57.1411 32.4062 177.0413 65 G 3.8425 8.7016 113.1622 45.8837 0.0000 172.7374 66 K 4.4343 7.8569 118.1996 57.0496 34.1662 175.2227 67 A 5.2297 8.0648 120.6052 49.6837 21.6389 175.7099 68 T 4.6132 8.2625 116.2491 61.8441 72.2182 172.7264 69 L 5.8283 9.1427 126.5886 52.5036 43.8521 175.9103 70 T 4.9129 8.3062 112.5997 60.6098 72.9113 172.4243 71 V 4.6403 8.0748 119.5148 60.4985 34.8794 174.0647 72 D 4.7016 8.9934 121.4135 52.6063 42.6963 177.1930 73 K 3.7856 8.6911 124.7137 59.2531 32.6355 179.9651 74 S 3.9808 8.1333 112.1159 61.5980 63.0788 175.6631 75 S 4.1522 7.9847 115.8943 61.4424 62.7242 176.4901 76 S 4.2240 7.8651 114.3260 58.9604 60.7228 168.2417 77 T 5.5875 8.5595 117.5361 61.2874 70.5240 174.0469 78 A 4.6829 8.2991 128.2664 51.1817 21.5192 175.1585 79 Y 5.8964 8.6207 115.6952 56.0028 43.1521 174.3624 80 M 4.8237 8.1197 121.1131 53.7944 35.5454 173.1461 81 E 4.8384 8.8542 127.9393 54.5421 31.8612 174.3538 82 L 4.7563 8.4244 127.8491 53.6521 43.5205 176.2395 82A R 4.8337 7.8821 119.9878 54.3498 33.8990 175.3574 82B S 3.5455 8.4445 115.1043 59.6539 60.4543 173.8846 82C L 4.1773 8.0624 120.3213 55.2269 41.8809 177.8466 83 T 4.8085 8.1446 114.2476 59.2253 71.3819 175.4505 84 S 4.1513 8.6255 115.7318 61.5816 62.7760 176.3736 85 E 3.9373 8.3540 119.1812 59.5290 29.1967 177.3982 86 D 4.8175 8.0012 115.8690 54.5606 40.7707 176.1795 87 S 4.7233 8.4736 116.7762 57.7737 63.3162 173.3122 88 A 4.3867 8.6250 125.2360 51.3306 23.0387 174.1683 89 V 4.5464 8.0455 119.1481 61.8632 33.2303 174.4285 90 Y 4.8555 8.9358 125.4614 56.8220 40.4183 174.2900 91 Y 5.4489 9.4167 119.5958 56.5038 42.5270 173.5308 92 C 4.5636 8.6997 121.7877 54.7358 44.8584 172.2196 93 A 4.6417 8.3538 125.7682 50.8036 22.7285 175.1514 94 G 4.2278 8.3781 105.3076 44.4613 0.0000 171.8279 95 S 4.9507 8.6550 118.3831 56.5967 65.9173 173.6628 96 S 4.3958 9.1272 121.7529 57.5829 62.5859 175.2447 97 G 3.6319 9.2869 117.3923 49.1476 0.0000 173.9909 98 N 3.7237 8.1168 116.8174 56.3364 41.0350 176.7887 99 K 3.9286 8.0523 114.7058 57.4447 32.9038 177.0878 100 W 3.6461 7.9520 116.8668 57.0520 26.6202 173.8752 100A A 4.6748 7.3395 118.2918 50.7815 22.2088 176.1397 100B M 4.3512 8.9369 121.5735 54.2464 32.0750 176.1910 101 D 4.6284 8.2935 123.8706 53.8917 40.5623 176.0645 102 Y 4.9423 7.5560 117.3830 55.9179 41.6616 174.5789 103 W 4.8656 8.8188 121.6372 54.7505 32.4575 175.5622 104 G 3.8043 9.2265 112.7888 46.1722 0.0000 173.6409 105 H 4.5129 8.9091 118.8417 58.4440 29.1068 175.4610 106 G 4.5637 7.2775 103.6460 42.9370 0.0000 173.3951 107 A 4.6306 8.4728 123.5511 50.2140 22.0473 175.5809 108 S 4.9927 8.7978 118.0383 58.9399 64.4764 173.7090 109 V 5.2879 8.7023 121.8986 60.6007 34.6730 174.4229 110 T 4.9393 8.4957 122.6495 61.9066 72.1472 172.9631 111 V 4.6472 8.5740 127.6115 62.0650 31.6501 175.1268 112 S 4.6808 9.0340 124.0581 56.5793 67.6847 175.6605 113 S 4.3104 8.3178 121.5297 57.8513 62.5857 172.6504 114 A 4.4281 6.9008 121.8952 51.1368 21.6984 176.0761 115 K 4.6114 7.8467 118.1189 54.5739 34.5243 176.7420 116 T 4.4839 8.5086 117.5852 64.6414 69.0454 174.0379 117 T 4.8030 9.5375 123.5392 61.4938 71.8125 174.0349 118 A 4.7401 8.8396 127.8322 51.2348 19.7433 174.4574 119 P 5.2730 0.0000 0.0000 60.8815 33.3966 175.5452 120 S 4.2254 8.5212 119.5817 57.9202 63.8156 173.0041 121 V 4.3727 7.8914 125.3548 61.5580 32.9913 174.5192 122 Y 5.1962 8.6581 125.5038 55.2434 40.9404 173.3071 123 P 4.6218 0.0000 0.0000 63.0908 32.1887 176.7712 124 L 4.8602 8.7031 123.2109 52.7987 41.8396 175.4698 125 A 4.3207 8.2214 123.8747 50.6087 19.9952 176.2427 126 P 4.1918 0.0000 0.0000 66.2260 32.1576 177.8000 127 V 3.6060 7.8990 114.9768 65.1765 27.5721 170.3215 128 C 4.6633 7.9693 107.4166 59.6994 29.4686 175.2385 129 G 3.7093 7.9692 112.0692 45.5773 0.0000 174.5807 130 D 4.3552 7.9020 126.6557 53.9230 40.2213 