NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1083 8.0249 121.4456 61.2600 38.3416 174.7645 17 V 4.1040 8.0552 118.8518 59.0740 32.9361 174.2721 18 G 3.6491 8.3430 111.8741 47.8534 0.0000 173.8460 19 G 4.6101 7.8362 109.1562 46.1197 0.0000 170.7598 20 Y 5.0704 7.6924 117.5149 55.0566 42.1008 174.1762 21 T 4.4008 8.4838 116.7262 63.3420 68.8117 176.5012 22 C 3.7604 8.6142 125.8992 58.4376 38.1123 175.6448 23 G 3.9981 7.7177 106.0231 45.0358 0.0000 172.7291 24 A 4.2140 8.3918 125.5347 53.4184 18.6468 177.0030 25 N 4.2790 8.7996 120.1811 54.6326 36.0560 175.4518 26 T 4.2349 7.5213 108.7792 62.5127 69.8513 175.1838 27 V 3.9349 7.1382 122.5940 60.2712 30.9960 173.4948 28 P 4.3989 0.0000 0.0000 63.6499 32.3623 177.8703 29 Y 5.0892 6.6742 116.3626 56.2485 38.5029 174.1902 30 Q 4.8346 7.2114 122.9475 55.7937 29.9248 175.2842 31 V 4.8656 9.0251 118.8730 59.7009 36.2056 174.2099 32 S 4.8762 8.7455 117.5453 56.9370 64.5455 172.7708 33 L 4.7438 8.6281 127.3790 53.3225 43.1691 174.8888 34 N 5.6684 8.7809 123.1931 50.3710 41.8816 175.1933 *37 S 4.2718 8.4972 121.7371 58.8950 64.2394 174.5762 38 G 4.1175 9.5387 110.3060 45.9279 0.0000 173.7959 39 Y 4.5785 6.8132 115.1332 55.7901 40.1903 173.0064 40 H 4.3883 8.9278 121.3427 56.7921 29.9616 174.5295 41 F 5.0656 7.9678 121.3794 57.4504 40.1405 174.1710 42 C 4.6118 6.7811 114.8734 56.2151 44.9154 172.5918 43 G 4.2497 8.5122 108.3405 45.2409 0.0000 172.0922 44 G 4.5311 7.8026 105.4843 46.6494 0.0000 172.5597 45 S 5.5626 8.4168 115.6221 56.3773 66.4033 173.7258 46 L 4.7445 9.3652 127.2841 54.8540 42.1332 177.2150 47 I 4.0574 8.4784 120.4972 62.2272 38.7756 174.7627 48 N 4.9373 7.6323 116.3231 51.8703 39.5421 174.4022 49 S 4.3570 8.8316 111.2616 60.6685 63.3662 174.6902 50 Q 4.6323 8.1669 118.1291 55.0309 31.5808 174.7375 51 W 5.3468 8.2413 119.6220 54.6808 32.7270 174.6459 52 V 5.0366 9.1729 123.9604 61.0795 34.3376 174.4534 53 V 4.9588 9.1203 126.7883 60.7597 34.2908 175.1443 54 S 5.0157 9.0687 116.0669 57.9982 66.0296 172.3842 55 A 4.6303 8.5280 120.1844 50.7269 20.4964 178.3544 56 A 3.7682 8.3513 124.0071 55.4300 18.3453 179.3632 57 H 4.5688 7.8045 108.5636 57.2236 28.7751 175.4182 58 C 4.6326 7.7157 116.8912 57.6746 40.4029 173.0186 59 Y 4.0972 7.6831 121.7956 57.8316 38.3948 175.2862 60 K 4.2045 7.4890 125.0317 54.1987 35.1757 175.9081 61 S 4.0931 8.0175 114.4834 58.8075 63.0063 173.5787 62 G 4.0201 8.4429 110.3318 46.4955 0.0000 174.0953 63 I 4.0107 7.0432 120.4609 61.0417 38.4099 175.3482 64 Q 4.7531 9.2135 128.8155 54.2751 31.4691 174.1371 65 V 4.4910 8.7659 126.9739 61.7412 33.6214 174.4633 66 R 5.1743 8.8294 127.1229 54.5986 32.4686 175.3415 67 L 4.8363 9.2767 123.6417 52.7987 45.0093 177.5031 *69 G 3.9572 8.4502 108.7436 45.1306 0.0000 173.0475 70 E 4.2262 8.1796 118.7638 56.2511 29.3923 174.4969 71 D 4.8510 8.1478 118.3604 55.6661 44.3176 174.7467 72 N 4.9332 7.9486 122.9723 53.0355 38.6835 175.7657 73 I 3.9182 8.4741 119.9972 62.0928 37.8506 176.3140 74 N 4.8482 8.6496 117.9875 53.2107 39.4148 174.9171 75 V 4.4222 7.6125 110.7385 59.2145 35.4980 175.7166 76 V 4.0891 8.3671 122.7727 62.8948 30.6750 175.5242 77 E 4.3615 9.8684 127.1065 56.0650 29.8452 177.4681 78 G 3.9271 8.6986 107.7091 45.4580 0.0000 173.8592 79 N 4.8850 7.6722 114.1280 52.6334 39.9334 174.6614 80 E 4.5652 7.8505 117.8179 56.5078 30.8728 176.5034 81 Q 4.4055 8.7951 119.9826 54.4268 32.4794 174.4029 82 F 5.4061 8.8576 123.8156 56.2062 40.3466 175.6057 83 I 4.6871 8.5750 124.6931 59.2794 40.7769 175.7581 84 S 4.7550 8.6889 121.9755 58.3853 64.1857 173.2935 85 