NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2399 7.8827 121.4424 61.2252 38.6316 173.7895 17 V 4.2888 8.7068 126.3245 61.8445 32.6645 174.5257 18 G 4.0401 8.4628 113.9713 46.5971 0.0000 173.5713 19 G 4.2521 7.7702 110.1213 44.4354 0.0000 172.7265 20 Y 4.9850 8.1312 117.7247 55.2836 42.2214 175.0372 21 T 4.1469 8.5807 117.4301 63.9299 68.4468 175.2592 22 C 4.1861 8.5901 125.4436 59.7063 35.2548 175.4875 23 G 4.0187 8.4051 105.5800 44.7665 0.0000 172.6421 24 A 4.3049 8.3295 124.9510 52.8737 18.6491 176.9941 25 N 4.2826 8.8592 119.4952 54.5624 36.0395 175.3956 26 T 4.2096 7.6062 108.1536 62.6415 69.8522 175.2345 27 V 4.0586 7.0462 122.4508 60.0908 31.3308 173.6007 28 P 4.5199 0.0000 0.0000 63.7847 32.0487 178.2336 29 Y 4.9546 6.8506 115.6821 56.6307 38.8067 174.5924 30 Q 4.5186 7.4053 123.7136 56.3204 29.4549 175.5266 31 V 4.8697 8.9514 119.2734 59.6940 35.8371 174.2204 32 S 5.0292 8.7044 117.3017 56.6865 64.6051 172.7544 33 L 4.4666 8.5014 127.7765 53.5475 43.1550 175.0255 34 N 5.5471 9.0325 122.9920 50.6894 41.5100 173.7492 *37 S 3.8072 8.6060 120.5135 57.8919 63.1876 174.4174 38 G 3.7718 9.3749 114.1739 46.0534 0.0000 170.3624 39 Y 4.5648 6.3107 114.7732 55.9860 40.8469 173.1372 40 H 4.5120 8.9523 122.2174 56.6116 30.3370 174.8113 41 F 5.1227 7.9624 119.4425 56.7092 39.5191 173.7699 42 C 4.8051 6.8720 114.8994 56.1904 44.6420 173.5231 43 G 4.2619 8.9448 109.8497 45.8666 0.0000 172.3082 44 G 4.6840 8.2330 105.6987 46.3043 0.0000 172.5229 45 S 5.4499 8.9845 115.6644 56.3958 66.7110 173.6958 46 L 4.7938 9.2022 127.8880 54.9586 42.3494 177.0880 47 I 4.5008 8.6673 119.5367 60.9952 39.0237 174.4027 48 N 4.8506 7.6040 117.2537 52.1879 39.5298 174.7117 49 S 4.3614 8.7932 111.5454 60.6637 63.2576 175.2225 50 Q 4.6210 8.1921 118.2570 55.2094 30.8650 174.7010 51 W 5.4837 7.9944 116.5326 54.6975 33.4250 174.4103 52 V 5.0980 9.1686 123.7952 61.0847 34.2923 174.3676 53 V 4.8478 8.8973 127.5307 60.8266 33.5509 175.1363 54 S 4.8220 9.0159 117.6492 57.3641 66.4295 171.8663 55 A 4.6429 8.7469 120.5958 50.1355 19.9085 178.5000 56 A 3.8134 8.3362 124.9692 55.2939 18.4057 179.2012 57 H 4.5483 8.4509 109.9932 57.6193 28.7092 175.4820 58 C 4.6537 7.8784 116.9997 57.4028 40.5227 173.3189 59 Y 4.2596 7.6975 122.2633 57.8948 38.7218 175.2496 60 K 3.3345 7.1084 123.7431 55.4807 34.9756 174.9647 61 S 4.2514 7.9080 114.6122 58.7326 63.9619 173.3063 62 G 3.7051 8.4074 106.3784 46.7397 0.0000 173.7001 63 I 4.1487 7.6022 120.0850 60.3813 38.9200 174.9223 64 Q 4.7136 9.0547 128.6655 54.2548 31.2792 174.2721 65 V 4.1763 8.7119 127.3366 62.1550 33.3931 174.6766 66 R 5.0707 8.9801 127.4307 54.7685 32.2385 175.2040 67 L 4.7181 9.1892 124.9890 52.8699 44.5183 177.8228 *69 G 4.1692 8.2733 107.7515 45.3155 0.0000 172.7675 70 E 4.3290 8.2308 118.7590 55.6668 29.9591 174.0351 71 D 4.8293 8.0931 118.9157 55.2229 44.3971 174.7595 72 N 4.7889 8.5416 120.4077 53.2089 39.3190 175.9529 73 I 3.7990 8.4567 119.9271 62.1923 37.8021 176.2342 74 N 4.8130 8.6534 118.0116 53.0126 39.3700 174.6844 75 V 4.3390 7.4755 118.2394 60.6437 34.3636 174.9563 76 V 4.0534 8.4899 126.8189 62.8682 31.2733 175.1315 77 E 4.4521 9.5442 127.2937 55.4177 30.8022 176.4754 78 G 3.8259 7.8016 105.5922 45.3748 0.0000 174.1777 79 N 4.9585 8.1222 116.2567 52.8703 40.2862 174.2997 80 E 4.4794 8.0882 118.6777 56.4983 30.7265 176.3095 81 Q 4.4111 8.9986 121.2654 54.2228 32.4371 174.1889 82 F 5.6019 8.7388 123.1139 56.0374 40.8492 175.4445 83 I 4.6524 8.8433 124.6450 59.3634 40.9877 175.3544 84 S 4.6709 8.7745 122.9799 58.3515 64.0855 173.5538 85 A 4.5426 8.6752 126.1652 52.2094 18.2427 177.7654 86 S 4.5824 8.8540 116.7518 59.6655 64.5379 174.4781 87 K 4.6237 7.4638 117.1729 55.9648 35.3082 174.6774 88 S 5.2852 8.7733 117.0220 57.0099 66.6636 173.9551 89 I 4.6006 