174.5837 129 T 4.0993 7.7892 116.8692 62.2773 67.1657 174.3808 130 T 4.0652 7.7120 119.8557 61.5230 68.9213 172.9837 135 G 3.9435 8.1326 113.4994 44.9935 0.0000 171.3242 136 S 4.8801 8.2218 116.5017 57.3656 66.4427 174.1059 137 S 5.2704 7.9033 112.7394 56.7438 66.5115 173.8016 138 V 4.5475 8.3578 112.2635 60.3699 36.3412 173.9156 139 T 4.9662 8.5109 121.2556 61.6327 70.9537 173.1606 140 L 4.6970 8.3895 126.2143 53.9734 44.6457 175.5397 141 G 4.7256 8.8554 105.4424 45.5258 0.0000 170.3773 142 C 5.6301 9.3017 115.4539 55.2148 43.6690 173.4293 143 L 5.3421 8.8632 124.3811 53.2806 45.3155 175.4725 144 V 4.6534 8.6091 124.0938 61.3687 34.3757 174.0675 145 K 4.8212 8.3872 127.9518 54.3898 34.7381 177.2402 146 G 4.1428 8.6594 111.0304 46.6819 0.0000 173.4949 147 Y 4.7654 7.8224 117.0781 56.5981 39.9613 173.9980 148 F 5.2271 9.0989 122.9290 56.5884 43.2669 172.4323 149 P 3.9413 0.0000 0.0000 61.3427 33.9399 174.7350 150 E 4.3810 8.3658 120.3162 55.1101 30.3953 174.4465 151 P 4.6302 0.0000 0.0000 62.0156 32.7437 175.2175 152 V 4.5333 7.6662 110.4193 59.8151 35.5455 175.2565 153 T 4.5587 8.7223 119.6698 61.8190 71.0263 173.5844 154 L 5.5892 8.3211 126.9545 52.7057 45.2921 175.1536 *156 T 4.3665 8.3490 115.6395 61.5589 71.0722 172.4632 157 W 4.7197 8.4066 121.1835 54.4013 32.1682 176.4595 *162 N 4.3767 8.3979 123.7932 53.9770 39.3665 175.0000 163 S 3.9176 9.6282 108.6598 60.0280 61.3598 174.0083 164 G 4.1244 7.9068 108.1317 45.8658 0.0000 175.7810 165 S 4.3306 7.8273 114.2542 59.2341 63.2604 173.6723 166 L 4.7558 7.8650 122.3025 53.3359 43.5027 175.6869 167 S 4.6174 8.4922 119.4544 58.2517 65.5362 174.6342 168 S 4.1540 8.0463 113.8920 58.7179 62.3584 174.8334 169 G 3.6778 8.4019 110.9648 46.6023 0.0000 173.3763 *171 V 3.8598 7.3764 117.8677 63.2264 32.7742 174.8869 172 H 4.6225 8.8234 123.5928 54.7985 32.2046 172.2171 173 T 4.9033 8.2465 120.7441 62.1350 69.3618 174.9693 174 F 4.4402 9.1959 126.4877 55.9060 39.9953 174.1975 175 P 4.2025 0.0000 0.0000 63.1721 31.7475 175.9008 176 A 4.5563 8.5287 123.8933 52.0051 19.4341 176.7227 177 V 4.4594 8.6192 121.7071 61.0316 34.2199 174.2021 178 L 4.6114 8.6220 129.8765 54.1684 42.2297 175.5996 179 Q 4.5452 8.6237 123.7037 56.7292 31.2920 175.4979 180 S 4.6602 7.3568 116.2958 57.8112 64.4978 174.8402 *183 D 4.6136 8.5559 122.9702 54.4959 42.4079 174.8956 184 L 4.7162 7.7892 117.0919 53.8513 46.7834 175.0307 185 Y 5.5180 8.3097 119.3256 56.9600 40.4470 174.7339 186 T 5.5740 8.3542 115.4927 63.2417 73.4959 172.7765 187 L 5.2294 8.6194 124.0201 54.7401 44.7978 174.5322 188 S 5.3590 8.7508 113.4216 57.0642 67.7143 173.1847 189 S 5.5566 9.3661 115.5641 56.8293 66.5377 172.8196 190 S 5.0109 9.4191 120.3244 56.5957 65.5831 173.1057 191 V 4.3699 7.8842 124.4475 59.8080 34.0193 174.9080 192 T 4.7894 7.9975 118.0865 62.0185 71.8246 173.5199 193 V 4.5800 8.6764 119.3808 58.9926 35.8523 175.2948 194 T 4.2679 8.3785 112.0732 61.3324 69.6950 174.5159 195 S 4.3367 9.0942 120.1275 62.1342 62.9760 177.6070 196 S 4.0468 8.0389 112.8361 59.4027 62.2329 175.8816 *198 T 4.9911 7.8845 119.2746 62.7687 70.1362 173.8181 199 W 5.2165 8.1444 129.0781 54.7714 33.4190 173.0505 200 P 3.6151 0.0000 0.0000 63.7303 30.6972 177.0149 *202 S 4.5221 7.8843 115.4239 58.4105 64.7181 173.6925 203 Q 4.6419 8.4733 120.0048 54.1945 32.0405 174.9736 204 S 4.5980 8.8996 122.1476 58.6839 63.9949 173.4412 205 I 4.9872 8.7069 124.3967 60.0034 40.1926 174.6710 206 T 5.9292 9.8333 122.6928 61.3524 73.2579 170.6664 *208 C 4.8367 8.5583 118.3192 55.3394 44.5540 172.0040 209 N 5.3043 8.5415 117.9621 51.4084 41.6061 173.6148 210 V 4.6458 8.4514 123.0692 61.1665 34.1481 173.7384 211 A 4.9373 8.4951 130.6640 50.5826 21.6006 175.0512 212 H 4.8605 9.1680 122.2702 53.7835 31.7969 172.4899 213 P 4.1213 0.0000 0.0000 65.4757 31.5567 178.7957 214 A 3.9161 7.8306 119.2239 