NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2746 8.1476 120.3095 55.1827 33.3121 174.9126 2 D 4.5124 8.5090 124.1445 51.9022 40.5406 173.0801 3 Y 4.9227 7.9646 117.0350 56.6198 42.1599 174.4599 4 R 4.2888 9.4299 121.3542 54.6191 31.9132 175.0093 5 Q 4.3507 8.4950 128.6325 55.5780 27.9331 175.3382 6 L 3.8444 6.7005 126.7020 56.7495 42.1306 176.3529 7 H 4.4261 6.8419 111.4532 54.9056 30.5566 173.2355 8 R 4.2314 8.3660 118.3893 55.7808 30.7068 176.9134 9 W 4.6945 8.6285 120.5376 59.0195 29.9656 177.3163 10 D 4.9473 8.1195 118.0990 53.6223 38.4847 174.3950 11 L 5.0063 7.9508 121.4753 51.3485 46.1278 174.8855 12 P 4.5695 0.0000 0.0000 62.0593 32.6682 175.7180 13 P 4.2043 0.0000 0.0000 66.0077 31.2065 178.3718 14 E 3.9269 8.1374 117.5223 59.2745 29.6041 178.4052 15 E 4.1144 8.3831 118.2557 58.7843 29.6589 178.9887 16 A 3.7308 7.6797 120.7339 54.9114 18.3073 179.5609 17 I 3.8506 7.4999 117.9471 64.2623 37.0577 178.8559 18 K 3.9759 7.5672 118.2550 59.3690 31.8658 179.5419 19 V 3.5917 7.7871 118.5671 65.9205 31.2817 178.2538 20 Q 3.9481 7.9606 117.7122 59.0420 28.4658 178.2772 21 N 4.3598 8.0041 115.6762 55.5266 38.7500 176.5925 22 E 4.2929 7.7784 119.6609 58.5866 30.1314 178.4821 23 L 4.0389 8.0445 119.2057 57.4334 41.1530 179.5580 24 R 3.8941 8.2011 116.2370 59.0047 28.9130 178.8558 25 K 4.0952 7.7140 117.8086 58.4645 32.1719 177.9090 26 K 4.2504 7.8982 117.1258 57.0757 32.5727 177.3685 27 I 3.8832 7.2471 120.4167 61.1013 37.6163 175.5488 28 K 4.4769 8.7701 123.8812 54.9070 34.0028 176.7040 29 L 5.4988 8.5478 128.3676 52.8012 40.1551 176.4680 30 T 4.4636 7.1993 110.9947 59.4732 71.0801 173.7679 31 P 5.1512 0.0000 0.0000 62.4638 31.9077 176.1089 32 Y 4.2298 8.5530 123.0127 55.8533 38.4226 173.9993 33 E 4.3103 8.7676 125.5656 55.6423 30.3144 175.5453 34 G 4.0441 8.3645 109.0835 43.3429 0.0000 172.0730 35 E 4.5367 8.4058 119.9941 53.9863 30.1133 175.0895 36 P 4.6665 0.0000 0.0000 62.8181 32.6894 175.0773 37 E 4.4082 9.3596 119.0125 57.4104 32.2580 174.9289 38 Y 5.3437 7.9661 118.6163 56.4145 40.2547 174.7596 39 V 4.7533 9.0302 125.3549 60.8789 34.1678 174.1730 40 A 5.2314 8.8918 129.5655 50.1903 21.8932 175.4821 41 G 4.3020 8.9612 107.4718 44.2834 0.0000 172.0436 42 V 5.0133 7.9788 121.2406 60.8509 34.9385 174.2212 43 A 5.0959 8.9566 127.5600 50.5752 23.0764 174.6958 44 L 5.3458 8.4803 118.0207 53.0269 45.7708 175.9867 45 S 4.8381 8.6398 115.3325 56.8140 67.0355 173.0235 46 F 5.2659 8.5482 117.7381 53.8230 40.4122 174.2035 47 P 4.0275 0.0000 0.0000 64.8194 31.7673 176.7718 48 G 4.2479 7.7311 105.5156 43.7523 0.0000 173.6405 49 K 3.9109 8.7895 120.7622 58.9858 32.2424 176.9758 50 E 5.0867 8.1426 116.7553 54.7687 31.4624 175.0935 51 E 4.9067 8.7884 121.2482 54.7636 32.8071 174.9658 52 G 3.7931 8.8625 114.4195 44.4713 0.0000 171.7852 53 L 4.7979 8.3067 121.1129 53.5163 45.1595 174.4558 54 A 5.1271 8.9463 129.5069 50.5384 21.2129 175.7235 55 V 4.8849 8.8619 121.8481 61.0546 35.2261 174.3169 56 I 5.1198 8.5700 127.3190 59.4789 40.7072 174.5024 57 V 4.6199 8.7193 126.2540 60.9250 34.7175 174.0708 58 V 4.7130 8.6206 127.6728 61.1762 33.6513 174.3086 59 L 5.2360 9.3035 128.3519 52.9236 45.3199 174.9202 60 E 4.9731 9.1334 123.2350 55.4958 31.1436 174.2190 61 Y 4.6086 8.8905 128.3932 55.0169 40.9754 173.4242 62 P 2.9700 0.0000 0.0000 62.0956 31.6753 177.0053 63 S 4.0694 7.5542 114.5415 59.7304 63.1675 174.8751 64 F 3.9362 8.2370 117.8746 58.0571 36.9121 175.0381 65 K 4.3514 7.5123 119.4623 56.2438 33.3115 176.4894 66 I 4.2795 8.3450 124.7399 61.3788 36.8841 175.6267 67 L 4.4048 8.6489 128.0562 56.2320 42.8869 176.8223 68 E 4.6722 7.5666 116.2931 55.3097 32.9030 174.5135 69 V 4.7456 8.1148 124.3068 61.5245 34.7983 174.3514 70 V 4.7233 8.4807 119.5478 60.2022 36.5123 174.0027 71 S 4.9952 8.3276 115.3946 57.9745 66.2562 173.1447 72 E 4.6194 8.9459 120.3214 55.3194 33.1100 173.6667 73 R 4.9508 8.4793 126.1038 54.8913 32.2432 175.6152 74 G 4.1025 8.4308 108.4816 45.0186 0.0000 172.0786 75 E 4.6823 8.8804 122.0704 