9.1760 123.7045 59.4934 40.1660 174.9125 90 V 4.1272 8.4575 127.4284 62.3491 32.6101 175.1794 91 H 3.4916 8.6801 127.0161 55.8478 30.0077 174.3788 92 P 4.2658 0.0000 0.0000 65.3525 31.1518 177.1423 93 S 4.6733 7.8847 112.4867 57.9945 63.1551 173.1331 94 Y 4.3323 7.9711 123.4270 57.8423 38.9721 174.4651 95 N 4.6319 8.4398 126.0897 51.4100 40.0765 175.2295 96 S 3.8847 7.7085 120.1527 59.8513 63.7785 175.4734 97 N 4.3297 8.4408 119.4550 56.1179 38.3279 176.2903 98 T 3.9063 7.7739 104.8602 61.0210 69.6759 175.1214 99 L 3.7321 7.7743 120.5784 55.2412 40.0394 173.9417 100 N 4.3644 7.7808 118.4291 54.8463 39.5269 174.6000 101 N 4.9574 8.7107 120.9126 54.1525 36.1702 175.7343 102 D 4.6476 7.6675 118.4183 52.9054 40.2780 174.3704 103 I 4.8796 7.0637 120.7936 59.4381 42.1961 172.8272 104 M 5.5199 9.1986 126.9364 54.2773 36.3829 173.1794 105 L 5.4392 9.3310 124.0833 53.1978 44.9186 175.4544 106 I 5.0205 9.1354 123.5289 59.4576 40.5956 174.2847 107 K 3.8501 8.5343 128.7384 54.5147 33.6894 175.5520 108 L 4.4027 8.4890 127.7627 54.2547 41.8590 177.5594 109 K 4.2097 8.8235 122.8955 58.9325 32.4940 177.5838 110 S 4.5908 7.7157 111.5812 55.8297 66.0994 173.2708 111 A 4.3735 8.4197 123.6439 51.8288 18.6592 177.4999 112 A 4.2649 9.0697 124.3881 52.1548 19.5676 177.2471 113 S 4.5479 9.1218 116.9010 57.4610 63.7303 174.1076 114 L 4.7972 8.4669 125.5378 53.3632 43.0605 175.8012 115 N 4.8751 8.5135 119.3881 52.4033 39.7269 174.1269 116 S 4.2919 8.6649 113.0193 61.5887 62.8713 175.6347 117 R 4.2061 8.1186 118.3350 56.8602 30.7027 175.9065 118 V 4.6349 8.1292 117.5448 60.9174 33.7910 173.7447 119 A 5.0619 8.5384 127.9397 50.5845 22.8240 175.5405 120 S 4.8872 8.7650 115.2850 58.2671 64.4911 173.0578 121 I 4.4097 8.2772 121.9451 59.1495 39.7834 175.6062 122 S 4.3739 8.4311 124.5880 58.4061 63.9642 174.0121 123 L 4.3705 8.3811 123.2439 53.5457 42.2851 175.4129 124 P 4.4504 0.0000 0.0000 63.3076 31.9846 176.5255 125 T 4.0569 8.2940 116.2500 65.2776 69.2402 175.1459 *127 S 4.3519 7.5460 113.2442 57.7870 64.0574 174.0383 128 C 4.3586 8.4299 118.2811 56.7938 40.5616 173.9075 129 A 4.2981 8.1406 125.9775 51.9228 19.2523 176.9001 130 S 4.5157 8.0496 114.6810 56.5446 65.6743 173.5528 *132 A 4.2752 8.2598 124.2763 53.5653 19.2474 177.1099 133 G 3.9991 9.0390 111.3311 45.3471 0.0000 174.2412 134 T 4.0772 7.5508 117.2904 63.5104 69.4692 174.1375 135 Q 4.5897 8.5830 125.1081 56.0753 29.8421 175.8802 136 C 5.2280 9.2737 119.6421 55.1947 46.1179 172.3926 137 L 5.1709 9.0882 122.6243 53.5968 43.8044 175.0143 138 I 5.2109 9.1525 127.4701 58.8719 39.9586 174.8751 139 S 4.8709 8.4396 119.2535 56.5076 66.3903 173.1581 140 G 3.7509 7.4385 108.5028 46.2482 0.0000 172.8558 141 W 4.5701 8.5658 116.8777 56.2916 29.3176 177.0303 142 G 4.0279 8.4571 109.3785 44.1231 0.0000 173.4811 143 N 3.5768 8.2274 118.2138 54.3204 38.8940 174.5070 144 T 4.9907 8.2401 113.1881 60.4884 69.5032 174.3397 145 K 4.6486 7.7663 121.4789 54.6916 34.8661 176.3685 146 S 4.2509 8.7475 117.5899 60.1996 63.5362 174.4440 147 S 4.5463 8.1514 116.7699 57.9191 64.7198 174.3508 148 G 3.8708 9.7537 114.4969 44.5961 0.0000 171.3277 149 T 4.8898 8.0509 114.5757 62.2122 72.6431 173.9020 150 S 4.5996 9.4871 121.1287 57.4226 66.1124 171.9690 151 Y 4.8576 8.8307 125.3343 55.6641 39.3148 174.1401 152 P 4.6692 0.0000 0.0000 62.5622 32.8341 175.6455 153 D 4.6819 8.6631 118.2870 55.7579 41.7833 177.2211 154 V 5.1705 7.4718 110.5509 58.9163 33.9010 175.8002 155 L 3.2526 8.5950 124.5426 54.8919 43.1278 175.7913 156 K 4.8786 8.1932 125.0444 54.9288 35.1856 174.5993 157 C 5.2541 8.5215 119.3369 55.1330 42.0152 173.0282 158 L 5.0935 8.7300 123.1825 53.6975 45.4075 174.8125 159 K 5.1214 9.0864 125.6286 55.5778 33.3825 175.9711 160 A 4.8850 9.1638 125.5322 50.0494 23.2018 173.5685 161 P 4.9429 