54.8555 18.0560 178.1668 215 S 4.5101 7.6482 107.9974 57.5936 64.9595 173.8652 216 S 3.7163 7.7586 115.7979 60.0571 60.3304 172.2761 217 T 4.6488 8.0038 115.8841 61.5135 72.4337 174.8675 218 K 4.9188 8.7227 126.8312 54.6572 35.0682 175.3087 219 V 4.2669 8.7720 128.5977 61.2678 33.6839 173.8262 220 D 5.0788 8.6161 128.2646 53.0416 42.4676 176.0419 221 K 4.4389 8.9188 124.9425 54.2647 34.6107 174.7882 222 K 4.5119 8.7492 129.8947 56.3593 33.0983 176.1707 223 I 4.2709 8.8451 131.6863 60.6592 37.9562 175.6763 *226 E 4.5368 8.5789 124.3025 56.0350 31.2517 172.0875 227 P 4.9090 0.0000 0.0000 63.1129 31.0596 176.4427 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 V 8.28 4.43 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 0.63 0.00 0.00 3 Q 7.97 4.26 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 4 L 9.24 5.14 0.00 1.51 1.55 0.86 0.84 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 5 Q 9.13 4.62 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 6 Q 8.56 5.20 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 7 S 8.43 4.45 0.00 4.15 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 8 G 8.65 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 9 P 0.00 4.94 0.00 2.13 2.12 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 10 E 9.06 4.73 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 11 L 8.69 4.97 0.00 1.67 1.85 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.96 4.72 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 nan 0.00 0.00 13 K 8.40 4.70 0.00 1.84 1.90 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.36 7.81 14 P 0.00 4.46 0.00 2.02 2.05 0.00 3.59 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 15 G 8.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.68 4.26 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 17 S 8.41 4.91 0.00 3.66 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 18 V 8.31 4.28 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.93 0.00 0.00 19 R 8.16 4.77 0.00 1.67 1.69 0.00 2.95 0.00 0.00 3.05 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.49 0.00 20 M 8.92 4.77 0.00 2.13 1.68 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 21 S 9.15 5.56 0.00 4.07 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 22 C 9.05 4.98 0.00 3.01 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 9.05 4.85 0.00 1.86 1.66 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.38 7.81 24 S 9.24 4.74 0.00 3.88 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 25 S 8.69 4.18 0.00 4.03 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 26 G 8.51 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.80 3.72 0.00 2.65 2.41 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 28 I 8.23 3.87 1.75 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 1.19 1.05 0.84 0.00 0.00 29 F 7.32 3.20 0.00 2.96 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 30 T 7.33 3.70 4.39 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 1.35 0.00 0.00 31 D 8.58 4.82 0.00 2.78 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 32 F 8.60 5.31 0.00 3.11 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 33 Y 8.29 4.21 0.00 2.75 2.64 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 0.00 0.00 0.00 0.00 34 M 8.44 4.50 0.00 1.91 1.67 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 35 N 9.17 5.45 0.00 2.47 2.47 0.00 0.00 6.80 8.29 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 36 W 8.68 5.17 0.00 3.05 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 V 9.16 4.86 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.07 0.00 0.00 38 R 8.99 4.43 0.00 1.82 1.75 0.00 3.21 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.56 0.00 39 Q 8.68 4.91 0.00 2.11 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.66 0.00 0.00 0.00 0.00 0.00 