56.3340 30.1608 175.9897 76 I 4.5999 8.8313 127.8943 60.1816 39.2591 176.0419 77 T 4.2655 8.7275 117.4773 62.3772 70.3208 175.2139 78 F 4.0314 8.2558 124.8080 56.9354 39.8665 172.9162 79 P 4.4196 0.0000 0.0000 62.3746 31.9162 175.2726 80 Y 4.3038 8.4231 121.5745 57.5969 39.2439 175.1145 81 I 4.2115 7.5566 126.9745 58.4130 40.6987 172.9336 82 P 4.0976 0.0000 0.0000 64.3693 31.4915 176.3433 83 G 4.0561 9.2109 111.3957 45.1213 0.0000 173.7130 84 L 4.9205 7.9673 120.0205 54.1214 42.7308 178.4229 85 L 4.0417 8.3363 123.2620 58.1640 42.3883 178.8617 86 A 3.7063 8.0731 121.1127 55.0073 18.3658 178.6453 87 F 3.9809 8.0925 112.0630 58.5616 39.2724 176.5804 88 R 4.5105 7.7433 119.4865 58.0694 31.4604 176.8483 89 E 4.5113 8.1124 116.6470 56.6567 30.3662 178.4037 90 G 2.9454 7.4635 106.7837 47.0967 0.0000 173.6174 91 P 3.6445 0.0000 0.0000 64.9135 31.3129 178.4841 92 L 3.8871 7.5488 118.3064 57.8554 42.0448 178.4655 93 F 4.1843 7.9585 120.3650 61.4320 39.3513 177.1369 94 L 3.1790 7.5140 118.3739 57.2409 40.9900 179.4813 95 K 3.9555 7.4332 118.3397 59.3083 32.3528 178.4935 96 A 4.0929 7.7819 121.1873 54.6595 18.3436 179.1500 97 W 3.9669 8.3081 127.2441 60.8504 30.3916 177.8357 98 E 4.3531 8.1281 118.6335 58.7970 28.9502 179.1797 99 K 4.0855 7.9065 117.4063 57.3006 32.5915 177.5629 100 L 3.9080 6.9104 121.3036 55.2534 42.4461 176.3314 101 R 4.1383 9.5256 126.4625 58.0708 30.9875 176.9674 102 T 3.8001 8.0187 114.3829 62.7583 68.9169 174.3962 103 K 4.2086 8.2133 127.5712 54.1688 31.6382 174.4331 104 P 4.7283 0.0000 0.0000 62.9820 31.9109 176.5195 105 D 4.9769 9.1735 121.0220 56.4062 41.8301 177.3233 106 V 4.8250 7.5821 116.2935 60.4402 34.9259 173.1077 107 V 4.7408 8.8607 122.8167 61.1573 34.5399 174.0604 108 V 4.8795 8.8169 127.8537 61.3175 33.5375 174.5014 109 F 4.8391 9.2053 126.0160 55.5521 42.7311 174.0444 110 D 4.9137 7.9270 120.2875 54.3469 41.7589 175.5599 111 G 3.7273 8.3543 108.7601 43.7849 0.0000 172.7671 112 Q 4.2400 8.6346 118.0335 57.1329 30.5877 177.7884 113 G 3.8460 9.3368 107.0456 46.7907 0.0000 175.1174 114 L 4.1452 5.7505 126.7036 57.4831 43.9569 177.3009 115 A 4.8496 7.7599 122.0910 51.6208 16.4523 175.5331 116 H 4.9283 7.6549 121.0405 52.7376 33.8881 172.0694 117 P 2.9700 0.0000 0.0000 64.8341 30.3139 177.6535 118 R 4.4678 7.6996 115.0334 55.3938 30.5291 175.9913 119 K 3.9289 7.8723 114.4433 55.8212 30.4023 176.6723 120 L 4.4689 7.0054 113.9304 54.3207 43.4432 174.3938 121 G 3.8086 9.0125 113.3869 43.9992 0.0000 172.3522 122 I 3.3552 8.4674 118.5969 64.2665 37.6759 177.2611 123 A 3.4066 7.6198 120.6203 55.0768 17.6601 179.9184 124 S 3.9036 7.7809 113.0035 61.8405 62.9598 175.9830 125 H 4.1260 8.1669 120.9656 59.8316 29.5371 177.2450 126 M 3.9227 8.2167 120.6704 58.0058 31.4671 178.9976 127 G 3.6473 7.6609 105.6692 47.8363 0.0000 175.7729 128 L 3.8953 7.6799 120.2040 57.4091 41.7959 179.4420 129 F 4.4540 8.4972 119.5371 59.8103 38.8037 177.2636 130 I 3.9378 8.0540 109.9038 60.3854 38.6746 175.0994 131 E 4.0028 8.4396 120.0089 57.2210 27.4536 174.5515 132 I 4.7992 7.3779 115.7595 58.7404 41.9994 173.8316 133 P 4.7717 0.0000 0.0000 63.9182 32.2459 175.3252 134 T 5.3906 9.1316 113.6277 60.0619 72.6749 172.8766 135 I 4.9021 8.8117 122.8577 59.6104 41.8131 174.4066 136 G 4.4044 9.2303 113.9530 43.8468 0.0000 172.4557 137 V 4.9471 8.9597 126.6547 61.3038 33.5489 174.1590 138 A 5.0812 9.2313 130.4852 50.3246 21.4914 177.2285 139 K 4.4140 8.7853 118.4590 57.0353 32.8312 176.8147 140 S 4.2940 7.2630 111.9270 56.6184 65.6612 173.4430 141 R 3.4491 7.4371 121.5772 55.5324 30.5850 175.3576 142 L 4.4996 8.3904 125.8962 56.2976 43.7180 175.5193 143 Y 4.7576 7.6822 115.9678 56.8435 41.8313 174.6782 144 G 3.9143 7.9497 109.7689 45.6148 0.0000 172.6411 145 T 4.8820 8.4912 109.2758 59.9442 71.2972 173.1720 146 F 5.1217 8.1604 115.7986 56.2315 40.1835 173.1522 147 K 4.1973 8.6055 120.8756 54.7014 33.6366 175.7233 148 M 4.1540 8.5299 123.9310 55.1022 32.3107 174.1320 149 P 4.4337 0.0000 0.0000 62.2023 32.1724 175.6338 150 