0.0000 0.0000 61.9745 33.6800 175.5296 162 I 4.3322 8.4252 123.1916 61.6841 37.9793 175.5602 163 L 4.8567 8.7016 127.2349 53.0324 43.4254 176.9929 164 S 4.2861 8.5221 115.4605 58.4610 63.6901 175.2417 165 D 4.4330 8.7740 122.3130 57.4556 40.4527 179.3455 166 S 4.1534 8.0357 114.7511 61.5731 63.1586 176.6543 167 S 4.1200 8.1843 118.3032 60.8371 62.8287 175.6029 168 C 4.3231 8.4274 122.1889 59.6719 43.2605 175.8008 169 K 4.0278 8.2502 118.9515 59.6058 31.6684 179.2574 170 S 4.2673 8.1986 114.6496 61.5164 62.7832 176.2949 171 A 4.0807 8.0030 122.7270 53.7881 19.5403 177.3390 172 Y 4.8139 7.8228 114.1020 54.8604 38.4328 172.3447 173 P 4.2749 0.0000 0.0000 64.2003 32.2755 176.8927 174 G 4.0252 9.0678 109.6684 46.3097 0.0000 173.9212 175 Q 4.4819 8.0472 117.2323 54.8875 30.9273 175.4845 176 I 4.3448 7.9482 119.0430 60.0734 37.7156 175.5761 177 T 4.4928 8.2469 116.3852 59.8726 70.5524 175.4863 178 S 4.3570 8.5589 114.9921 60.2668 63.1341 174.4088 179 N 5.0125 8.2914 118.6767 53.2744 38.6261 173.7165 180 M 5.5699 7.9217 117.2226 53.6263 35.9925 174.6808 181 F 5.1442 8.6957 115.7082 55.5590 42.2654 172.7912 182 C 5.3874 8.9609 116.4975 56.1599 40.6792 172.5978 183 A 5.0551 9.5128 122.6955 50.5832 22.4364 174.1289 184 G 4.0058 7.3175 106.6246 44.3356 0.0000 175.1145 184A Y 4.6545 8.5124 122.4755 56.0918 41.4388 176.0229 185 L 4.1874 8.7738 125.5739 57.4666 42.0167 179.1269 186 E 3.7599 8.2044 115.5403 57.2814 29.7741 177.5098 187 G 3.8152 7.7245 107.0566 45.0396 0.0000 172.6546 188 G 4.0145 9.7229 106.3147 44.7374 0.0000 173.4232 188A K 4.9068 7.3896 117.3693 55.2434 35.4725 175.1485 189 D 4.7169 8.8692 123.4133 53.4119 45.5054 174.8980 190 S 4.8977 8.1999 115.4945 58.5570 64.7456 171.7034 191 C 4.7380 9.2693 118.8674 55.4852 43.5764 172.3916 192 Q 4.2978 8.5851 119.1943 57.9878 28.4546 178.1990 193 G 4.4925 9.2935 111.0573 45.6187 0.0000 173.8640 194 D 4.6730 8.3878 118.7554 55.4389 41.6516 176.7797 195 S 4.4793 8.0639 115.8509 60.5090 63.5199 175.4152 196 G 4.1443 8.9524 112.7888 46.4022 0.0000 173.7438 197 G 4.4737 7.8267 107.5872 44.8027 0.0000 171.1867 198 P 5.0869 0.0000 0.0000 62.3547 33.3586 175.5501 199 V 4.5806 8.7325 121.7697 61.3795 34.0714 174.1591 200 V 4.7905 8.7697 128.7466 61.2848 34.1843 173.6627 201 C 5.0976 8.8364 124.5870 55.7331 43.9926 174.5618 202 S 3.4387 9.8782 120.1480 59.7017 60.1844 173.1926 203 G 3.9135 8.4644 104.0011 45.7332 0.0000 173.9518 204 K 4.6633 7.5496 117.7857 52.9559 35.1341 175.5343 *209 L 4.3197 8.2863 123.0753 55.4717 42.0442 175.7557 210 Q 4.6092 8.9736 125.7964 56.2360 31.1743 175.7972 211 G 5.2389 8.0178 104.6911 45.7408 0.0000 171.4593 212 I 5.2336 8.1829 119.9164 58.8312 41.1415 175.2368 213 V 3.8281 8.9418 127.3666 64.0159 31.8201 174.2319 214 S 4.7786 8.3620 120.5295 58.5041 64.3474 173.7182 215 W 4.8516 7.1839 114.0102 55.5047 31.9081 172.2878 216 G 3.9073 8.3293 107.3179 46.3842 0.0000 173.0772 217 S 4.6108 8.9533 115.5175 56.9962 62.0247 173.4325 *219 G 4.0132 8.0916 119.3989 45.5163 0.0000 170.8990 220 C 4.9457 8.0865 116.4214 56.3973 42.9878 173.9046 221 A 4.2395 9.4282 125.6387 53.2100 16.7472 177.2037 221A Q 4.5155 7.3642 117.3073 56.1707 29.6664 175.8723 222 K 4.2007 8.4825 122.0273 58.1724 32.5450 176.1908 223 N 4.2760 9.4541 122.1894 54.1011 36.9439 175.2906 224 K 4.2718 7.6500 116.3365 53.9498 32.2497 173.7892 225 P 4.6417 0.0000 0.0000 61.8424 33.3033 177.6780 226 G 3.5613 8.4244 107.2905 46.2968 0.0000 172.6658 227 V 4.4210 7.6810 122.8915 60.6629 33.9917 174.0578 228 Y 4.9490 8.1991 124.4386 55.9566 42.0948 175.0407 229 T 4.2986 8.6081 120.0039 63.6593 70.0193 174.2824 230 K 5.1397 9.3654 128.2556 55.3415 31.3853 177.2648 231 V 3.9741 8.8691 126.4192 65.7894 31.4255 174.9126 232 C 4.4563 8.3498 112.7843 58.4147 41.4843 175.0682 233 N 4.1506 