A 4.6044 8.1642 124.4796 52.0088 18.5477 177.7456 86 S 4.4769 8.9023 116.0937 59.8085 64.6697 174.7963 87 K 4.7636 7.6050 117.4917 54.6918 36.8332 175.7605 88 S 5.1107 8.7439 117.9641 57.1452 66.3543 173.5872 89 I 4.4821 9.5278 127.8324 59.4737 39.0425 175.3887 90 V 4.2702 8.3614 127.4646 62.1130 32.6496 175.2212 91 H 3.9567 8.8500 126.8964 55.8158 30.0699 174.4139 92 P 4.2600 0.0000 0.0000 65.2781 31.3135 177.1279 93 S 4.7383 7.8753 112.3081 57.9606 63.4084 173.2506 94 Y 4.2795 8.1335 122.8029 57.9457 38.8287 174.8588 95 N 4.4849 8.1790 126.4326 51.3762 39.7895 175.3749 96 S 3.6165 8.0605 121.2888 60.6942 63.6781 175.3966 97 N 4.3921 8.4208 118.6552 55.5999 38.5957 176.3312 98 T 3.9357 7.7360 104.8492 61.1459 69.6534 175.1686 99 L 3.7260 7.8822 120.9859 55.3110 39.9594 173.8954 100 N 4.4998 7.5053 117.3881 54.4902 39.6059 174.4781 101 N 4.5261 8.6489 119.2078 54.4514 35.7916 175.5878 102 D 4.6003 7.9172 116.9370 52.9035 40.2938 174.3460 103 I 4.8434 6.8327 121.2407 59.5505 42.5366 173.4411 104 M 5.4255 9.0309 126.2947 54.4831 36.1951 173.0970 105 L 5.4705 9.3983 125.0924 53.1859 45.0539 175.4329 106 I 5.0060 8.8372 123.0638 59.4552 40.5887 174.2996 107 K 3.6989 8.8953 129.3715 54.7441 33.3670 175.6984 108 L 4.4388 8.2239 128.1647 54.2435 41.9525 177.1241 109 K 4.1219 9.2583 123.8308 59.2311 32.4222 177.4138 110 S 4.5883 7.7288 110.5457 55.8460 66.1353 173.2531 111 A 4.3410 8.3815 122.9161 52.0900 18.7130 177.4483 112 A 4.3282 9.0307 123.4402 51.8720 19.6468 177.2458 113 S 4.6395 8.8244 115.2482 56.6558 64.3833 174.1105 114 L 4.5044 8.5651 126.0707 54.1445 42.7884 175.2953 115 N 4.9435 8.6184 125.3900 52.4062 37.6141 175.9336 116 S 4.4277 8.8415 108.9635 59.5781 63.9027 175.2840 117 R 4.3004 8.2073 118.1242 56.0797 30.6317 176.3896 118 V 4.4235 7.5585 117.4827 61.4261 33.4599 173.2554 119 A 5.0996 8.5792 128.1166 50.8744 22.8511 175.1052 120 S 5.2601 8.7262 114.8245 57.0477 65.8693 172.8742 121 I 4.3587 8.7207 121.5263 59.0741 39.6097 175.5344 122 S 4.3725 8.4085 124.6912 58.4757 63.9530 174.0106 123 L 4.3976 8.3687 123.2933 53.3355 42.4550 175.2500 124 P 4.4728 0.0000 0.0000 63.0742 32.2630 176.4176 125 T 4.0206 8.3378 109.9487 63.5125 69.6990 174.8654 *127 S 4.8616 7.5056 113.6739 57.6997 64.0893 173.6774 128 C 4.5360 8.3671 117.5552 56.5845 40.5868 173.8152 129 A 4.2998 8.2038 126.0511 51.6382 19.2109 177.5438 130 S 4.2637 8.1484 114.9754 57.2440 64.6407 173.1812 *132 A 4.3049 8.2582 123.6401 53.5441 19.1800 177.3501 133 G 3.9198 9.7247 112.0436 45.2250 0.0000 173.7623 134 T 4.0223 7.7155 117.7512 63.6179 69.4994 173.3960 135 Q 4.8759 8.5705 124.9658 54.9344 30.3704 175.5889 136 C 5.2260 9.4391 120.2212 55.0353 46.3827 172.3261 137 L 5.1403 8.5554 122.2272 53.6284 43.8478 174.9505 138 I 5.3695 9.0969 127.5225 58.7253 39.7800 174.8614 139 S 4.9819 8.4753 120.4796 56.4882 66.3171 173.2557 140 G 3.8454 7.7641 107.5002 45.8607 0.0000 173.3235 141 W 4.6368 8.8008 118.5640 56.1855 29.5792 176.9868 142 G 4.1158 8.4121 109.0107 44.2371 0.0000 173.6781 143 N 3.7943 8.9331 118.4448 54.2177 38.9499 174.6296 144 T 4.3278 8.3589 114.1218 61.3872 69.7771 174.4793 145 K 4.5684 7.7227 122.0167 54.7795 34.1881 176.4230 146 S 4.2316 8.7536 120.0146 61.0831 63.0762 174.8818 147 S 4.3380 8.2537 115.7026 58.8913 65.3352 172.5025 148 G 3.9068 8.1438 110.7089 43.8109 0.0000 172.1485 149 T 4.5791 7.8438 115.3533 62.1618 72.1072 174.3748 150 S 4.2939 9.1394 119.0861 58.0144 65.8264 173.3365 151 Y 4.7152 8.6808 126.2841 55.9143 38.7983 174.4021 152 P 4.6790 0.0000 0.0000 62.2835 33.0240 176.1812 