2.23 2.54 0.00 40 S 9.34 4.00 0.00 3.79 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 41 H 9.48 3.73 0.00 3.23 3.49 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 9.07 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.01 4.43 0.00 1.87 1.73 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.40 7.81 44 S 7.98 4.32 0.00 3.84 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 45 L 8.57 5.35 0.00 1.62 1.72 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.01 5.08 0.00 2.89 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 47 Y 8.75 4.56 0.00 2.97 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 8.59 2.83 1.82 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.10 0.76 0.00 0.00 49 G 6.25 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 7.11 5.45 0.00 3.20 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 51 I 8.80 4.92 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.35 0.87 0.00 0.00 52 S 8.47 4.59 0.00 2.72 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 52A P 0.00 4.01 0.00 1.61 2.05 0.00 3.58 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 1.87 1.93 0.00 53 Y 7.74 4.88 0.00 3.12 3.20 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 54 S 8.36 4.59 0.00 3.94 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 55 G 8.13 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 56 V 6.99 4.38 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 1.15 0.00 0.00 1.05 0.00 0.00 57 T 8.14 4.89 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 58 G 7.04 3.30 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 59 Y 8.26 5.14 0.00 2.86 2.93 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 60 N 9.27 4.65 0.00 3.17 2.95 0.00 0.00 7.32 6.78 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 61 Q 9.22 4.10 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 62 K 7.99 4.51 0.00 1.82 1.93 0.00 1.52 0.00 0.00 1.76 0.00 0.00 3.20 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.82 1.21 7.81 63 F 8.50 4.79 0.00 3.31 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 64 K 8.34 4.10 0.00 1.73 1.64 0.00 0.96 0.00 0.00 1.39 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.22 7.81 65 G 8.70 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.86 4.43 0.00 1.81 1.95 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.63 7.81 67 A 8.06 5.23 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 68 T 8.26 4.61 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 1.20 0.00 0.00 69 L 9.14 5.83 0.00 1.34 1.45 0.58 0.78 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 70 T 8.31 4.91 4.32 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 1.25 0.00 0.00 71 V 8.07 4.64 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 0.60 0.00 0.00 0.82 0.00 0.00 72 D 8.99 4.70 0.00 2.70 2.58 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 0.00 0.00 0.00 0.00 73 K 8.69 3.79 0.00 1.78 1.67 0.00 1.49 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.35 7.81 74 S 8.13 3.98 0.00 3.96 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 75 S 7.98 4.15 0.00 3.94 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 76 S 7.87 4.22 0.00 3.78 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.56 5.59 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 1.14 0.00 0.00 78 A 8.30 4.68 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.62 5.90 0.00 2.81 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 80 M 8.12 4.82 0.00 0.82 0.57 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 81 E 8.85 4.84 0.00 1.99 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 0.00 2.12 2.30 0.00 82 L 8.42 4.76 0.00 1.48 1.45 0.30 0.52 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 82A R 7.88 4.83 0.00 1.65 1.74 0.00 3.26 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 