E 4.2110 8.2761 117.7535 56.1572 30.6192 175.7984 151 D 4.6915 8.2010 117.5970 53.9696 41.5386 175.6050 152 K 4.4325 7.5927 125.8093 56.4890 33.0994 175.6998 153 R 4.5413 8.5798 113.8174 56.9287 31.8363 177.0473 154 C 4.9061 7.8889 111.0854 59.5314 31.3613 174.0964 155 S 4.3467 8.2143 115.2403 58.7832 63.0137 172.9477 156 W 5.6667 7.9175 121.8547 56.0073 31.1130 172.9152 157 S 4.5015 9.1117 114.1215 57.2360 66.3682 172.7483 158 Y 5.0848 8.7160 117.9321 57.5841 39.1899 174.7213 159 L 4.9795 8.9645 125.1083 54.0424 44.1087 174.9398 160 Y 5.2847 9.6226 123.3804 56.4272 41.9940 174.1462 161 D 4.3697 9.2796 122.0532 54.1109 41.5529 178.6932 162 G 3.8872 8.9881 116.5037 45.9195 0.0000 171.6031 163 E 4.4060 9.3503 122.0429 56.8717 31.9684 174.8764 164 E 4.1138 8.0005 120.4854 55.7755 30.2226 175.4265 165 I 4.1629 8.2014 127.3279 60.5632 37.3961 175.5941 166 I 4.3298 8.5915 118.6461 59.7352 38.8000 176.1947 167 G 3.9753 6.9161 107.7065 46.5433 0.0000 170.7263 168 C 5.2839 8.3400 113.4198 56.8701 33.9720 173.0970 169 V 4.3752 8.9616 120.2243 61.1175 33.3991 174.2781 170 I 4.7352 8.2824 128.5576 59.4402 39.9581 175.6059 171 R 4.7748 8.7247 129.3031 54.9525 28.1267 176.8259 172 T 3.7149 8.0195 113.4545 63.3725 69.6289 175.0248 173 K 4.7806 7.5553 122.4962 54.4581 35.4630 174.7626 174 E 4.2564 8.6690 125.7121 57.6303 29.9202 177.3852 175 G 3.9972 9.1915 112.5862 45.1304 0.0000 173.2572 176 S 4.7961 7.1999 114.6182 56.1037 65.6063 173.9667 177 A 4.2360 8.2858 125.3781 51.4201 18.7941 175.7526 178 P 4.7696 0.0000 0.0000 62.6546 32.7950 175.3042 179 I 4.6821 8.3393 113.5824 59.4137 40.8956 174.5237 180 F 4.8937 9.5991 122.5685 55.9311 41.1734 174.7842 181 V 4.9464 8.8919 125.5108 61.0968 33.5031 174.6599 182 S 5.1043 8.9827 122.1524 55.6725 66.7747 171.9038 183 P 4.4710 0.0000 0.0000 64.4878 32.6024 176.3933 184 G 3.8847 9.3821 110.0545 44.8366 0.0000 175.1235 185 H 5.0501 6.1691 120.9835 54.3691 33.9043 173.0670 186 L 3.7177 8.0967 121.5322 54.2576 39.7257 173.9138 187 M 5.0097 7.5900 114.1606 54.4655 35.4576 172.1353 188 D 5.1761 8.1456 121.5616 50.4160 44.2713 176.5377 189 V 3.5087 8.2742 118.5321 66.3200 31.4457 177.4511 190 E 3.8522 8.0964 118.1205 59.5276 29.4702 178.8390 191 S 4.1249 9.0180 115.7085 61.4329 62.8030 176.7434 192 S 3.9905 8.2668 117.3098 61.2118 62.5394 176.5179 193 K 3.6537 7.7773 123.1119 58.9838 31.9477 178.5118 194 R 3.6991 7.5371 118.5405 59.4704 29.9914 178.3908 195 L 3.2026 7.7877 118.7177 57.6581 41.0350 179.6901 196 I 3.6213 7.6637 119.9858 64.1782 36.7491 178.6273 197 K 3.9114 7.9419 118.6483 59.3988 31.9568 178.9199 198 A 4.2745 7.5835 119.4981 54.1068 18.5941 178.6108 199 F 5.5590 7.9539 115.1087 57.2277 39.2245 175.1373 200 T 4.6837 7.2032 115.6406 61.5359 69.7424 174.4331 201 L 4.2907 8.0390 126.5404 53.1388 42.7012 174.8208 202 P 4.4785 0.0000 0.0000 64.2994 31.6080 177.1502 203 G 3.9953 9.1413 111.4185 44.9937 0.0000 173.3028 204 R 4.6437 7.4484 117.8531 54.5262 32.3482 175.7854 205 R 4.7256 8.4003 119.1722 56.2514 31.5018 176.4373 206 I 4.4752 7.3831 117.5324 58.5255 39.1725 174.1403 207 P 4.5496 0.0000 0.0000 62.7788 32.9362 177.0721 208 E 3.8966 8.9321 121.4233 59.5625 29.5717 177.9349 209 P 4.2046 0.0000 0.0000 66.1975 31.3677 178.6721 210 T 4.0274 7.7769 107.4865 64.1449 69.0633 176.7248 211 R 3.8791 8.0621 122.0286 59.4959 30.1857 178.4573 212 L 4.1050 8.3256 118.9706 57.5905 41.5278 179.3254 213 A 4.0024 7.9241 120.3046 55.5885 18.4261 179.0675 214 H 4.1094 8.5278 116.9062 59.4744 29.7562 177.4707 215 I 3.5505 7.6838 121.0171 64.7089 36.9278 178.0831 216 Y 3.8957 8.1578 117.5028 61.1675 37.3915 178.5192 217 T 3.8573 7.9526 113.6352 65.1209 67.5667 175.9865 218 Q 4.1165 7.8930 119.9368 58.7396 28.8324 178.4854 219 R 3.8932 8.1432 119.3759 59.4841 29.9688 179.2506 220 L 4.0402 7.9017 117.0180 57.3438 41.6672 178.9463 221 K 4.1909 7.5464 118.0429 58.6466 32.1033 176.4424 222 K 4.3776 8.2584 115.3051 56.6994 35.1877 176.3973 223 G 3.7513 7.8010 114.5590 45.6423 0.0000 173.3906 *224 L 4.1219 8.5164 125.0212 54.3311 41.6291 173.1069 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 8.15 4.27 0.00 0.89 1.43 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.23 0.00 2 D 8.51 4.51 0.00 2.93 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 7.96 4.92 0.00 3.07 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.43 4.29 0.00 1.82 1.67 0.00 2.97 0.00 0.00 3.01 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.45 0.00 5 Q 8.50 4.35 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 6 L 6.70 3.84 0.00 1.19 1.47 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 7 H 6.84 4.43 0.00 3.06 3.16 0.00 5.72 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.37 4.23 0.00 1.87 1.96 0.00 3.21 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 9 W 8.63 4.69 0.00 3.36 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 10 D 8.12 4.95 0.00 2.78 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 11 L 7.95 5.01 0.00 1.76 1.55 1.07 1.28 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 12 P 0.00 4.57 0.00 2.22 2.19 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 13 P 0.00 4.20 0.00 2.15 2.15 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 14 E 8.14 3.93 0.00 2.00 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 2.35 2.37 0.00 15 E 8.38 4.11 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 16 A 7.68 3.73 0.11 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 17 I 7.50 3.85 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.65 0.87 0.00 0.00 18 K 7.57 3.98 0.00 1.99 1.82 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.57 7.81 19 V 7.79 3.59 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 0.76 0.00 0.00 0.92 0.00 0.00 20 Q 7.96 3.95 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.56 2.84 0.00 21 N 8.00 4.36 0.00 2.82 2.87 0.00 0.00 7.07 7.78 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 22 E 7.78 4.29 0.00 2.06 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 2.40 2.45 0.00 23 L 8.04 4.04 0.00 1.79 1.64 0.83 0.68 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 24 R 8.20 3.89 0.00 2.01 2.17 0.00 2.92 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 25 K 7.71 4.10 0.00 1.83 1.90 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.55 7.81 26 K 7.90 4.25 0.00 1.83 1.82 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.37 7.81 27 I 7.25 3.88 2.02 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 1.28 0.74 0.96 0.00 0.00 28 K 8.77 4.48 0.00 1.71 1.69 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.64 7.81 29 L 8.55 5.50 0.00 1.63 1.64 0.93 1.06 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 30 T 7.20 4.46 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 1.20 0.00 0.00 31 P 0.00 5.15 0.00 2.05 2.03 0.00 3.67 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 32 Y 8.55 4.23 0.00 2.90 2.84 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 33 E 8.77 4.31 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 34 G 8.36 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 35 E 8.41 4.54 0.00 2.05 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 2.30 0.00 36 P 0.00 4.67 0.00 2.17 2.06 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 37 E 9.36 4.41 0.00 1.80 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 1.71 2.04 0.00 38 Y 7.97 5.34 0.00 2.96 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 39 V 9.03 4.75 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.55 0.00 0.00 40 A 8.89 5.23 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.96 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 42 V 7.98 5.01 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 0.95 0.00 0.00 0.23 0.00 0.00 43 A 8.96 5.10 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 44 L 8.48 5.35 0.00 1.46 1.28 0.94 0.67 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 45 S 8.64 4.84 0.00 3.88 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 46 F 8.55 5.27 0.00 2.99 