153 D 4.5333 8.7662 118.9003 57.3116 41.1798 177.4725 154 V 4.9388 7.4540 109.8061 59.3509 33.5485 175.6805 155 L 3.3824 8.2648 124.1594 54.7880 43.1179 175.8609 156 K 4.8855 8.1400 124.9800 55.0095 34.8694 174.7022 157 C 5.3376 8.6055 119.7350 55.1292 43.3408 173.1267 158 L 4.9611 8.4356 123.2411 53.8354 45.3295 174.7039 159 K 5.0993 9.0983 126.1301 55.6364 33.2507 176.1362 160 A 4.7828 9.0763 126.6238 49.7434 23.0705 173.4055 161 P 4.9422 0.0000 0.0000 61.7574 33.6585 175.2971 162 I 4.2187 8.7404 122.8779 61.5460 38.0223 175.5558 163 L 4.6156 8.9240 127.0496 53.0744 43.4607 176.9729 164 S 4.3190 8.0506 115.6795 58.0675 63.9667 175.0521 165 D 4.3541 8.7301 121.2560 57.7979 40.8439 178.9215 166 S 4.2107 8.0161 115.5602 61.4483 62.8700 176.5593 167 S 4.2106 8.4103 117.2123 61.2548 62.7595 175.7476 168 C 4.3182 8.4488 122.6314 59.5860 40.0285 175.5493 169 K 3.9339 8.3374 119.2794 58.6777 31.4101 179.3307 170 S 4.2309 7.6233 114.8350 60.9724 63.0631 175.8883 171 A 4.1236 8.0422 122.9432 54.0392 19.4278 177.3565 172 Y 4.6292 8.1812 115.3131 55.1744 39.3173 171.3483 173 P 4.3866 0.0000 0.0000 63.3736 31.9778 177.1364 174 G 4.0653 9.4820 111.2837 45.5468 0.0000 173.3964 175 Q 4.4995 7.7639 114.4479 54.8666 30.9640 175.1200 176 I 4.4036 7.9399 119.3519 59.9386 38.3588 175.4861 177 T 4.5404 8.2230 115.8301 59.6755 70.7388 175.5742 178 S 4.2781 8.5124 115.4648 60.6276 63.2378 174.5701 179 N 4.8611 8.1333 118.0660 53.3842 38.5600 173.8955 180 M 5.4738 8.0414 118.0544 53.4990 35.4281 174.7543 181 F 5.1704 8.7246 115.7170 55.5457 42.4228 172.5184 182 C 5.6475 8.9805 115.4619 55.3915 41.5363 173.0382 183 A 5.0237 9.3696 122.9057 51.3881 22.4514 174.7207 184A G 3.7959 7.3915 105.7731 44.3907 0.0000 173.0054 184 Y 4.6725 8.6254 119.1273 55.9233 40.6299 176.2581 185 L 4.0591 8.7873 125.6544 57.6922 42.1160 179.3584 186 E 3.5872 8.2878 118.6988 57.6795 29.8716 176.6821 187 G 3.8095 7.9776 103.9705 45.4382 0.0000 174.0729 188A G 3.9993 9.1597 106.3133 45.2793 0.0000 173.9721 188 K 4.4204 7.5319 116.5874 55.0958 34.3301 174.5818 189 D 4.6639 8.3705 122.9215 53.6784 43.8577 173.9059 190 S 4.8511 8.4465 113.3940 57.0188 65.3149 173.3643 191 C 4.8618 9.3129 120.7113 54.7924 42.3358 172.4630 192 Q 4.2976 8.7312 118.0759 57.9989 28.3309 177.8573 193 G 4.4755 9.2000 111.4211 46.0576 0.0000 174.1330 194 D 4.7062 8.4489 118.6976 55.2298 41.9055 176.8620 195 S 4.4818 8.0759 115.3542 60.2715 63.6517 175.4293 196 G 4.5929 8.5173 111.9538 46.6371 0.0000 174.1638 197 G 4.3622 7.6847 106.6914 45.0536 0.0000 171.4674 198 P 4.9738 0.0000 0.0000 62.6070 33.2295 175.7529 199 V 4.5509 8.7548 122.3026 61.4899 33.3077 173.8707 200 V 4.6530 8.6091 128.8297 61.3997 33.5377 173.7417 201 C 5.0981 8.8898 125.2951 55.4486 43.2238 174.6615 202 S 3.4236 9.6292 121.6683 59.6515 59.8698 173.2329 203 G 3.9164 8.0726 104.4456 45.5477 0.0000 172.7757 204 K 4.6660 7.3944 118.4154 53.2812 34.8077 175.3481 *209 L 4.2494 8.2443 122.8132 55.3903 42.2974 175.8687 210 Q 4.4160 9.0262 126.5224 57.1466 30.7392 175.9131 211 G 5.3650 8.0188 104.2203 45.8741 0.0000 171.3832 212 I 5.2669 8.2364 119.3968 58.8478 41.0227 175.3276 213 V 3.4732 8.8742 127.0354 64.4240 31.7263 174.1278 214 S 4.8987 8.5353 121.2323 58.4150 64.2808 175.1654 215 W 5.0822 7.7139 114.8311 56.4015 32.1348 172.8328 216 G 3.8129 8.4078 105.6641 46.5006 0.0000 173.9284 217 S 4.6285 8.8077 115.6578 56.8720 61.7319 173.0228 *219 G 4.1401 7.8908 118.0928 45.4123 0.0000 170.5932 220 C 4.9278 8.1691 116.8848 56.1845 39.2306 173.4845 221A A 4.4118 8.9781 123.4293 53.1219 16.8239 