8.1327 117.5389 54.8204 38.3640 175.5954 234 Y 4.7873 8.0371 117.4770 57.5088 38.7857 177.4216 235 V 3.6793 7.8276 121.0205 66.2568 31.6841 177.9602 236 S 4.1417 8.0855 114.3699 61.2824 62.6945 176.3015 237 W 4.1997 8.2939 130.5837 60.4487 30.5005 177.8428 238 I 2.9958 8.3803 120.1131 64.2077 36.5894 178.5655 239 K 3.7608 8.2104 119.5132 59.5424 31.6403 179.5369 240 Q 3.8991 7.7805 117.1151 59.0689 28.9471 178.6102 241 T 3.7112 7.5263 116.8189 66.6161 68.0590 176.7674 242 I 2.6589 7.1389 121.4605 63.9441 36.7465 178.3442 243 A 4.0729 7.5843 120.3531 54.0211 18.1453 178.2197 244 S 4.7131 7.4879 110.6504 58.1338 64.0510 174.0030 245 N 4.6949 8.0245 123.8128 53.6397 39.4238 174.1676 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.24 1.78 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 1.37 0.81 0.87 0.00 0.00 17 V 8.71 4.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 18 G 8.46 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.77 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 0.00 0.00 0.00 0.00 20 Y 8.13 4.98 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.58 4.15 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 1.24 0.00 0.00 22 C 8.59 4.19 0.00 2.72 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 23 G 8.41 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 24 A 8.33 4.30 1.30 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 25 N 8.86 4.28 0.00 2.88 2.93 0.00 0.00 7.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.61 4.21 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 27 V 7.05 4.06 1.72 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 0.25 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.52 0.00 2.38 2.47 0.00 3.81 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 2.20 1.96 0.00 29 Y 6.85 4.95 0.00 3.28 3.43 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 30 Q 7.41 4.52 0.00 1.75 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.73 0.00 0.00 0.00 0.00 0.00 1.83 2.46 0.00 31 V 8.95 4.87 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.04 0.00 0.00 32 S 8.70 5.03 0.00 3.03 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.50 4.47 0.00 0.33 0.96 0.82 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.03 5.55 0.00 2.50 2.47 0.00 0.00 6.78 8.34 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 *37 S 8.61 3.81 0.00 3.72 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 38 G 9.37 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 0.00 0.00 0.00 39 Y 6.31 4.56 0.00 3.09 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.95 4.51 0.00 2.89 3.21 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.96 5.12 0.00 3.10 3.27 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 42 C 6.87 4.81 0.00 2.29 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 43 G 8.94 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 0.00 0.00 0.00 0.00 44 G 8.23 4.68 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 45 S 8.98 5.45 0.00 3.81 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 46 L 9.20 4.79 0.00 1.88 1.68 1.05 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.67 4.50 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.91 0.95 0.00 0.00 48 N 7.60 4.85 0.00 2.96 3.01 0.00 0.00 6.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.79 4.36 0.00 4.21 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 50 Q 8.19 4.62 0.00 2.23 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 51 W 7.99 5.48 0.00 3.27 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 52 V 9.17 5.