NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4769 8.2893 118.7925 54.2270 33.7124 175.1254 2 T 4.4452 7.6350 106.9797 59.2125 71.5014 172.1109 3 T 4.3705 8.9142 120.3675 61.4052 69.0864 174.4811 4 P 4.5777 0.0000 0.0000 62.5044 32.4147 175.5027 5 N 4.8470 8.5086 120.9063 52.4432 41.0150 173.6541 6 F 5.5598 8.8255 123.3548 55.8421 42.5183 174.1018 7 E 5.1736 9.4430 121.7761 54.4838 33.4845 174.3016 8 L 5.1282 9.2050 126.8186 53.5612 44.5939 174.7760 9 Y 4.8734 9.2693 125.8132 57.4362 39.0373 175.1256 10 G 4.6445 9.2391 111.0096 44.8521 0.0000 169.8643 11 Y 5.5503 8.6120 120.2368 55.4951 41.7568 176.1062 12 F 4.1835 8.5730 121.2706 59.5440 37.9380 176.0705 13 R 3.8578 5.8400 117.6417 55.5440 30.2546 176.0612 14 S 4.3299 7.8433 113.4075 58.7736 63.3144 174.6988 15 S 4.2794 8.7651 124.9231 61.8116 62.3723 176.3012 16 C 4.2060 8.0603 119.9163 62.7457 27.9807 176.0415 17 S 4.3718 8.1778 116.8875 61.3717 62.4076 176.7438 18 G 3.9624 8.6669 109.0008 48.0152 0.0000 175.7436 19 R 3.9539 7.9453 120.3097 59.2450 30.1228 179.2434 20 L 3.9942 7.7054 117.7660 57.5333 41.6112 179.7359 21 R 4.0409 8.2035 118.1262 59.4272 30.1315 178.8860 22 I 3.7551 7.9870 119.2430 64.5239 37.1570 178.3850 23 A 3.8797 7.8708 121.0960 55.1653 18.2270 179.5532 24 F 3.9002 8.0592 116.3336 61.0498 38.9376 177.7797 25 H 4.2793 8.3501 115.5456 58.9438 28.3724 177.7677 26 L 4.0320 7.8410 119.4657 57.5660 41.5569 178.9293 27 K 4.2234 7.9042 115.0822 55.4018 32.7806 176.6857 28 S 3.7525 7.8801 114.5715 59.7353 60.9266 172.4869 29 I 4.5181 7.7972 119.9485 58.8144 38.7543 174.8066 30 P 4.6525 0.0000 0.0000 63.0463 32.1949 174.8294 31 Y 5.0209 7.6273 115.9924 56.3580 40.9425 173.7695 32 T 4.1515 8.7967 120.7808 63.3434 70.1942 174.5732 33 R 4.7677 8.1684 127.0354 55.8404 31.0804 172.4112 34 H 4.7334 9.2662 123.6262 52.2071 30.3587 171.8800 35 P 4.9958 0.0000 0.0000 62.3990 32.2089 176.3242 36 V 4.4997 8.9607 123.9004 61.2004 33.9711 175.1225 37 N 4.8267 9.7553 128.4561 52.3668 37.7919 175.1635 38 L 3.8290 7.9495 126.8241 57.2850 41.8934 179.5793 39 L 4.1288 8.0451 117.0644 55.9784 41.9323 177.5612 40 K 4.3853 8.2925 116.3450 55.2147 32.2141 176.1258 41 G 3.9829 7.5627 106.5885 46.6199 0.0000 174.9906 42 E 3.9668 8.4645 120.5692 58.7979 29.4895 178.5791 *55 N 4.6427 7.9745 115.4550 51.7003 39.4880 178.9320 56 T 4.6096 7.7404 108.4592 60.7651 70.6388 174.0154 57 V 4.4351 8.0607 123.7512 60.2669 34.0672 173.3244 58 P 4.9612 0.0000 0.0000 62.5702 32.9676 175.1158 59 L 4.8317 8.8367 121.8397 53.3392 45.3762 174.5967 60 L 5.0864 8.9576 129.1744 53.8136 43.8405 174.9248 61 V 4.7375 9.1109 127.2902 61.2010 33.8355 174.3106 62 V 4.7617 9.1746 128.0187 61.4195 34.3330 174.5916 63 S 5.1989 8.7793 123.6725 56.5601 67.0785 172.7425 64 N 4.3981 8.7066 115.4403 55.1722 36.9321 173.1570 65 I 4.5998 7.3399 107.3712 58.6769 41.1262 174.9278 66 N 4.4492 8.4528 119.7487 52.6257 37.7458 174.1704 67 N 4.4666 8.2966 125.1691 52.7716 37.5197 175.4266 68 T 4.0337 7.9551 114.3506 63.2202 69.6294 176.8273 69 V 3.6979 7.8398 121.7898 65.3407 31.9003 176.6348 70 S 4.6428 8.8026 121.4475 55.5002 62.9550 172.8909 71 P 4.6769 0.0000 0.0000 64.4736 31.3761 177.7924 72 S 4.4220 7.9717 110.0975 58.5236 63.6283 173.5402 73 S 4.6482 7.9075 116.7623 56.8280 63.4818 173.7808 74 A 4.1299 8.7156 130.5185 54.3348 18.5700 177.2696 75 S 5.0586 7.7362 108.6082 56.9538 66.1241 173.4395 76 F 5.1855 9.1108 121.2796 56.7307 42.7479 173.0560 77 S 4.9914 8.2039 119.3318 56.3865 65.8974 173.2692 78 I 4.1138 8.5702 122.6791 59.4780 39.9624 176.0920 79 G 4.1408 8.7706 114.7061 45.1267 0.0000 172.9232 80 Q 4.6430 7.6062 119.3301 53.4845 32.3544 176.5797 81 S 4.2386 8.6334 119.8052 61.1264 63.3288 176.8111 82 L 3.8933 