NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.5285 8.4249 117.7622 52.3986 39.7877 175.1352 8 Y 4.5937 7.5987 113.4585 55.7667 37.9003 174.0668 9 D 5.0028 7.9468 118.9783 53.0473 40.8371 177.2091 10 G 3.7527 8.2673 111.4874 48.6872 0.0000 173.5019 11 D 4.6568 7.5417 116.6394 52.7634 42.2552 174.6700 12 T 4.1971 8.3020 113.7496 64.2803 68.8962 176.5262 13 V 4.0284 7.5572 120.1820 61.6299 31.6876 175.6146 14 T 4.5551 7.2463 116.0144 62.0373 70.5985 173.7215 15 F 4.8352 8.7249 125.6561 56.6804 40.1994 176.2948 16 S 4.2345 8.7579 118.9163 56.8664 64.7152 172.8747 17 P 4.1637 0.0000 0.0000 64.8962 31.1690 177.3027 18 T 4.2353 7.8332 106.8081 60.9809 69.0291 174.5273 19 G 3.5096 7.5883 109.5561 47.2474 0.0000 173.9225 20 R 4.5548 7.8256 116.9800 53.9322 33.0655 175.7837 21 L 4.7943 7.7684 119.2849 52.5225 42.9700 177.4938 22 F 3.4780 8.5178 123.2526 60.4113 38.9931 177.1475 23 Q 4.0161 8.0184 117.0028 59.1365 28.4246 179.3810 24 V 3.5168 7.6070 118.1959 66.1300 31.4233 177.4258 25 E 3.9244 7.7928 116.8130 59.9723 29.7676 178.8803 26 Y 4.5983 8.9207 117.2967 60.9542 37.8661 178.4807 27 A 4.0476 8.4731 122.1667 55.4226 18.5482 179.5169 28 L 3.9905 8.3267 117.7827 58.1570 41.3667 179.3936 29 E 4.0901 8.2407 118.0863 58.5451 29.6892 178.5465 30 A 3.8879 8.5996 121.4178 54.9102 18.3378 179.6992 31 I 3.7596 7.6265 118.2389 64.7090 37.4244 178.5971 32 K 3.9640 7.5585 118.8053 58.8648 31.5278 177.5932 33 Q 4.4560 7.4706 117.7498 55.8312 29.2507 174.8319 34 G 4.3371 7.8003 102.8338 43.3238 0.0000 173.3660 35 S 4.7882 8.6250 115.4854 57.9023 63.5205 174.1704 36 V 4.2495 8.2942 123.6131 62.0908 32.9142 174.7866 37 T 5.0312 8.8098 116.8693 60.5772 70.8921 172.6366 38 V 4.8847 9.5729 129.1270 61.2403 34.9398 174.4032 39 G 4.5920 9.2250 111.9706 44.7670 0.0000 171.3760 40 L 4.9783 8.1162 120.9592 54.6020 43.8871 173.8725 41 R 5.1198 8.8870 117.4508 54.8193 32.7622 174.9272 42 S 5.1279 8.7786 115.0003 58.3250 64.0779 174.3080 43 N 4.8860 9.2173 116.9638 53.9431 39.1382 174.9804 44 T 4.9455 8.3055 107.0398 61.4206 70.9968 172.9898 45 H 5.4803 8.1835 117.9742 54.7518 34.3203 171.9392 46 A 5.0104 9.1010 120.9032 50.5883 22.3101 175.5428 47 V 4.8371 8.8364 122.0827 60.9812 35.5661 174.3962 48 L 4.9141 9.0670 124.5484 53.0220 45.3881 175.5467 49 V 4.7132 8.8446 124.3372 60.9070 33.8337 174.0217 50 A 5.0823 9.2118 129.8459 49.7675 21.8305 174.5426 51 L 4.3384 8.6336 126.0819 54.9557 42.3644 176.9811 52 K 4.4948 9.3049 126.9970 56.1526 33.4043 176.4550 53 R 4.8621 8.6175 122.0387 54.4945 33.2699 174.2345 54 N 4.8882 8.2807 120.7606 50.7959 39.7468 174.3425 55 A 4.1640 7.9356 123.2050 54.2950 19.1690 176.5923 56 D 4.6602 7.3617 112.9362 53.3692 45.0472 174.3302 57 E 4.3797 8.6206 118.3574 56.5706 29.2986 176.1523 58 L 4.7049 7.7811 114.6791 54.4875 43.0883 176.1492 59 S 4.8670 7.7119 114.4924 56.6933 65.5561 172.9710 60 S 4.6493 8.2432 113.7770 57.5623 64.5328 173.5453 *63 Y 5.0918 7.9875 119.1210 58.1664 38.3151 173.1991 64 Q 3.7764 8.1877 122.8730 52.9687 29.9664 176.7290 65 K 4.1450 8.8496 126.9371 57.6032 32.7931 176.7997 66 K 4.4647 9.0124 123.7330 56.3878 34.0166 175.7755 67 I 5.0834 7.7876 120.9240 59.4697 39.3538 175.0609 68 I 4.6358 8.9142 127.5988 59.2422 40.7279 174.7530 69 K 3.4905 8.7297 127.9178 55.7609 32.6663 175.9943 70 C 4.4118 7.7887 122.7024 59.9156 29.9929 172.8216 71 D 4.2822 6.9805 117.0051 53.4640 43.4452 176.1709 72 E 4.1800 8.4729 121.3872 58.6582 29.7264 178.2737 73 H 4.8770 8.0193 113.0388 54.8971 29.2686 172.3867 74 M 4.8580 7.7510 118.2330 55.5563 36.1271 173.4394 75 G 3.5123 8.5389 109.9179 45.6795 0.0000 171.6719 76 L 5.4732 8.8358 119.3667 54.5380 44.3970 174.8532 77 S 5.4962 9.3585 115.4606 56.6484 65.5269 172.9409 78 L 5.3673 8.9414 122.8639 54.2293 43.4545 176.0511 79 A 4.3567 9.1719 122.1566 52.0446 21.8453 173.0609 80 G 3.9164 8.9576 112.2352 44.9428 0.0000 176.2078 