3.21 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 47 P 0.00 4.03 0.00 2.18 2.13 0.00 3.83 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 2.01 2.08 0.00 48 G 7.73 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 0.00 0.00 0.00 0.00 49 K 8.79 3.91 0.00 1.73 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 50 E 8.14 5.09 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.13 0.00 51 E 8.79 4.91 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 2.19 2.24 0.00 52 G 8.86 3.79 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 0.00 0.00 0.00 53 L 8.31 4.80 0.00 1.59 1.39 0.91 1.15 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 54 A 8.95 5.13 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 55 V 8.86 4.88 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 0.94 0.00 0.00 0.98 0.00 0.00 56 I 8.57 5.12 1.89 0.00 0.00 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 1.42 1.05 1.04 0.00 0.00 57 V 8.72 4.62 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 0.90 0.00 0.00 0.68 0.00 0.00 58 V 8.62 4.71 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.81 0.00 0.00 59 L 9.30 5.24 0.00 1.54 1.57 1.07 -0.36 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 60 E 9.13 4.97 0.00 2.11 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 0.00 2.22 2.27 0.00 61 Y 8.89 4.61 0.00 2.72 2.85 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 62 P 0.00 2.97 0.00 1.60 0.71 0.00 3.58 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 63 S 7.55 4.07 0.00 3.99 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 64 F 8.24 3.94 0.00 3.24 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 65 K 7.51 4.35 0.00 1.79 1.75 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.46 7.81 66 I 8.34 4.28 1.90 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.53 0.84 0.00 0.00 67 L 8.65 4.40 0.00 1.42 1.62 1.05 1.16 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 68 E 7.57 4.67 0.00 1.85 1.56 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 2.08 2.12 0.00 69 V 8.11 4.75 1.85 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 0.47 0.00 0.00 0.39 0.00 0.00 70 V 8.48 4.72 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.91 0.00 0.00 71 S 8.33 5.00 0.00 3.89 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 72 E 8.95 4.62 0.00 2.06 1.75 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 2.18 2.30 0.00 73 R 8.48 4.95 0.00 1.71 1.80 0.00 3.29 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 74 G 8.43 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.88 4.68 0.00 2.02 1.91 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 2.34 2.39 0.00 76 I 8.83 4.60 2.11 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 1.50 1.23 1.22 0.00 0.00 77 T 8.73 4.27 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 1.28 0.00 0.00 78 F 8.26 4.03 0.00 3.15 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.42 0.00 2.10 1.90 0.00 2.33 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 80 Y 8.42 4.30 0.00 2.90 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 81 I 7.56 4.21 1.85 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 1.32 0.78 0.82 0.00 0.00 82 P 0.00 4.10 0.00 1.97 2.01 0.00 3.48 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 83 G 9.21 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.97 4.92 0.00 1.86 1.68 0.98 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.34 4.04 0.00 1.85 1.73 1.27 1.01 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 86 A 8.07 3.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 8.09 3.98 0.00 2.08 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 0.00 0.00 0.00 88 R 7.74 4.51 0.00 2.10 2.25 0.00 3.51 0.00 0.00 3.