7.8710 122.0700 57.6618 41.4963 178.6344 83 A 4.0310 8.1771 120.0232 55.4318 18.1720 179.3984 84 A 4.0188 8.0781 118.8201 55.3867 18.6265 179.8046 85 L 3.8574 8.1143 117.6525 58.1211 41.8166 179.7384 86 E 4.0474 8.4482 118.4297 59.1826 29.3684 178.7135 87 Y 4.1420 8.2687 120.0584 60.6890 38.6147 177.9841 88 L 3.9072 8.0428 119.8992 57.8785 41.4454 179.3213 89 E 3.9574 7.7755 116.9248 59.1402 29.4744 178.5058 90 E 4.2972 7.5669 115.8798 57.8383 30.4328 178.0204 91 A 4.0214 7.9938 120.0417 53.0862 19.9557 177.5355 92 L 4.7593 7.1649 115.9918 52.5472 41.6917 175.6616 93 P 4.3356 0.0000 0.0000 64.9595 32.0146 178.1249 94 T 4.3389 7.6721 107.6075 61.1212 69.2120 174.2749 95 N 4.3137 7.8623 121.3623 53.9307 39.3049 174.9774 96 A 4.0997 8.6067 127.4828 54.1118 18.7665 177.5227 97 R 4.4441 8.0868 116.3969 53.2099 29.8470 172.4679 98 P 4.4316 0.0000 0.0000 62.3391 32.2438 176.4365 99 L 4.5573 9.2778 121.4418 54.2646 42.0038 175.9402 100 L 5.0183 7.3427 117.8172 51.7888 45.0038 174.6527 101 P 4.3549 0.0000 0.0000 61.9480 32.1108 174.6303 102 P 4.4413 0.0000 0.0000 62.5899 31.7674 177.2914 103 I 4.0126 8.1483 119.1985 63.4780 38.0130 176.9027 104 S 4.3133 8.0314 112.8743 59.6553 63.8356 173.5578 105 N 5.0324 8.3067 120.2079 51.6385 38.4250 173.0663 106 P 4.3118 0.0000 0.0000 65.2339 31.9434 178.6557 107 V 3.5456 7.8001 116.7121 66.0771 31.5011 177.7598 108 A 4.0246 8.0946 119.9611 55.2835 18.2132 179.8100 109 R 3.8622 8.1018 116.4012 59.3174 30.0301 179.1674 110 A 4.0242 8.3269 120.9213 55.1697 18.3803 179.2703 111 H 3.9931 8.1337 116.9499 59.2182 29.9897 177.4576 112 V 3.5716 7.9192 120.1594 66.3922 31.3584 178.2956 113 R 3.9255 8.0622 117.4781 59.3540 29.7647 179.1682 114 T 3.7997 8.0478 115.7686 66.6824 68.5688 176.6443 115 I 3.5736 7.4504 121.0354 64.5238 37.0673 178.2085 116 C 4.0467 8.0611 117.4657 63.0338 27.9016 176.0658 117 N 4.2603 8.6166 118.2906 56.1427 38.1000 177.4750 118 I 3.6010 7.8287 121.3650 64.4308 37.1257 178.5699 119 I 3.4833 7.4131 119.6538 64.3861 36.7907 178.3672 120 A 4.0494 8.4918 119.9292 53.9637 18.3671 177.7761 121 C 4.5308 8.2046 114.1775 60.9533 29.9710 174.8040 122 D 4.5924 7.8692 116.9375 54.8737 41.0656 176.8363 123 V 4.1847 7.2521 115.5925 64.3576 33.3061 176.7889 124 Q 3.9891 8.4780 119.1399 58.9475 28.8084 176.9743 125 P 4.3996 0.0000 0.0000 64.4141 31.5725 177.8392 126 V 4.5253 7.4056 109.2451 61.1695 32.0801 176.0537 127 T 4.7658 7.4582 107.5666 60.6090 69.6164 174.1916 128 N 4.7557 7.8734 121.4386 51.8819 40.5380 175.0439 129 L 3.8684 8.3026 120.4903 58.3896 42.1251 178.7253 130 K 3.8929 7.9851 118.9123 59.6071 32.2083 178.6403 131 I 3.7859 7.9872 119.9026 64.0532 37.0644 178.2473 132 Q 3.8065 8.1802 119.1214 58.8255 28.4256 179.0876 133 K 3.8656 8.0786 119.3770 59.4058 31.9605 179.5038 134 K 3.8276 7.6788 118.3202 59.3974 31.9348 179.5631 135 V 3.1532 7.7601 118.8853 65.6620 31.2689 178.0548 136 K 4.0165 8.1224 119.3276 59.3485 31.8142 178.6289 137 A 4.1069 7.9949 120.4661 54.7747 18.2868 178.6246 138 L 4.1917 7.2542 114.9001 54.2636 41.8435 176.3090 139 D 4.3559 8.1811 117.8912 55.1992 39.9672 173.7980 140 G 3.8597 7.8424 106.4190 43.9718 0.0000 173.8097 141 D 4.7337 8.2770 118.1257 52.0624 42.2766 174.7461 142 P 4.3500 0.0000 0.0000 65.6437 31.4782 178.6146 143 T 3.9107 8.0279 116.0800 66.5530 68.4167 176.7780 144 V 3.6018 8.0282 119.6807 65.6425 31.6799 177.3969 145 W 4.1965 8.3042 128.1267 60.9233 30.5524 178.1479 146 S 4.3194 8.5367 114.8938 61.5293 62.1902 176.7265 147 R 3.8875 8.3577 121.6596 59.5189 29.9001 178.2302 148 D 4.3473 8.1308 118.6413 57.5276 40.8407 178.9485 149 L 3.9050 7.9214 119.1504 57.5282 41.4744 179.3856 150 A 4.1024 8.5349 121.2375 55.5138 18.3202 179.8371 151 T 3.9452 8.2912 