81 L 4.1785 9.3432 124.7282 53.9491 40.9527 177.1338 82 A 3.9972 8.5252 126.2122 54.8753 18.3177 176.8556 83 P 4.2005 0.0000 0.0000 66.2320 31.4729 178.3034 84 D 4.5003 8.1224 116.5511 57.4726 40.7620 178.8317 85 A 4.0618 7.9637 120.7356 55.0224 18.3404 179.4610 86 R 3.7816 8.2448 117.4733 59.5579 30.2514 178.6903 87 V 3.6350 8.0209 118.1873 66.2933 31.5300 178.0251 88 L 3.8948 8.5130 119.0721 57.5458 41.3035 179.6993 89 S 4.0339 8.5325 114.7052 61.4344 62.9014 175.8666 90 N 4.2175 8.4403 121.5197 56.5805 38.6790 176.0565 91 Y 3.9947 8.1208 120.6895 60.5854 38.8373 177.8716 92 L 3.8412 8.0568 121.3378 57.9410 42.1135 179.0907 93 R 4.0842 8.4692 120.3343 58.7555 30.0449 178.8375 94 Q 3.9409 8.1401 117.9165 59.3622 28.8961 179.3112 95 Q 3.9879 7.7081 118.6273 58.9164 28.6727 178.8316 96 C 4.1416 8.0940 117.9133 62.7184 28.1162 175.4811 97 N 4.2606 8.4526 119.0412 56.9214 38.5259 176.0846 98 Y 3.9923 8.6059 121.1651 60.8029 38.8526 178.0862 99 S 4.3536 8.2165 113.6651 61.6166 62.4307 176.1816 100 S 4.1001 8.0137 117.5244 61.5692 62.4051 176.4700 101 L 3.8489 7.7907 120.5987 58.1239 41.5895 179.7220 102 V 3.3967 7.2878 116.1038 64.4151 31.4388 176.3076 103 F 4.7464 7.6590 113.3608 55.8069 40.5757 173.9460 104 N 4.3290 8.2565 118.1380 54.4687 37.8280 173.4629 105 R 4.6379 7.8957 114.0582 53.6791 32.8708 174.6870 106 K 4.0857 8.4619 124.5072 55.6076 32.7837 176.6481 107 L 4.0111 8.4305 125.7968 54.5647 42.7849 176.8763 108 A 4.2472 8.4517 128.0719 51.6604 19.9471 178.0785 109 V 3.4171 8.3036 124.2467 66.2509 31.5750 178.0609 110 E 3.7537 8.0056 118.2448 59.3961 29.3008 178.6618 111 R 3.8192 7.7344 117.8090 59.2629 30.2127 178.1059 112 A 4.0443 8.2821 121.1499 54.9976 18.3089 179.6882 113 G 3.5777 8.2783 104.5197 48.5328 0.0000 175.3811 114 H 4.2497 8.2054 119.2662 58.5159 28.6336 177.9525 115 L 4.0205 7.8939 120.5555 57.8959 41.4921 179.3973 116 L 3.6682 7.9533 118.9116 57.8347 41.3569 178.8799 117 C 4.2892 8.2956 118.5436 62.9995 31.2920 175.2279 118 D 4.3591 7.9546 119.3773 57.3926 40.6558 178.9794 119 K 3.8750 8.0340 119.6656 59.3277 32.2191 178.7154 120 A 4.1579 8.1497 121.4264 55.2426 18.3030 179.0150 121 Q 3.9370 8.3260 118.2779 59.7231 27.7384 179.1989 122 K 4.0736 7.7547 117.5547 59.2410 31.7961 177.9512 123 N 4.8235 8.0128 114.4485 53.3339 38.5922 175.3161 124 T 4.6296 7.9926 110.0424 61.1646 69.2520 174.3355 125 Q 4.3956 7.9904 118.7152 55.8674 31.5584 174.4153 126 S 4.6774 7.4897 111.0402 56.6618 65.6593 173.4116 127 A 4.1509 8.4826 127.7865 53.9207 18.5746 176.9132 128 G 3.9863 9.0910 110.6642 45.3408 0.0000 173.9094 129 G 3.9604 7.3208 107.6108 44.7184 0.0000 172.6953 130 R 4.5574 7.8265 113.8530 53.8776 31.9971 173.2236 131 P 4.5483 0.0000 0.0000 62.7145 32.0524 175.5697 132 Y 4.3049 8.6216 117.5351 58.0844 39.1416 176.3645 133 G 4.4049 8.8703 110.0998 43.1668 0.0000 171.9577 134 V 4.8344 7.6004 117.7704 61.2365 34.4483 173.9312 135 G 4.3996 9.1954 110.2954 44.8594 0.0000 172.0207 136 L 5.5481 8.7647 118.7024 53.1682 46.9695 175.2618 137 L 5.2084 9.2942 122.5237 53.1737 44.4633 175.3641 138 I 5.0601 9.1269 125.7934 59.4125 39.7304 174.9698 139 I 5.4936 7.8304 120.2496 58.4374 41.1508 174.8201 140 G 4.3517 8.0768 106.8950 46.0896 0.0000 171.3159 141 Y 5.1509 8.6918 125.0824 56.0272 40.4644 175.0110 142 D 4.5577 7.9138 124.9583 52.6306 41.4357 175.9707 143 K 4.1048 8.7914 116.7095 58.9845 32.2269 177.4473 144 S 4.5946 8.6177 113.9374 57.6375 63.6514 174.7898 145 G 3.3647 7.3788 109.2214 44.7448 0.0000 172.9258 146 A 4.6893 7.9387 119.9194 52.0797 19.7400 177.3477 147 H 4.9414 8.8366 115.9934 54.1739 34.0610 172.4213 148 L 5.2026 8.4066 122.0512 53.5672 45.4962 174.8472 149 L 5.3006 9.3835 125.6664 52.8814 46.0282 174.8513 150 E 5.0470 9.0113 123.3196 54.3883 32.4299 174.1434 151 F 5.3253 9.5047 129.4477 56.4595 42.2141 173.7827 152 Q 4.5221 7.8785 124.4122 53.0835 31.3089 174.8213 