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.98 0.00 0.00 53 V 8.90 4.85 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 0.92 0.00 0.00 1.02 0.00 0.00 54 S 9.02 4.82 0.00 3.89 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 55 A 8.75 4.64 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 56 A 8.34 3.81 0.31 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 57 H 8.45 4.55 0.00 3.39 3.60 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.88 4.65 0.00 3.24 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 59 Y 7.70 4.26 0.00 2.98 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 60 K 7.11 3.33 0.00 1.42 1.27 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.66 0.97 7.81 61 S 7.91 4.25 0.00 3.96 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.41 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 63 I 7.60 4.15 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.75 0.93 0.00 0.00 64 Q 9.05 4.71 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 65 V 8.71 4.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.90 0.00 0.00 66 R 8.98 5.07 0.00 1.69 1.80 0.00 2.67 0.00 0.00 2.57 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.22 0.00 67 L 9.19 4.72 0.00 1.60 1.65 0.96 0.74 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 *69 G 8.27 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 70 E 8.23 4.33 0.00 2.16 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 2.39 2.07 0.00 71 D 8.09 4.83 0.00 2.79 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 72 N 8.54 4.79 0.00 2.82 2.81 0.00 0.00 7.20 8.58 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 73 I 8.46 3.80 1.43 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.51 -0.55 0.00 0.00 74 N 8.65 4.81 0.00 2.83 2.87 0.00 0.00 6.62 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.48 4.34 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.49 4.05 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 0.85 0.00 0.00 0.98 0.00 0.00 77 E 9.54 4.45 0.00 1.97 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 2.27 2.46 0.00 78 G 7.80 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 0.00 0.00 0.00 79 N 8.12 4.96 0.00 2.71 2.80 0.00 0.00 7.15 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.09 4.48 0.00 1.43 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 2.43 2.45 0.00 81 Q 9.00 4.41 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 82 F 8.74 5.60 0.00 2.82 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.84 4.65 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.89 0.91 0.00 0.00 84 S 8.77 4.67 0.00 3.75 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 85 A 8.68 4.54 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 86 S 8.85 4.58 0.00 3.77 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 87 K 7.46 4.62 0.00 1.84 1.88 0.00 1.57 0.00 0.00 1.90 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.43 7.81 88 S 8.77 5.29 0.00 3.97 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 89 I 9.18 4.60 2.08 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.06 1.18 0.00 0.00 90 V 8.46 4.13 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 0.71 0.00 0.00 0.80 0.00 0.00 91 H 8.68 3.49 0.00 2.80 2.93 0.00 5.65 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.15 2.17 0.00 2.30 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.87 0.00 93 S 7.88 4.67 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 94 Y 7.97 4.33 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 95 N 8.44 4.63 0.00 2.58 2.45 0.00 0.00 6.57 6.91 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 96 S 7.71 3.88 0.00 3.97 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 97 N 8.44 4.33 0.00 2.73 2.78 0.00 0.00 6.93 7.53 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 98 T 7.77 3.91 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 1.09 0.00 0.00 99 L 7.77 3.73 0.00 1.41 1.85 0.71 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.78 4.36 0.00 