114.5895 66.6985 68.3971 176.6270 152 Q 4.0582 8.2425 121.6141 59.2710 29.1365 178.7088 153 G 3.5042 8.1761 106.6453 47.8790 0.0000 175.7124 154 F 3.5972 8.5761 120.6451 59.6823 38.7286 177.9326 155 G 3.8099 8.0589 105.4481 47.9304 0.0000 175.6462 156 A 4.0203 7.7405 123.4435 54.5213 18.2748 179.8450 157 V 3.3761 7.6330 116.8310 66.1218 31.5008 177.6870 158 E 3.9558 8.3614 119.3147 59.5382 29.2348 178.9681 159 K 3.9682 7.7294 116.5981 59.4709 32.4244 178.9893 160 L 4.2129 7.6700 119.4649 57.6186 41.4903 179.4104 161 L 4.0983 8.3139 119.2992 57.6187 41.2942 178.9552 162 E 3.9424 8.2984 118.3017 59.7551 29.4617 179.1381 163 L 4.2703 7.6596 117.4663 56.3903 42.1063 177.8836 164 S 4.5078 7.7631 110.9717 58.1962 65.1885 174.0385 165 A 4.9608 7.7690 123.9611 51.5897 20.0260 175.1524 166 G 3.9784 8.1513 108.7461 45.4003 0.0000 174.8350 167 R 3.6747 8.0993 123.7247 58.0522 30.3219 174.7919 168 F 5.1453 7.5980 115.1807 55.3196 42.7843 174.9670 169 C 3.8985 9.4848 118.6832 62.8522 27.8659 174.5654 170 V 4.5227 7.4007 118.8639 61.5816 33.4904 175.7463 171 G 3.8434 8.9803 119.3561 46.3319 0.0000 173.8282 172 D 5.1230 8.8505 124.4992 53.9551 41.6831 175.4356 173 E 4.8824 7.8868 118.1015 54.0725 32.3445 175.9087 174 I 3.5243 7.7667 122.9249 61.5197 37.9256 175.5162 175 T 4.8071 9.2016 114.2283 58.9958 71.9682 174.4918 176 L 3.9595 8.5202 120.0924 57.6703 41.2182 179.6452 177 A 3.9279 7.7116 121.1976 55.3419 18.3119 179.4370 178 D 4.2939 7.9785 116.8947 57.3246 40.7159 178.8919 179 V 3.5110 7.3514 117.5542 66.3420 31.5439 177.6454 180 C 4.2356 8.3264 116.5958 62.2705 27.8811 175.7905 181 L 3.9019 7.9097 122.1851 58.0430 41.7815 179.0932 182 V 3.5490 7.5728 118.0534 65.7584 31.4806 176.3093 183 P 4.0528 0.0000 0.0000 64.7855 31.1556 178.4305 184 A 4.1032 7.5821 118.8769 54.8168 18.2290 179.8081 185 V 3.3201 7.9794 117.1959 65.9135 31.2666 178.3211 186 W 4.4877 7.7048 117.3309 59.7087 28.7477 178.1039 187 A 4.1046 8.1732 120.6364 55.0350 17.9329 179.5699 188 A 3.9954 8.3097 119.6184 55.2971 18.3747 179.7023 189 E 3.9148 8.3437 117.2044 59.4762 29.2522 179.4998 190 R 3.9829 7.5578 116.7975 58.5344 30.0482 177.9658 191 V 4.3613 7.4623 109.6375 60.6260 32.0997 176.1235 192 G 3.8624 7.8082 105.9918 46.0417 0.0000 173.8560 193 M 3.9875 7.7192 119.4809 54.9756 32.8681 175.9143 194 D 4.5089 8.5321 125.6997 53.1287 40.5860 176.1749 195 L 4.0578 8.3747 129.5239 57.5976 42.2852 178.2776 196 A 4.2258 7.9473 121.5236 53.9585 18.3730 178.8571 197 R 3.8978 7.3657 113.3204 57.1648 29.7906 182.6289 198 F 5.0422 7.6594 115.7679 54.9117 39.5192 173.5697 199 P 4.3019 0.0000 0.0000 65.7523 31.3966 178.6922 200 I 3.7325 8.4069 119.8017 64.3533 36.9697 178.2954 201 T 3.9689 8.5593 116.7702 66.7521 68.3053 176.4366 202 K 4.0726 8.5320 121.6015 59.5057 32.2126 178.7430 203 R 3.9158 8.4860 119.4291 59.5296 29.9453 178.7291 204 V 3.6174 8.2677 118.4236 65.8078 31.5705 177.5157 205 F 4.2487 8.6260 120.7536 61.7168 38.9823 177.0531 206 E 3.8836 8.3899 116.6976 59.2445 29.5672 178.8511 207 E 4.1241 8.4018 118.7503 59.8525 29.5283 179.3342 208 M 4.1974 8.4698 118.8892 58.3961 31.8082 178.6547 209 L 4.0567 7.6220 117.6399 56.7908 41.8047 178.7536 210 K 4.2620 7.6460 116.9834 56.3994 32.6545 176.7041 211 E 4.2573 7.8732 121.1350 55.4826 30.4341 177.0816 212 E 3.8910 9.1176 124.1371 59.6102 29.3759 178.9555 213 A 4.1071 7.8908 119.1635 55.0800 18.6823 179.3302 214 V 3.7963 7.7514 116.4054 66.2247 31.7716 178.1418 215 Q 4.1460 8.5999 120.6182 59.5884 28.3353 179.5822 216 K 4.0199 8.4775 123.8888 58.9494 31.7409 179.9550 217 A 4.8046 7.3382 117.6625 51.4261 19.8841 176.7828 218 H 4.2182 7.5724 118.9698 55.6075 30.5000 176.5132 219 W 4.4230 7.4607 122.5437 59.3631 28.1687 176.8933 