153 P 4.1723 0.0000 0.0000 64.8656 31.2626 177.6544 154 S 4.0901 7.8322 113.5296 59.6411 63.2940 174.8567 155 G 4.1109 8.1736 107.9730 45.0261 0.0000 173.0335 156 N 4.7757 7.8965 117.8794 52.2392 40.0343 174.3757 157 V 5.0130 8.3947 122.7184 61.4770 34.7360 174.6768 158 T 4.7290 8.6889 122.8602 61.7879 72.9833 172.3501 159 E 4.8762 8.7962 126.5427 55.3619 30.4522 175.1820 160 L 4.8984 8.5587 126.1013 53.0960 45.3942 176.5503 161 Y 4.3263 8.9541 118.5465 61.1680 39.1027 175.5337 162 G 4.2668 7.3206 103.3162 45.7965 0.0000 172.4283 163 T 4.2119 8.5227 113.0109 63.4787 73.0134 170.6294 164 A 5.0141 8.3755 120.7050 51.9164 21.9986 175.8671 165 I 4.4748 8.9757 112.2554 60.6378 41.7602 173.7218 166 G 3.7827 9.0129 107.5204 43.8861 0.0000 172.0873 167 A 4.2338 8.3314 122.7842 53.1354 18.5101 177.9825 168 R 3.9958 8.9063 120.5443 57.4797 28.0176 178.2398 169 S 4.1262 8.1567 116.6478 62.0068 62.7327 176.0854 170 Q 4.1325 8.4244 122.3615 58.6063 28.3712 179.0680 171 G 4.1912 8.4246 107.8933 47.6274 0.0000 175.7527 172 A 4.1104 8.4933 124.6473 54.3352 18.4100 179.5291 173 K 3.9375 8.1453 118.1883 59.9524 32.0908 179.1510 174 T 4.0324 7.6889 115.0888 66.2835 68.4202 176.0121 175 Y 4.0258 7.8656 121.4217 61.0124 38.7875 178.4720 176 L 4.2543 8.5879 119.7069 57.9098 41.6635 179.0155 177 E 4.0620 8.1433 117.6372 58.1907 29.4905 177.5664 178 R 4.2993 7.1421 116.1982 58.4132 31.9323 177.2828 179 T 3.7554 8.0472 114.1594 64.5837 68.1722 175.6354 180 L 2.4400 7.2574 122.8313 58.3637 41.6809 178.3302 180A D 4.2017 7.6391 119.0215 57.4702 41.2184 179.1012 180B T 4.1159 7.2297 115.7056 66.1573 68.9553 176.8730 180C F 4.7227 7.7904 117.9286 58.8241 37.9808 177.2783 180D I 4.0951 7.8673 119.0860 63.1029 37.8417 176.2262 180E K 4.5729 7.5514 117.0136 56.6107 32.7301 177.6029 180F I 4.0956 7.9495 122.4137 60.0296 35.6632 175.0197 180C D 4.7427 7.8304 118.0286 55.3241 39.4808 177.7783 180D G 3.8851 8.1973 107.9860 47.1029 0.0000 174.7262 180E N 4.9929 7.6614 115.3136 53.5107 38.5301 176.2029 180F P 4.3456 0.0000 0.0000 62.2296 28.9632 175.9197 187 D 4.8136 8.2343 118.5924 57.4466 40.7577 178.6457 188 E 3.9723 8.2557 117.9300 59.5614 29.4794 178.7521 189 L 3.9811 8.0829 119.5152 58.5799 41.9207 179.1944 190 I 3.5494 7.6865 118.6983 64.2649 37.1551 177.9662 191 K 3.9487 8.5198 119.6452 59.7417 31.9890 178.7579 192 A 4.1688 8.6127 120.9752 55.4621 18.4456 179.6893 193 G 3.7439 8.2241 104.3254 47.9412 0.0000 176.0158 194 V 3.4903 8.0864 120.5084 65.8738 31.4802 177.4809 195 E 3.8537 8.6792 119.0068 58.5123 29.5580 178.6550 196 A 3.3497 8.0716 120.7174 54.9805 18.7082 179.5030 197 I 3.6517 7.4631 116.9003 63.7956 37.6447 177.7623 198 S 4.3786 8.1068 114.6330 60.4047 63.0353 175.2619 199 Q 4.4846 7.8733 121.2447 56.3251 28.2348 176.6123 200 S 4.7129 7.6129 111.4811 58.2826 64.4655 173.9844 201 L 4.5900 7.2787 120.6434 53.6797 43.4311 175.1940 202 R 4.3482 8.3070 124.0005 57.5854 34.4898 174.6564 203 D 4.5058 8.4978 116.1674 55.9728 41.1828 175.6036 204 E 4.5249 7.5583 113.1299 56.2197 31.9962 174.1470 *206 S 4.4637 8.6995 111.7870 57.8730 63.4274 173.4883 207 L 3.9049 8.0963 125.5300 55.9067 40.9440 176.7899 *209B T 4.8710 8.4058 112.0881 61.3710 69.9528 174.2772 209C V 3.8206 8.0449 118.6496 63.4348 31.7488 176.9540 209D D 4.5089 7.4756 119.2003 54.9194 42.7794 177.6001 209E N 4.1990 7.5560 116.5292 56.0344 38.4891 174.9163 210 L 4.4615 7.6420 120.3535 55.2183 43.8042 175.9146 211 S 4.9439 8.2129 118.8559 57.4932 66.0811 172.8061 212 I 5.1961 9.0977 127.6811 59.4701 41.3033 174.3860 213 A 5.2219 9.0977 126.4649 49.0712 22.3977 174.9028 214 I 5.3334 7.7038 120.6023 58.3741 42.4412 174.0996 215 V 4.6357 7.3398 122.9080 60.7675 34.5477 172.8868 216 G 3.8504 9.3042 111.2852 46.3322 0.0000 174.9520 217 K 3.4704 6.2048 116.0394 57.6574 32.6089 177.0258 218 D 4.9093 7.2211 118.0482 52.9643 41.7497 177.7927 219 T 4.3893 