82B S 8.44 3.55 0.00 3.93 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 82C L 8.06 4.18 0.00 1.78 1.62 0.95 0.57 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 83 T 8.14 4.81 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 84 S 8.63 4.15 0.00 4.02 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.35 3.94 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 86 D 8.00 4.82 0.00 2.89 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 87 S 8.47 4.72 0.00 3.91 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 88 A 8.62 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.05 4.55 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 0.68 0.00 0.00 0.91 0.00 0.00 90 Y 8.94 4.86 0.00 3.34 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 91 Y 9.42 5.45 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 8.70 4.56 0.00 1.75 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.35 4.64 0.18 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 94 G 8.38 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.65 4.95 0.00 3.59 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 96 S 9.13 4.40 0.00 3.88 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 97 G 9.29 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 98 N 8.12 3.72 0.00 2.74 2.99 0.00 0.00 6.85 6.68 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 99 K 8.05 3.93 0.00 1.83 1.86 0.00 1.96 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.48 7.81 100 W 7.95 3.65 0.00 3.21 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100A A 7.34 4.67 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 100B M 8.94 4.35 0.00 1.31 1.70 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 101 D 8.29 4.63 0.00 2.52 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 0.00 102 Y 7.56 4.94 0.00 2.96 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 8.82 4.87 0.00 2.99 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 0.00 104 G 9.23 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 0.00 105 H 8.91 4.51 0.00 3.29 3.49 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.28 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.47 4.63 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 8.80 4.99 0.00 3.88 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.70 5.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.77 0.00 0.00 110 T 8.50 4.94 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 111 V 8.57 4.65 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 0.78 0.00 0.00 1.03 0.00 0.00 112 S 9.03 4.68 0.00 3.62 3.30 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 0.00 113 S 8.32 4.31 0.00 3.89 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 A 6.90 4.43 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.85 4.61 0.00 1.76 1.76 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.37 7.81 116 T 8.51 4.48 4.32 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 1.38 0.00 0.00 117 T 9.54 4.80 4.39 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 1.31 0.00 0.00 118 A 8.84 4.74 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 0.00 119 P 0.00 5.27 0.00 2.06 2.14 0.00 3.29 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.47 0.00 120 S 8.52 4.23 0.00 3.63 3.54 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 0.00 121 V 7.89 4.37 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.81 0.00 0.00 122 Y 8.66 5.20 0.00 2.93 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 0.00 123 P 0.00 4.62 0.00 2.17 2.15 0.00 3.93 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 2.10 2.10 0.00 124 L 8.70 4.86 0.00 1.67 1.63 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.22 4.32 1.41 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 0.00 126 P 0.00 4.19 0.00 2.16 2.18 0.00 3.80 