220 Q 3.7286 7.0482 116.1949 56.2791 28.3440 176.5095 221 K 4.5525 7.6941 116.8936 56.0014 33.4245 176.0154 222 Q 4.5622 7.9798 120.7765 54.7050 30.5398 177.4740 223 E 3.9669 8.7167 115.7973 58.6062 29.8084 178.3113 224 D 4.7520 7.8317 115.1343 53.2226 39.7982 176.2424 225 T 2.5922 7.3120 117.7945 62.4655 68.7592 172.9009 226 P 4.2056 0.0000 0.0000 62.9625 32.3992 177.6900 227 E 3.9096 8.9073 117.6854 59.2003 29.6022 179.6302 228 D 4.5213 7.9744 117.0263 55.0845 39.7135 176.7144 229 L 4.4638 7.5584 118.3851 54.6020 42.2556 177.0911 230 R 4.1058 7.6294 118.0072 55.8122 30.6075 176.5687 231 A 4.0114 7.8945 122.9923 52.7229 18.9578 176.1522 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 1 M 8.29 4.48 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 T 7.63 4.45 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 1.21 0.00 0.00 3 T 8.91 4.37 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 1.29 0.00 0.00 4 P 0.00 4.58 0.00 1.15 1.87 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 5 N 8.51 4.85 0.00 2.85 2.63 0.00 0.00 7.24 6.99 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 6 F 8.83 5.56 0.00 3.04 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 7 E 9.44 5.17 0.00 2.04 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 2.26 2.31 0.00 8 L 9.20 5.13 0.00 1.62 1.70 1.08 0.84 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 9 Y 9.27 4.87 0.00 3.08 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 10 G 9.24 4.64 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 0.00 0.00 0.00 11 Y 8.61 5.55 0.00 3.01 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 12 F 8.57 4.18 0.00 3.32 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 5.84 3.86 0.00 0.67 1.51 0.00 3.03 0.00 0.00 2.87 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.84 0.00 14 S 7.84 4.33 0.00 4.15 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 15 S 8.77 4.28 0.00 4.14 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.06 4.21 0.00 3.03 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 17 S 8.18 4.37 0.00 4.18 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 18 G 8.67 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 19 R 7.95 3.95 0.00 2.06 1.98 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.94 0.00 20 L 7.71 3.99 0.00 1.93 1.85 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.20 4.04 0.00 2.20 2.21 0.00 3.47 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.08 0.00 22 I 7.99 3.76 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.99 0.89 0.00 0.00 23 A 7.87 3.88 1.11 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 24 F 8.06 3.90 0.00 2.85 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 25 H 8.35 4.28 0.00 3.46 3.42 0.00 5.82 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 26 L 7.84 4.03 0.00 1.72 1.69 0.87 0.70 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 27 K 7.90 4.22 0.00 1.72 1.87 0.00 1.78 0.00 0.00 1.48 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.57 1.45 7.81 28 S 7.88 3.75 0.00 4.03 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 29 I 7.80 4.52 2.05 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 1.38 0.68 1.00 0.00 0.00 30 P 0.00 4.65 0.00 2.22 2.08 0.00 3.97 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 31 Y 7.63 5.02 0.00 2.66 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 0.00 0.00 0.00 0.00 32 T 8.80 4.15 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 1.02 0.00 0.00 33 R 8.17 4.77 0.00 1.59 1.72 0.00 3.21 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.21 0.00 34 H 9.27 4.73 0.00 2.09 2.95 0.00 5.60 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 5.00 0.00 2.03 2.08 