8.3710 116.9599 61.9682 72.4920 172.2426 220 P 4.7679 0.0000 0.0000 61.7022 32.9021 175.2253 221 F 4.1577 8.5517 124.6303 59.2382 39.8893 174.5454 222 T 4.4591 8.2764 116.4823 59.7002 71.8255 173.0343 223 I 4.2019 8.0399 125.1811 60.1617 38.5932 174.5742 224 Y 4.8772 8.8871 126.4868 56.5579 39.1999 174.7852 225 D 5.0940 8.5681 123.8885 52.2135 45.0533 176.4354 226 G 4.3027 7.7538 110.9994 47.2756 0.0000 176.7498 227 E 3.5682 8.0812 120.6913 59.0321 29.7093 178.7429 228 A 4.0632 7.9315 120.9773 54.1266 18.6959 178.1629 229 V 4.3910 8.4626 108.7228 60.9029 32.7827 177.7365 230 A 3.9610 8.3293 124.8649 55.3246 18.0895 179.6981 231 K 4.1227 7.9233 109.5053 58.1182 32.2212 176.7128 232 Y 4.6276 8.2118 115.8887 58.0826 38.7546 175.8495 233 I 4.0648 7.4863 126.7351 61.4356 37.3204 175.4568 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 7 N 8.42 4.53 0.00 2.76 2.80 0.00 0.00 6.66 6.66 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 8 Y 7.60 4.59 0.00 2.91 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 9 D 7.95 5.00 0.00 2.79 2.44 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 10 G 8.27 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.54 4.66 0.00 2.70 2.62 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 12 T 8.30 4.20 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 1.13 0.00 0.00 13 V 7.56 4.03 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 0.74 0.00 0.00 0.89 0.00 0.00 14 T 7.25 4.56 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 1.43 0.00 0.00 15 F 8.72 4.84 0.00 3.07 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.76 4.23 0.00 4.06 4.54 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 17 P 0.00 4.16 0.00 1.93 2.01 0.00 3.35 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.31 0.00 18 T 7.83 4.24 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 1.20 0.00 0.00 19 G 7.59 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 20 R 7.83 4.55 0.00 1.43 1.67 0.00 2.98 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 21 L 7.77 4.79 0.00 1.55 1.46 0.75 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.52 3.48 0.00 2.82 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.02 4.02 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.34 0.00 24 V 7.61 3.52 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 1.08 0.00 0.00 0.87 0.00 0.00 25 E 7.79 3.92 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.35 0.00 26 Y 8.92 4.60 0.00 2.97 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 27 A 8.47 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.33 3.99 0.00 1.95 1.76 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.24 4.09 0.00 2.21 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 2.39 0.00 30 A 8.60 3.89 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.63 3.76 2.01 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 1.55 0.84 0.93 0.00 0.00 32 K 7.56 3.96 0.00 2.06 1.91 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.48 1.53 7.81 33 Q 7.47 4.46 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 34 G 7.80 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.63 4.79 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.29 4.25 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 0.71 0.00 0.00 0.99 0.00 0.00 37 T 8.81 5.03 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 1.24 0.00 0.00 38 V 9.57 4.88 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 0.99 0.00 0.00 0.94 0.00 0.00 39 G 9.22 4.59 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 0.00 0.00 0.00 40 L 8.12 4.98 0.00 0.78 1.41 0.76 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.89 5.12 0.00 1.91 1.89 0.00 3.01 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 42 S 8.78 5.13 0.00 4.22 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 43 N 9.22 4.89 0.00 3.09 2.97 0.00 0.00 6.50 