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.09 0.00 89 E 8.11 4.51 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 90 G 7.46 2.95 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 0.00 0.00 0.00 91 P 0.00 3.64 0.00 1.84 1.77 0.00 2.94 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.44 0.00 92 L 7.55 3.89 0.00 1.66 1.56 0.90 0.80 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 93 F 7.96 4.18 0.00 3.19 3.21 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 94 L 7.51 3.18 0.00 1.56 0.96 0.76 -0.31 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 95 K 7.43 3.96 0.00 1.91 1.86 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.50 7.81 96 A 7.78 4.09 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 97 W 8.31 3.97 0.00 2.61 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 98 E 8.13 4.35 0.00 2.24 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 2.55 2.77 0.00 99 K 7.91 4.09 0.00 1.81 1.79 0.00 1.79 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.40 7.81 100 L 6.91 3.91 0.00 1.17 0.92 0.76 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 101 R 9.53 4.14 0.00 1.67 1.82 0.00 3.23 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 102 T 8.02 3.80 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 0.57 0.00 0.00 103 K 8.21 4.21 0.00 1.71 1.81 0.00 1.86 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.58 7.81 104 P 0.00 4.73 0.00 2.33 2.09 0.00 3.92 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.10 0.00 105 D 9.17 4.98 0.00 2.73 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 0.00 106 V 7.58 4.82 1.90 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 0.60 0.00 0.00 0.97 0.00 0.00 107 V 8.86 4.74 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 0.45 0.00 0.00 1.19 0.00 0.00 108 V 8.82 4.88 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 0.99 0.00 0.00 0.99 0.00 0.00 109 F 9.21 4.84 0.00 2.92 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 0.00 110 D 7.93 4.91 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 8.35 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 8.63 4.24 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 113 G 9.34 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 0.00 114 L 5.75 4.15 0.00 2.01 1.86 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.76 4.85 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.65 4.93 0.00 3.17 3.07 0.00 5.70 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 2.97 0.00 1.75 1.82 0.00 2.72 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.90 0.00 118 R 7.70 4.47 0.00 1.89 1.96 0.00 3.35 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 119 K 7.87 3.93 0.00 1.87 1.88 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.12 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.48 7.81 120 L 7.01 4.47 0.00 1.46 1.40 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 121 G 9.01 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 0.00 122 I 8.47 3.36 1.76 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.60 0.85 0.00 0.00 123 A 7.62 3.41 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 0.00 124 S 7.78 3.90 0.00 3.92 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 0.00 125 H 8.17 4.13 0.00 3.10 3.22 0.00 5.61 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 0.00 126 M 8.22 3.92 0.00 1.48 0.95 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 2.18 0.00 127 G 7.66 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.68 3.90 0.00 1.96 1.73 0.94 0.54 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 0.00 129 F 8.50 4.45 0.00 3.10 3.13 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 0.00 130 I 8.05 3.94 1.61 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.53 -0.25 0.00 0.00 131 E 8.44 4.00 0.00 2.19 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 2.31 2.38 0.00 132 I 7.38 4.80 2.04 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.91 1.18 0.00 0.00 133 P 0.00 4.77 0.00 2.40 2.38 0.00 3.89 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 134 T 9.13 5.39 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 135 I 8.81 4.90 1.93 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 1.15 0.80 0.99 0.00 0.00 136 G 9.23 