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.74 4.61 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 1.19 0.00 0.00 57 V 8.06 4.44 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 1.01 0.00 0.00 0.97 0.00 0.00 58 P 0.00 4.96 0.00 2.20 2.13 0.00 3.79 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 59 L 8.84 4.83 0.00 1.94 1.55 0.83 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.96 5.09 0.00 1.91 1.56 1.34 1.30 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 61 V 9.11 4.74 2.31 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 1.02 0.00 0.00 1.04 0.00 0.00 62 V 9.17 4.76 2.29 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 1.02 0.00 0.00 0.99 0.00 0.00 63 S 8.78 5.20 0.00 3.73 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 64 N 8.71 4.40 0.00 2.77 2.92 0.00 0.00 6.64 7.94 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 65 I 7.34 4.60 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.76 1.04 0.00 0.00 66 N 8.45 4.45 0.00 2.67 2.79 0.00 0.00 6.95 7.79 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 67 N 8.30 4.47 0.00 2.76 2.91 0.00 0.00 6.86 7.22 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 68 T 7.96 4.03 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 1.17 0.00 0.00 69 V 7.84 3.70 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 0.86 0.00 0.00 0.87 0.00 0.00 70 S 8.80 4.64 0.00 3.86 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 71 P 0.00 4.68 0.00 2.03 2.11 0.00 3.72 0.00 0.00 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 72 S 7.97 4.42 0.00 3.98 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 7.91 4.65 0.00 3.85 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 74 A 8.72 4.13 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 75 S 7.74 5.06 0.00 4.01 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 76 F 9.11 5.19 0.00 3.00 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 77 S 8.20 4.99 0.00 3.68 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 78 I 8.57 4.11 1.73 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 -0.01 0.90 0.00 0.00 79 G 8.77 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 80 Q 7.61 4.64 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 81 S 8.63 4.24 0.00 4.05 4.13 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 82 L 7.87 3.89 0.00 1.71 1.75 0.90 0.71 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 83 A 8.18 4.03 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 84 A 8.08 4.02 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 85 L 8.11 3.86 0.00 1.83 1.67 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.45 4.05 0.00 2.04 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 0.00 2.40 2.51 0.00 87 Y 8.27 4.14 0.00 3.26 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.04 3.91 0.00 1.68 1.43 -0.05 0.21 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 89 E 7.78 3.96 0.00 2.14 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 2.45 2.45 0.00 90 E 7.57 4.30 0.00 1.89 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 2.25 2.39 0.00 91 A 7.99 4.02 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.16 4.76 0.00 1.78 1.57 1.02 0.99 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 93 P 0.00 4.34 0.00 2.15 2.15 0.00 3.77 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 1.97 1.93 0.00 94 T 7.67 4.34 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 95 N 7.86 4.31 0.00 2.77 2.78 0.00 0.00 7.06 8.11 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 96 A 8.61 4.10 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 97 R 8.09 4.44 0.00 1.69 1.78 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.31 0.00 2.19 2.08 0.00 3.65 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 2.11 2.13 0.00 107 V 7.80 3.