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 44 T 8.31 4.95 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 1.30 0.00 0.00 45 H 8.18 5.48 0.00 3.13 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 9.10 5.01 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 47 V 8.84 4.84 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 0.91 0.00 0.00 0.88 0.00 0.00 48 L 9.07 4.91 0.00 1.47 1.50 1.12 0.80 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 49 V 8.84 4.71 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 0.89 0.00 0.00 0.84 0.00 0.00 50 A 9.21 5.08 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 51 L 8.63 4.34 0.00 1.68 1.86 1.02 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 K 9.30 4.49 0.00 1.92 1.94 0.00 2.11 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.67 7.81 53 R 8.62 4.86 0.00 1.88 1.74 0.00 3.11 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 54 N 8.28 4.89 0.00 2.35 1.42 0.00 0.00 6.04 7.26 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 55 A 7.94 4.16 1.29 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 0.00 0.00 56 D 7.36 4.66 0.00 2.56 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 57 E 8.62 4.38 0.00 1.90 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 2.28 2.42 0.00 58 L 7.78 4.70 0.00 1.60 1.63 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.71 4.87 0.00 3.93 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.24 4.65 0.00 4.06 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 *63 Y 7.99 5.09 0.00 2.87 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 64 Q 8.19 3.78 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 65 K 8.85 4.15 0.00 1.84 1.87 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.51 7.81 66 K 9.01 4.46 0.00 1.73 2.05 0.00 1.75 0.00 0.00 1.86 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.73 1.44 7.81 67 I 7.79 5.08 1.92 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 1.40 0.62 1.09 0.00 0.00 68 I 8.91 4.64 1.85 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 1.13 0.87 0.87 0.00 0.00 69 K 8.73 3.49 0.00 1.82 1.66 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.24 1.24 7.81 70 C 7.79 4.41 0.00 2.84 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 71 D 6.98 4.28 0.00 2.60 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 72 E 8.47 4.18 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 73 H 8.02 4.88 0.00 3.55 3.51 0.00 5.51 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.75 4.86 0.00 1.81 1.54 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.27 0.00 75 G 8.54 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 76 L 8.84 5.47 0.00 1.84 1.68 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 77 S 9.36 5.50 0.00 3.87 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 78 L 8.94 5.37 0.00 1.61 1.70 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.17 4.36 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 80 G 8.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 9.34 4.18 0.00 1.90 1.70 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.53 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.20 0.00 2.19 2.17 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 84 D 8.12 4.50 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 85 A 7.96 4.06 1.42 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 86 R 8.24 3.78 0.00 1.90 2.14 0.00 3.13 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 87 V 8.02 3.64 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 1.15 0.00 0.00 1.00 0.00 0.00 88 L 8.51 3.89 0.00 1.54 1.39 0.66 0.06 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 89 S 8.53 4.03 0.00 3.94 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 90 N 8.44 4.22 0.00 3.00 2.90 0.00 0.00 6.90 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 91 Y 8.12 3.99 0.00 3.00 