176.9696 221 Q 4.5507 7.3787 116.9324 56.3675 29.7101 176.2570 222 K 4.4208 8.4327 121.2312 57.9066 32.6066 176.8092 223 N 4.2500 9.5652 119.4570 53.8465 36.7696 175.2804 224 K 4.2570 7.6770 118.2485 53.4882 32.6723 174.1578 225 P 4.6128 0.0000 0.0000 61.8095 32.9707 176.7189 226 G 3.5170 8.4224 107.5655 46.4261 0.0000 172.4917 227 V 4.3488 7.5201 122.6761 60.8908 33.4220 174.1964 228 Y 4.8600 7.8247 124.5932 55.9717 41.5055 175.0932 229 T 4.3278 8.5583 120.7881 63.4459 69.9537 174.3730 230 K 4.8555 9.6093 128.5395 56.0210 31.1288 177.2371 231 V 3.9681 9.3771 126.9885 65.6129 31.4312 174.8782 232 C 4.3532 8.3049 112.7551 58.0854 41.5572 174.8346 233 N 4.1848 7.8978 117.1177 54.6502 38.5926 175.5230 234 Y 4.7456 8.0602 117.2022 57.4551 39.1147 177.4596 235 V 3.7246 7.7686 120.6280 66.0926 31.6047 177.8908 236 S 4.1327 8.0907 114.4199 61.3982 62.7411 176.0607 237 W 4.2905 8.4396 130.5357 60.7104 30.2227 177.9206 238 I 3.3502 8.5253 119.9663 64.3064 36.6447 178.6564 239 K 3.7955 7.9899 119.3410 59.3798 31.5713 179.3119 240 Q 3.8821 8.1945 120.0163 59.2330 28.7233 178.2370 241 T 3.5391 7.3745 116.3620 66.1284 68.2991 176.5247 242 I 2.0791 7.2047 121.8065 63.7957 36.7759 178.3867 243 A 4.1188 7.5184 120.4221 53.8276 18.1459 178.2152 244 S 4.7465 7.2724 110.4159 57.9190 63.4995 174.0336 245 N 4.6581 7.8570 122.9274 54.4215 39.4773 174.2672 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 8.02 4.11 1.81 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 1.38 1.02 0.84 0.00 0.00 17 V 8.06 4.10 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 0.66 0.00 0.00 1.01 0.00 0.00 18 G 8.34 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 19 G 7.84 4.61 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 0.00 0.00 0.00 20 Y 7.69 5.07 0.00 3.04 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 21 T 8.48 4.40 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 1.22 0.00 0.00 22 C 8.61 3.76 0.00 2.82 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 23 G 7.72 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 24 A 8.39 4.21 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 25 N 8.80 4.28 0.00 2.90 2.93 0.00 0.00 7.11 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 7.52 4.23 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 1.24 0.00 0.00 27 V 7.14 3.93 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.40 0.00 2.30 2.28 0.00 3.65 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 2.17 1.97 0.00 29 Y 6.67 5.09 0.00 3.26 3.40 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 30 Q 7.21 4.83 0.00 1.75 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.72 0.00 0.00 0.00 0.00 0.00 1.86 2.42 0.00 31 V 9.03 4.87 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 1.04 0.00 0.00 1.00 0.00 0.00 32 S 8.75 4.88 0.00 3.27 3.40 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 33 L 8.63 4.74 0.00 0.50 1.11 0.75 0.45 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 34 N 8.78 5.67 0.00 2.46 2.50 0.00 0.00 7.03 7.46 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 *37 S 8.50 4.27 0.00 3.26 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 38 G 9.54 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.81 4.58 0.00 3.04 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 40 H 8.93 4.39 0.00 2.91 3.24 0.00 5.86 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.97 5.07 0.00 3.05 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 42 C 6.78 4.61 0.00 2.11 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 43 G 8.51 