2.81 2.66 0.00 0.00 7.23 6.58 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 0.00 101 N 8.71 4.96 0.00 2.96 2.63 0.00 0.00 7.23 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.67 4.65 0.00 3.21 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 0.00 103 I 7.06 4.88 1.43 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 1.40 1.28 0.02 0.00 0.00 104 M 9.20 5.52 0.00 2.15 1.83 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.68 0.00 105 L 9.33 5.44 0.00 1.74 1.91 -0.03 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.14 5.02 1.93 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 1.21 0.98 0.90 0.00 0.00 107 K 8.53 3.85 0.00 0.79 1.03 0.00 1.21 0.00 0.00 1.31 0.00 0.00 2.65 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.49 4.40 0.00 1.45 1.57 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.82 4.21 0.00 1.64 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.48 7.81 110 S 7.72 4.59 0.00 3.88 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.42 4.37 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.07 4.26 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.12 4.55 0.00 3.74 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.47 4.80 0.00 1.65 1.62 0.96 1.06 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 0.00 115 N 8.51 4.88 0.00 2.76 2.80 0.00 0.00 7.04 8.10 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 0.00 116 S 8.66 4.29 0.00 3.90 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 0.00 117 R 8.12 4.21 0.00 2.00 1.97 0.00 3.07 0.00 0.00 3.27 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.35 0.00 3.98 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 0.00 128 C 8.43 4.36 0.00 2.94 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 0.00 129 A 8.14 4.30 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 0.00 130 S 8.05 4.52 0.00 3.81 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 *132 A 8.26 4.28 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 0.00 133 G 9.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.55 4.08 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.58 4.59 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.27 5.23 0.00 2.74 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 9.09 5.17 0.00 1.75 1.58 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.15 5.21 1.87 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.57 1.01 0.00 0.00 139 S 8.44 4.87 0.00 3.54 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 0.00 140 G 7.44 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 0.00 141 W 8.57 4.57 0.00 3.19 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 0.00 142 G 8.46 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 0.00 143 N 8.23 3.58 0.00 2.07 2.55 0.00 0.00 7.12 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.24 4.99 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 1.25 0.00 0.00 145 K 7.77 4.65 0.00 1.80 1.87 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.43 7.81 146 S 8.75 4.25 0.00 4.04 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 0.00 147 S 8.15 4.55 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.75 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.05 4.89 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 1.52 0.00 0.00 150 S 9.49 4.60 0.00 3.85 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 0.00 151 Y 8.83 4.86 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.67 0.00 2.43 2.08 0.00 4.05 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 153 D 8.66 4.68 0.00 2.79 3.02 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 0.00 154 V 7.47 5.