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 92 L 8.06 3.84 0.00 1.90 1.75 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.47 4.08 0.00 1.98 1.91 0.00 3.17 0.00 0.00 3.23 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 94 Q 8.14 3.94 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 95 Q 7.71 3.99 0.00 1.80 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.82 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 96 C 8.09 4.14 0.00 3.19 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 97 N 8.45 4.26 0.00 2.95 2.93 0.00 0.00 6.89 7.11 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 98 Y 8.61 3.99 0.00 3.02 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 99 S 8.22 4.35 0.00 4.20 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 0.00 100 S 8.01 4.10 0.00 4.10 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 0.00 101 L 7.79 3.85 0.00 1.41 1.60 0.88 1.15 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 0.00 102 V 7.29 3.40 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 -0.27 0.00 0.00 nan 0.00 0.00 103 F 7.66 4.75 0.00 3.12 2.91 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 0.00 104 N 8.26 4.33 0.00 2.78 2.85 0.00 0.00 6.81 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 0.00 105 R 7.90 4.64 0.00 1.91 1.80 0.00 3.16 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 106 K 8.46 4.09 0.00 1.68 1.35 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.25 1.34 7.81 107 L 8.43 4.01 0.00 1.61 1.61 0.92 1.02 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 0.00 108 A 8.45 4.25 1.22 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 0.00 0.00 109 V 8.30 3.42 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.95 0.00 0.00 110 E 8.01 3.75 0.00 1.94 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 2.17 2.17 0.00 111 R 7.73 3.82 0.00 1.92 2.05 0.00 3.29 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 112 A 8.28 4.04 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 0.00 113 G 8.28 3.58 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 0.00 0.00 0.00 114 H 8.21 4.25 0.00 3.36 3.34 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.89 4.02 0.00 1.96 1.98 0.88 0.74 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 0.00 116 L 7.95 3.67 0.00 1.43 0.72 0.48 0.46 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 0.00 117 C 8.30 4.29 0.00 3.13 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 0.00 118 D 7.95 4.36 0.00 2.85 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 0.00 119 K 8.03 3.87 0.00 1.48 1.31 0.00 0.61 0.00 0.00 1.05 0.00 0.00 2.22 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.06 0.55 7.81 120 A 8.15 4.16 1.62 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 0.00 0.00 121 Q 8.33 3.94 0.00 2.11 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 122 K 7.75 4.07 0.00 2.05 1.86 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.59 7.81 123 N 8.01 4.82 0.00 3.09 3.00 0.00 0.00 6.79 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 7.99 4.63 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 1.31 0.00 0.00 125 Q 7.99 4.40 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 126 S 7.49 4.68 0.00 3.83 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 0.00 127 A 8.48 4.15 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 0.00 128 G 9.09 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.32 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 0.00 0.00 0.00 130 R 7.83 4.56 0.00 1.84 1.80 0.00 3.01 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.50 0.00 131 P 0.00 4.55 0.00 2.08 2.07 0.00 3.66 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 2.01 2.24 0.00 132 Y 8.62 4.30 0.00 3.06 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.87 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 0.00 0.00 0.00 0.00 134 V 7.60 4.83 2.32 