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 0.00 137 V 8.96 4.95 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 0.99 0.00 0.00 0.97 0.00 0.00 138 A 9.23 5.08 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 0.00 139 K 8.79 4.41 0.00 1.78 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.45 7.81 140 S 7.26 4.29 0.00 3.79 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 R 7.44 3.45 0.00 0.91 1.62 0.00 3.70 0.00 0.00 3.56 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 142 L 8.39 4.50 0.00 1.61 1.67 0.95 0.84 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 0.00 143 Y 7.68 4.76 0.00 2.83 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 0.00 144 G 7.95 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 0.00 145 T 8.49 4.88 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 1.21 0.00 0.00 146 F 8.16 5.12 0.00 3.29 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.61 4.20 0.00 1.84 1.81 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.49 0.00 0.00 0.00 0.00 1.41 1.37 7.81 148 M 8.53 4.15 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 149 P 0.00 4.43 0.00 2.22 2.07 0.00 3.98 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 150 E 8.28 4.21 0.00 2.08 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 0.00 2.22 2.27 0.00 151 D 8.20 4.69 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.59 4.43 0.00 1.74 1.63 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 153 R 8.58 4.54 0.00 1.79 1.91 0.00 3.52 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 154 C 7.89 4.91 0.00 2.89 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 0.00 155 S 8.21 4.35 0.00 3.89 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 0.00 156 W 7.92 5.67 0.00 3.44 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 0.00 157 S 9.11 4.50 0.00 3.99 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 0.00 158 Y 8.72 5.08 0.00 2.91 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 0.00 159 L 8.96 4.98 0.00 1.82 1.59 1.06 1.14 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 0.00 160 Y 9.62 5.28 0.00 2.94 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 0.00 161 D 9.28 4.37 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 G 8.99 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 0.00 0.00 0.00 163 E 9.35 4.41 0.00 1.94 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 2.24 2.38 0.00 164 E 8.00 4.11 0.00 2.04 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 2.33 2.29 0.00 165 I 8.20 4.16 1.55 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.41 0.34 0.00 0.00 166 I 8.59 4.33 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.71 1.00 0.00 0.00 167 G 6.92 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 0.00 168 C 8.34 5.28 0.00 3.01 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 0.00 169 V 8.96 4.38 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.31 0.00 0.00 170 I 8.28 4.74 1.80 0.00 0.00 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 1.03 0.46 0.92 0.00 0.00 171 R 8.72 4.77 0.00 2.02 1.84 0.00 3.21 0.00 0.00 3.22 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 172 T 8.02 3.71 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 1.20 0.00 0.00 173 K 7.56 4.78 0.00 1.78 1.62 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.41 7.81 174 E 8.67 4.26 0.00 2.00 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 2.61 2.30 0.00 175 G 9.19 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 0.00 176 S 7.20 4.80 0.00 3.94 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 0.00 177 A 8.29 4.24 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 0.00 178 P 0.00 4.77 0.00 1.81 2.01 0.00 3.83 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 1.82 1.95 0.00 179 I 8.34 4.68 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.74 0.99 0.00 0.00 180 F 9.60 4.89 0.00 2.94 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 0.00 181 V 8.89 4.