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.93 0.00 0.00 108 A 8.09 4.02 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 0.00 109 R 8.10 3.86 0.00 2.04 1.99 0.00 3.36 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 110 A 8.33 4.02 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 0.00 111 H 8.13 3.99 0.00 3.30 3.43 0.00 5.80 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 V 7.92 3.57 2.22 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 0.97 0.00 0.00 0.97 0.00 0.00 113 R 8.06 3.93 0.00 1.89 1.94 0.00 3.17 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 114 T 8.05 3.80 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 1.13 0.00 0.00 115 I 7.45 3.57 1.93 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 1.42 0.91 0.81 0.00 0.00 116 C 8.06 4.05 0.00 3.08 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 0.00 117 N 8.62 4.26 0.00 2.85 2.82 0.00 0.00 7.06 7.30 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 0.00 118 I 7.83 3.60 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.98 0.76 0.00 0.00 119 I 7.41 3.48 1.86 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 1.11 0.39 0.81 0.00 0.00 120 A 8.49 4.05 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 0.00 121 C 8.20 4.53 0.00 2.97 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 0.00 122 D 7.87 4.59 0.00 2.82 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 0.00 123 V 7.25 4.18 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 1.13 0.00 0.00 0.87 0.00 0.00 124 Q 8.48 3.99 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 125 P 0.00 4.40 0.00 2.08 2.11 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 126 V 7.41 4.53 2.22 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 0.84 0.00 0.00 1.01 0.00 0.00 127 T 7.46 4.77 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 1.40 0.00 0.00 128 N 7.87 4.76 0.00 3.01 3.20 0.00 0.00 5.79 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.30 3.87 0.00 1.73 1.67 0.88 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 130 K 7.99 3.89 0.00 1.83 1.77 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 131 I 7.99 3.79 1.92 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 1.71 0.91 0.95 0.00 0.00 132 Q 8.18 3.81 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 133 K 8.08 3.87 0.00 1.91 1.79 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.56 7.81 134 K 7.68 3.83 0.00 1.83 1.71 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.57 7.81 135 V 7.76 3.15 1.64 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 0.67 0.00 0.00 -0.99 0.00 0.00 136 K 8.12 4.02 0.00 1.82 1.71 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.45 7.81 137 A 7.99 4.11 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 0.00 138 L 7.25 4.19 0.00 1.66 1.67 0.85 1.35 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 0.00 139 D 8.18 4.36 0.00 2.73 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 0.00 140 G 7.84 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 0.00 0.00 0.00 141 D 8.28 4.73 0.00 2.73 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.35 0.00 2.44 2.32 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 143 T 8.03 3.91 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 1.24 0.00 0.00 144 V 8.03 3.60 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 1.12 0.00 0.00 1.08 0.00 0.00 145 W 8.30 4.20 0.00 3.59 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 0.00 146 S 8.54 4.32 0.00 4.16 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 0.00 147 R 8.36 3.89 0.00 2.12 1.95 0.00 3.18 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 