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 0.83 0.00 0.00 1.06 0.00 0.00 135 G 9.20 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 0.00 0.00 0.00 0.00 136 L 8.76 5.55 0.00 1.73 1.56 0.67 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 137 L 9.29 5.21 0.00 1.55 1.59 0.98 0.81 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 0.00 138 I 9.13 5.06 1.87 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 1.23 0.81 0.91 0.00 0.00 139 I 7.83 5.49 1.95 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 1.30 0.79 0.95 0.00 0.00 140 G 8.08 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.69 5.15 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 0.00 142 D 7.91 4.56 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 8.79 4.10 0.00 1.73 1.90 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.42 7.81 144 S 8.62 4.59 0.00 3.90 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 0.00 145 G 7.38 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.94 4.69 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 H 8.84 4.94 0.00 3.15 3.09 0.00 5.56 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.41 5.20 0.00 1.71 1.72 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 149 L 9.38 5.30 0.00 1.72 1.52 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 150 E 9.01 5.05 0.00 2.06 1.80 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 2.20 2.24 0.00 151 F 9.50 5.33 0.00 3.12 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 0.00 152 Q 7.88 4.52 0.00 1.71 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 153 P 0.00 4.17 0.00 1.91 2.46 0.00 3.50 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.34 0.00 154 S 7.83 4.09 0.00 3.92 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 0.00 155 G 8.17 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 N 7.90 4.78 0.00 2.61 2.71 0.00 0.00 6.36 7.56 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 0.00 157 V 8.39 5.01 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 0.88 0.00 0.00 1.24 0.00 0.00 158 T 8.69 4.73 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 0.00 159 E 8.80 4.88 0.00 1.95 1.80 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 2.16 2.46 0.00 160 L 8.56 4.90 0.00 1.61 1.65 1.03 0.77 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 0.00 161 Y 8.95 4.33 0.00 3.12 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 G 7.32 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 0.00 163 T 8.52 4.21 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 0.00 164 A 8.38 5.01 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 0.00 165 I 8.98 4.47 1.89 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 0.70 0.94 0.00 0.00 166 G 9.01 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 A 8.33 4.23 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 R 8.91 4.00 0.00 2.07 2.07 0.00 3.28 0.00 0.00 3.40 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 169 S 8.16 4.13 0.00 4.08 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 Q 8.42 4.13 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 171 G 8.42 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 0.00 0.00 0.00 172 A 8.49 4.11 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 0.00 173 K 8.15 3.94 0.00 1.92 1.88 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.56 7.81 174 T 7.69 4.03 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 0.00 175 Y 7.87 4.03 0.00 3.11 3.22 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 0.00 176 L 8.59 4.25 0.00 1.96 2.14 1.08 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 177 E 8.14 4.06 0.00 2.27 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 0.00 2.32 2.34 0.00 178 R 7.14 4.30 0.00 1.85 1.68 0.00 3.35 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.69 0.00 179 T 8.05 3.76 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 1.16 0.00 