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.89 0.00 0.00 182 S 8.98 5.10 0.00 4.03 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 0.00 183 P 0.00 4.47 0.00 2.24 2.30 0.00 3.86 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 184 G 9.38 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 H 6.17 5.05 0.00 3.19 3.16 0.00 5.94 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 8.10 3.72 0.00 1.83 1.74 0.93 0.62 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 0.00 187 M 7.59 5.01 0.00 2.16 1.89 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 188 D 8.15 5.18 0.00 2.91 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 0.00 189 V 8.27 3.51 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 1.05 0.00 0.00 0.93 0.00 0.00 190 E 8.10 3.85 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 2.38 2.44 0.00 191 S 9.02 4.12 0.00 3.94 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 0.00 192 S 8.27 3.99 0.00 3.98 4.09 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 0.00 0.00 0.00 0.00 193 K 7.78 3.65 0.00 1.58 1.71 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.42 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.95 0.93 7.81 194 R 7.54 3.70 0.00 1.84 1.95 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 195 L 7.79 3.20 0.00 1.28 0.75 0.47 0.39 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 0.00 196 I 7.66 3.62 1.79 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 1.70 1.28 0.90 0.00 0.00 197 K 7.94 3.91 0.00 1.84 1.81 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.40 1.38 7.81 198 A 7.58 4.27 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 0.00 199 F 7.95 5.56 0.00 3.13 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 0.00 200 T 7.20 4.68 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 201 L 8.04 4.29 0.00 1.58 1.48 0.55 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 202 P 0.00 4.48 0.00 2.03 1.99 0.00 3.63 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 2.03 2.09 0.00 203 G 9.14 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 0.00 204 R 7.45 4.64 0.00 1.95 1.81 0.00 3.27 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 205 R 8.40 4.73 0.00 1.76 1.93 0.00 3.06 0.00 0.00 3.90 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 206 I 7.38 4.48 1.88 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 1.48 1.00 0.96 0.00 0.00 207 P 0.00 4.55 0.00 2.41 2.31 0.00 3.76 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 2.12 2.12 0.00 208 E 8.93 3.90 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.74 0.00 209 P 0.00 4.20 0.00 2.06 1.95 0.00 3.64 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.91 0.00 210 T 7.78 4.03 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 211 R 8.06 3.88 0.00 2.07 2.09 0.00 3.09 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 212 L 8.33 4.11 0.00 1.84 1.87 1.00 1.01 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 0.00 213 A 7.92 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 H 8.53 4.11 0.00 3.20 3.56 0.00 5.60 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 0.00 215 I 7.68 3.55 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 1.49 0.79 0.73 0.00 0.00 216 Y 8.16 3.90 0.00 3.20 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 0.00 217 T 7.95 3.86 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 218 Q 7.89 4.12 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 219 R 8.14 3.89 0.00 1.72 1.89 0.00 2.90 0.00 0.00 2.76 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 220 L 7.90 4.04 0.00 1.69 1.75 1.01 0.91 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 0.00 221 K 7.55 4.19 0.00 1.90 2.03 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.49 7.81 222 K 8.26 4.38 0.00 1.82 1.60 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.34 7.81 223 G 7.80 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 *224 L 8.52 4.12 0.00 1.42 1.50 0.92 0.82 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 * Residues marked with a * may have inaccurate shift predictions.