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.97 0.00 0.00 155 L 8.60 3.25 0.00 1.26 1.24 -0.71 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.88 0.00 1.65 1.50 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.46 7.81 157 C 8.52 5.25 0.00 1.45 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.73 5.09 0.00 1.71 1.47 1.05 1.01 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 0.00 159 K 9.09 5.12 0.00 1.80 1.82 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.68 7.81 160 A 9.16 4.89 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.94 0.00 2.01 2.09 0.00 3.03 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.76 0.00 162 I 8.43 4.33 1.87 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.35 0.79 0.00 0.00 163 L 8.70 4.86 0.00 1.54 1.60 0.93 0.78 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 0.00 164 S 8.52 4.29 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.77 4.43 0.00 2.74 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.04 4.15 0.00 4.06 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 0.00 167 S 8.18 4.12 0.00 4.10 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 0.00 168 C 8.43 4.32 0.00 3.23 3.37 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 0.00 169 K 8.25 4.03 0.00 1.79 1.92 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.71 7.81 170 S 8.20 4.27 0.00 4.03 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 0.00 171 A 8.00 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.82 4.81 0.00 3.19 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 0.00 173 P 0.00 4.27 0.00 2.09 2.06 0.00 3.85 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 174 G 9.07 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 0.00 175 Q 8.05 4.48 0.00 2.40 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.31 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.53 0.00 176 I 7.95 4.34 1.98 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 1.84 1.07 0.99 0.00 0.00 177 T 8.25 4.49 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.56 4.36 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.29 5.01 0.00 3.08 3.10 0.00 0.00 6.63 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.92 5.57 0.00 1.81 2.11 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.70 5.14 0.00 3.10 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.96 5.39 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.51 5.06 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 0.00 184 G 7.32 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.51 4.65 0.00 3.07 3.02 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 0.00 185 L 8.77 4.19 0.00 1.74 1.89 0.92 0.88 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 0.00 186 E 8.20 3.76 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 187 G 7.72 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.72 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.39 4.91 0.00 1.56 1.79 0.00 1.18 0.00 0.00 1.44 0.00 0.00 2.28 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.46 1.26 7.81 189 D 8.87 4.72 0.00 2.79 2.51 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 0.00 190 S 8.20 4.90 0.00 3.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.27 4.74 0.00 2.92 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 0.00 192 Q 8.59 4.30 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.15 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 193 G 9.29 4.49 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 0.00 0.00 0.00 194 D 8.39 4.67 0.00 2.96 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 0.00 195 S 8.06 4.48 0.00 3.99 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 0.00 196 G 8.95 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 0.00 197 G 7.83 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.09 0.00 2.35 2.40 0.00 3.84 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 2.19 2.21 0.00 