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 127 V 7.90 3.61 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.95 0.00 0.00 128 C 7.97 4.66 0.00 3.21 3.20 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 0.00 129 G 7.97 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 0.00 130 D 7.90 4.36 0.00 2.85 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 0.00 129 T 7.79 4.10 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 0.00 130 T 7.71 4.07 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 0.00 135 G 8.13 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.22 4.88 0.00 3.75 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 0.00 137 S 7.90 5.27 0.00 3.80 3.77 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 0.00 138 V 8.36 4.55 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 0.77 0.00 0.00 1.02 0.00 0.00 139 T 8.51 4.97 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 140 L 8.39 4.70 0.00 1.56 1.30 0.34 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.86 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 9.30 5.63 0.00 2.84 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 0.00 143 L 8.86 5.34 0.00 1.85 1.61 1.00 0.93 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 0.00 144 V 8.61 4.65 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 0.82 0.00 0.00 0.89 0.00 0.00 145 K 8.39 4.82 0.00 1.80 1.77 0.00 1.93 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.52 7.81 146 G 8.66 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 0.00 147 Y 7.82 4.77 0.00 3.00 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 0.00 148 F 9.10 5.23 0.00 3.18 3.20 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 0.00 149 P 0.00 3.94 0.00 1.82 1.52 0.00 3.87 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 150 E 8.37 4.38 0.00 1.23 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 151 P 0.00 4.63 0.00 2.15 1.99 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 152 V 7.67 4.53 1.77 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 0.12 0.00 0.00 0.28 0.00 0.00 153 T 8.72 4.56 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 154 L 8.32 5.59 0.00 1.56 1.41 0.84 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 *156 T 8.35 4.37 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 1.23 0.00 0.00 157 W 8.41 4.72 0.00 3.47 3.16 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 *162 N 8.40 4.38 0.00 3.08 2.93 0.00 0.00 7.18 7.27 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 0.00 163 S 9.63 3.92 0.00 4.02 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 0.00 164 G 7.91 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 0.00 0.00 0.00 165 S 7.83 4.33 0.00 3.89 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.86 4.76 0.00 1.75 1.64 0.94 0.79 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 0.00 167 S 8.49 4.62 0.00 3.84 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 0.00 168 S 8.05 4.15 0.00 3.79 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 0.00 169 G 8.40 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 *171 V 7.38 3.86 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 1.14 0.00 0.00 0.77 0.00 0.00 172 H 8.82 4.62 0.00 2.94 2.44 0.00 5.65 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.25 4.90 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 1.26 0.00 0.00 174 F 9.20 4.44 0.00 2.96 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 0.00 175 P 0.00 4.20 0.00 2.12 2.08 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 176 A 8.53 4.56 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 0.00 177 V 8.62 4.46 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 0.96 0.00 0.00 1.00 0.00 0.00 178 L 8.62 4.61 0.00 1.29 1.41 -0.21 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.62 4.55 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.37 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 180 S 7.36 4.66 0.00 3.80 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 *183 D 8.56 4.61 0.00 2.53 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 0.00 184 L 7.79 4.72 0.00 1.48 1.46 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.31 5.52 0.00 1.73 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 T 8.35 5.57 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 1.31 0.00 0.00 187 L 8.62 5.23 0.00 2.02 1.89 1.