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 44 G 7.80 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.42 5.56 0.00 3.85 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 9.37 4.74 0.00 1.83 1.82 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.48 4.06 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 1.66 0.81 0.96 0.00 0.00 48 N 7.63 4.94 0.00 2.96 3.01 0.00 0.00 6.04 8.22 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 49 S 8.83 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 8.17 4.63 0.00 2.03 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.89 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 51 W 8.24 5.35 0.00 3.17 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 52 V 9.17 5.04 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 1.11 0.00 0.00 0.98 0.00 0.00 53 V 9.12 4.96 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 0.77 0.00 0.00 1.03 0.00 0.00 54 S 9.07 5.02 0.00 3.84 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 55 A 8.53 4.63 1.14 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 56 A 8.35 3.77 0.28 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 57 H 7.80 4.57 0.00 3.44 3.57 0.00 5.56 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.72 4.63 0.00 3.26 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 59 Y 7.68 4.10 0.00 3.01 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 60 K 7.49 4.20 0.00 1.30 1.21 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.47 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.96 0.98 7.81 61 S 8.02 4.09 0.00 3.76 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.44 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 63 I 7.04 4.01 1.84 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 1.23 1.04 0.91 0.00 0.00 64 Q 9.21 4.75 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 65 V 8.77 4.49 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 0.90 0.00 0.00 0.90 0.00 0.00 66 R 8.83 5.17 0.00 1.54 1.77 0.00 2.57 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.00 0.00 0.00 77 E 9.87 4.36 0.00 1.96 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 2.29 2.43 0.00 78 G 8.70 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 0.00 0.00 0.00 79 N 7.67 4.88 0.00 2.86 2.84 0.00 0.00 7.06 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 7.85 4.57 0.00 1.62 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 2.75 2.52 0.00 81 Q 8.80 4.41 0.00 2.02 2.00 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 2.25 2.31 0.00 82 F 8.86 5.41 0.00 2.81 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 83 I 8.58 4.69 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 1.25 0.79 0.95 0.00 0.00 84 S 8.69 4.76 0.00 3.75 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 85 A 8.16 4.60 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 86 S 8.90 4.48 0.00 3.74 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 7.60 4.76 0.00 1.50 1.68 0.00 1.59 0.00 0.00 1.90 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.39 7.81 88 S 8.74 5.11 0.00 4.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.53 4.48 2.03 0.00 0.00 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 1.25 0.96 1.05 0.00 0.00 90 V 8.36 4.27 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 0.70 0.00 0.00 0.80 0.00 0.00 91 H 8.85 3.96 0.00 2.85 3.07 0.00 5.66 0.00 0.00 0.00 0.00 6.74 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 4.26 0.00 2.08 2.17 0.00 3.03 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.20 0.00 93 S 7.88 4.74 0.00 3.90 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 94 Y 8.13 4.28 0.00 3.03 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 95 N 8.18 4.48 0.00 2.58 2.43 0.00 0.00 6.53 7.75 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 96 S 8.06 3.62 0.00 3.