199 V 8.73 4.58 2.21 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 0.93 0.00 0.00 0.52 0.00 0.00 200 V 8.77 4.79 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.63 0.00 0.00 201 C 8.84 5.10 0.00 2.79 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.88 3.44 0.00 3.94 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.46 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 0.00 0.00 0.00 204 K 7.55 4.66 0.00 1.72 1.64 0.00 1.88 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.29 4.32 0.00 1.50 1.64 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.97 4.61 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.41 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 211 G 8.02 5.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.18 5.23 1.91 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 0.98 0.00 0.00 213 V 8.94 3.83 2.38 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 1.00 0.00 0.00 1.24 0.00 0.00 214 S 8.36 4.78 0.00 3.89 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 0.00 215 W 7.18 4.85 0.00 3.34 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 0.00 216 G 8.33 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 0.00 0.00 0.00 217 S 8.95 4.61 0.00 4.22 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 *219 G 8.09 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.09 4.95 0.00 2.94 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 0.00 221 A 9.43 4.24 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 221A Q 7.36 4.52 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.48 4.20 0.00 1.72 1.72 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.57 7.81 223 N 9.45 4.28 0.00 2.82 2.81 0.00 0.00 6.81 8.05 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 0.00 224 K 7.65 4.27 0.00 1.73 1.77 0.00 1.52 0.00 0.00 1.18 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.47 7.81 225 P 0.00 4.64 0.00 2.14 2.11 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.42 3.56 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 0.00 227 V 7.68 4.42 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 0.33 0.00 0.00 -0.70 0.00 0.00 228 Y 8.20 4.95 0.00 1.44 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.61 4.30 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 1.19 0.00 0.00 230 K 9.37 5.14 0.00 2.11 1.93 0.00 1.83 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.69 7.81 231 V 8.87 3.97 2.35 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 1.17 0.00 0.00 1.12 0.00 0.00 232 C 8.35 4.46 0.00 3.17 3.24 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 0.00 233 N 8.13 4.15 0.00 2.25 2.34 0.00 0.00 6.84 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 0.00 234 Y 8.04 4.79 0.00 3.26 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 0.00 235 V 7.83 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.03 0.00 0.00 236 S 8.09 4.14 0.00 3.97 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 0.00 237 W 8.29 4.20 0.00 3.48 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.38 3.00 1.99 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.91 0.71 0.00 0.00 239 K 8.21 3.76 0.00 1.70 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.58 7.81 240 Q 7.78 3.90 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 241 T 7.53 3.71 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 242 I 7.14 2.66 1.38 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.21 0.54 0.00 0.00 243 A 7.58 4.07 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 0.00 244 S 7.49 4.71 0.00 3.79 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 0.00 245 N 8.02 4.69 0.00 3.00 2.99 0.00 0.00 6.73 7.23 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 * Residues marked with a * may have inaccurate shift predictions.