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 188 S 8.75 5.36 0.00 3.84 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 0.00 189 S 9.37 5.56 0.00 4.11 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 0.00 190 S 9.42 5.01 0.00 3.92 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 0.00 191 V 7.88 4.37 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 -0.26 0.00 0.00 0.44 0.00 0.00 192 T 8.00 4.79 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 1.19 0.00 0.00 193 V 8.68 4.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.89 0.00 0.00 194 T 8.38 4.27 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 1.21 0.00 0.00 195 S 9.09 4.34 0.00 4.05 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 0.00 196 S 8.04 4.05 0.00 3.93 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 *198 T 7.88 4.99 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 1.30 0.00 0.00 199 W 8.14 5.22 0.00 3.18 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 0.00 200 P 0.00 3.62 0.00 1.72 0.76 0.00 3.52 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.40 0.00 *202 S 7.88 4.52 0.00 4.03 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 0.00 203 Q 8.47 4.64 0.00 1.97 2.09 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 2.32 2.43 0.00 204 S 8.90 4.60 0.00 3.87 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 0.00 205 I 8.71 4.99 2.01 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.05 1.11 0.00 0.00 206 T 9.83 5.93 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 1.24 0.00 0.00 *208 C 8.56 4.84 0.00 1.25 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 0.00 209 N 8.54 5.30 0.00 2.56 2.70 0.00 0.00 6.50 7.38 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 0.00 210 V 8.45 4.65 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 0.87 0.00 0.00 0.74 0.00 0.00 211 A 8.50 4.94 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 0.00 212 H 9.17 4.86 0.00 2.97 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.12 0.00 2.15 2.03 0.00 3.72 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 2.05 2.03 0.00 214 A 7.83 3.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 S 7.65 4.51 0.00 3.91 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 0.00 216 S 7.76 3.72 0.00 4.00 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 0.00 217 T 8.00 4.65 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 1.19 0.00 0.00 218 K 8.72 4.92 0.00 1.67 1.62 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.25 1.30 7.81 219 V 8.77 4.27 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 0.85 0.00 0.00 0.87 0.00 0.00 220 D 8.62 5.08 0.00 2.57 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 0.00 221 K 8.92 4.44 0.00 1.68 1.58 0.00 1.48 0.00 0.00 1.50 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.39 7.81 222 K 8.75 4.51 0.00 1.83 1.75 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.62 7.81 223 I 8.85 4.27 1.98 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 1.47 1.26 0.95 0.00 0.00 *226 E 8.58 4.54 0.00 2.01 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 2.13 1.84 0.00 227 P 0.00 4.91 0.00 2.07 1.83 0.00 3.74 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 1.86 1.56 0.00 * Residues marked with a * may have inaccurate shift predictions.