148 D 8.13 4.35 0.00 2.78 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 0.00 149 L 7.92 3.91 0.00 1.64 1.59 0.12 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.53 4.10 1.39 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 0.00 0.00 151 T 8.29 3.95 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 152 Q 8.24 4.06 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 153 G 8.18 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 F 8.58 3.60 0.00 2.64 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.06 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 7.74 4.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 7.63 3.38 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 0.89 0.00 0.00 0.58 0.00 0.00 158 E 8.36 3.96 0.00 2.33 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 2.52 2.52 0.00 159 K 7.73 3.97 0.00 1.93 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.65 7.81 160 L 7.67 4.21 0.00 1.74 1.63 0.81 0.55 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 0.00 161 L 8.31 4.10 0.00 1.84 1.75 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.30 3.94 0.00 2.16 2.07 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 2.39 2.66 0.00 163 L 7.66 4.27 0.00 1.83 1.69 0.96 0.78 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 0.00 164 S 7.76 4.51 0.00 3.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.77 4.96 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 0.00 166 G 8.15 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 0.00 0.00 0.00 167 R 8.10 3.67 0.00 1.70 1.42 0.00 3.07 0.00 0.00 3.04 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.29 0.00 168 F 7.60 5.15 0.00 3.18 3.28 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 0.00 169 C 9.48 3.90 0.00 3.06 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 0.00 170 V 7.40 4.52 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 0.83 0.00 0.00 1.01 0.00 0.00 171 G 8.98 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 0.00 172 D 8.85 5.12 0.00 2.70 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 0.00 173 E 7.89 4.88 0.00 1.94 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 2.23 2.33 0.00 174 I 7.77 3.52 1.52 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 -0.36 0.66 0.00 0.00 175 T 9.20 4.81 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 1.24 0.00 0.00 176 L 8.52 3.96 0.00 1.67 1.71 0.88 0.71 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 0.00 177 A 7.71 3.93 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 0.00 178 D 7.98 4.29 0.00 2.60 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 0.00 179 V 7.35 3.51 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 0.78 0.00 0.00 0.88 0.00 0.00 180 C 8.33 4.24 0.00 2.92 2.88 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 0.00 181 L 7.91 3.90 0.00 1.83 1.81 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 182 V 7.57 3.55 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 0.12 0.00 0.00 0.92 0.00 0.00 183 P 0.00 4.05 0.00 2.24 2.24 0.00 3.64 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 184 A 7.58 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 V 7.98 3.32 1.54 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 -0.21 0.00 0.00 0.79 0.00 0.00 186 W 7.70 4.49 0.00 3.64 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 0.00 187 A 8.17 4.10 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 0.00 188 A 8.31 4.00 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 0.00 189 E 8.34 3.91 0.00 2.09 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 2.27 2.43 0.00 190 R 7.56 3.98 0.00 1.85 2.17 0.00 3.00 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 191 V 7.46 4.36 