0.00 180 L 7.26 2.44 0.00 1.52 1.28 0.26 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 180A D 7.64 4.20 0.00 2.51 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 180B T 7.23 4.12 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 1.23 0.00 0.00 180C F 7.79 4.72 0.00 3.22 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180D I 7.87 4.10 1.69 0.00 0.00 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 1.18 0.76 0.80 0.00 0.00 180E K 7.55 4.57 0.00 1.85 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.37 7.81 180F I 7.95 4.10 1.97 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 1.38 1.16 1.00 0.00 0.00 180C D 7.83 4.74 0.00 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0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 200 S 7.61 4.71 0.00 3.91 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 0.00 201 L 7.28 4.59 0.00 1.64 1.61 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 202 R 8.31 4.35 0.00 1.72 1.87 0.00 3.28 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.49 0.00 203 D 8.50 4.51 0.00 2.67 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 0.00 204 E 7.56 4.52 0.00 2.15 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 0.00 2.20 2.49 0.00 *206 S 8.70 4.46 0.00 3.88 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 0.00 207 L 8.10 3.90 0.00 1.85 1.79 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 *209B T 8.41 4.87 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 1.24 0.00 0.00 209C V 8.04 3.82 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 209D D 7.48 4.51 0.00 1.62 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 0.00 0.00 0.00 0.00 209E N 7.56 4.20 0.00 2.79 2.82 0.00 0.00 6.81 6.74 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 0.00 210 L 7.64 4.46 0.00 1.88 1.50 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 211 S 8.21 4.94 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 0.00 212 I 9.10 5.20 1.84 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 0.58 0.78 0.00 0.00 213 A 9.10 5.22 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 I 7.70 5.33 1.83 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 2.83 0.87 0.00 0.00 215 V 7.34 4.64 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 0.72 0.00 0.00 1.11 0.00 0.00 216 G 9.30 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 0.00 217 K 6.20 3.47 0.00 1.50 1.56 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.45 7.81 218 D 7.22 4.91 0.00 2.57 2.56 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 0.00 219 T 8.37 4.39 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 1.23 0.00 0.00 220 P 0.00 4.77 0.00 2.11 2.06 0.00 3.80 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 221 F 8.55 4.16 0.00 3.10 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 0.00 222 T 8.28 4.46 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 1.13 0.00 0.00 223 I 8.04 4.20 1.82 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.90 0.00 0.00 224 Y 8.89 4.88 0.00 2.91 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 0.00 225 D 8.57 5.09 0.00 2.58 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 0.00 226 G 7.75 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 E 8.08 3.57 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 228 A 7.93 4.06 1.22 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 0.00 0.00 229 V 8.46 4.39 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 0.76 0.00 0.00 1.03 0.00 0.00 230 A 8.33 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 K 7.92 4.12 0.00 1.58 1.72 0.00 1.39 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 0.87 7.81 232 Y 8.21 4.63 0.00 2.99 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 0.00 233 I 7.49 4.06 1.87 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 1.18 0.56 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.