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 0.86 0.00 0.00 0.98 0.00 0.00 192 G 7.81 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 0.00 0.00 0.00 193 M 7.72 3.99 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.50 0.00 194 D 8.53 4.51 0.00 2.76 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.37 4.06 0.00 1.64 1.63 0.81 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 196 A 7.95 4.23 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 0.00 197 R 7.37 3.90 0.00 1.88 1.85 0.00 3.21 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 198 F 7.66 5.04 0.00 3.13 3.19 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 0.00 199 P 0.00 4.30 0.00 2.29 2.32 0.00 3.93 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 200 I 8.41 3.73 2.14 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 1.56 0.82 0.95 0.00 0.00 201 T 8.56 3.97 4.63 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 1.42 0.00 0.00 202 K 8.53 4.07 0.00 2.15 2.06 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.59 7.81 203 R 8.49 3.92 0.00 1.92 2.21 0.00 3.12 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 204 V 8.27 3.62 2.19 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 1.23 0.00 0.00 0.95 0.00 0.00 205 F 8.63 4.25 0.00 3.21 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 0.00 206 E 8.39 3.88 0.00 2.19 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 0.00 2.45 2.68 0.00 207 E 8.40 4.12 0.00 2.21 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 2.35 2.32 0.00 208 M 8.47 4.20 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.07 0.00 209 L 7.62 4.06 0.00 1.65 1.67 0.78 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 210 K 7.65 4.26 0.00 1.95 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.66 7.81 211 E 7.87 4.26 0.00 2.14 1.88 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 2.39 2.36 0.00 212 E 9.12 3.89 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 213 A 7.89 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 0.00 214 V 7.75 3.80 2.37 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 1.19 0.00 0.00 0.95 0.00 0.00 215 Q 8.60 4.15 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.57 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 216 K 8.48 4.02 0.00 1.81 1.73 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.33 7.81 217 A 7.34 4.80 1.49 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 0.00 218 H 7.57 4.22 0.00 3.43 3.00 0.00 5.60 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 0.00 219 W 7.46 4.42 0.00 3.64 2.96 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 0.00 220 Q 7.05 3.73 0.00 1.33 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 221 K 7.69 4.55 0.00 1.73 1.66 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.17 1.08 7.81 222 Q 7.98 4.56 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.58 0.00 223 E 8.72 3.97 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.87 0.00 224 D 7.83 4.75 0.00 2.82 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 0.00 225 T 7.31 2.59 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 0.91 0.00 0.00 226 P 0.00 4.21 0.00 2.10 1.92 0.00 2.87 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 2.10 1.96 0.00 227 E 8.91 3.91 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.89 0.00 228 D 7.97 4.52 0.00 2.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 L 7.56 4.46 0.00 1.79 1.87 1.21 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 230 R 7.63 4.11 0.00 1.88 1.73 0.00 3.04 0.00 0.00 2.96 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 231 A 7.89 4.01 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 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.