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.42 4.39 0.00 2.75 2.78 0.00 0.00 6.96 8.37 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 98 T 7.74 3.94 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 1.11 0.00 0.00 99 L 7.88 3.73 0.00 1.48 1.80 0.02 0.85 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 0.00 100 N 7.51 4.50 0.00 2.76 2.63 0.00 0.00 7.25 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.65 4.53 0.00 2.90 2.50 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 7.92 4.60 0.00 3.06 2.68 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 0.00 103 I 6.83 4.84 1.47 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 1.36 1.27 0.08 0.00 0.00 104 M 9.03 5.43 0.00 2.17 1.85 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 105 L 9.40 5.47 0.00 1.72 1.87 0.21 0.69 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 0.00 106 I 8.84 5.01 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 1.19 0.94 0.88 0.00 0.00 107 K 8.90 3.70 0.00 0.79 1.05 0.00 1.19 0.00 0.00 1.35 0.00 0.00 2.68 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.78 0.21 7.81 108 L 8.22 4.44 0.00 1.48 1.61 0.96 0.77 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 9.26 4.12 0.00 1.71 1.85 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.35 7.81 110 S 7.73 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 8.38 4.34 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 9.03 4.33 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 0.00 113 S 8.82 4.64 0.00 3.88 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 0.00 114 L 8.57 4.50 0.00 1.67 1.69 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.62 4.94 0.00 2.77 2.61 0.00 0.00 7.03 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 0.00 116 S 8.84 4.43 0.00 4.01 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 0.00 117 R 8.21 4.30 0.00 1.84 2.19 0.00 3.28 0.00 0.00 3.16 7.28 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.51 4.86 0.00 3.99 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 0.00 128 C 8.37 4.54 0.00 2.94 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 0.00 129 A 8.20 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 8.15 4.26 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 *132 A 8.26 4.30 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 0.00 133 G 9.72 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.72 4.02 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 1.13 0.00 0.00 135 Q 8.57 4.88 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 136 C 9.44 5.23 0.00 2.80 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 0.00 137 L 8.56 5.14 0.00 1.83 1.58 1.04 0.96 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 0.00 138 I 9.10 5.37 1.89 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.48 1.01 0.00 0.00 139 S 8.48 4.98 0.00 3.51 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.76 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 0.00 141 W 8.80 4.64 0.00 3.09 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.41 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.93 3.79 0.00 2.32 2.63 0.00 0.00 7.15 7.70 0.00 0.00 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 8.36 4.33 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 1.22 0.00 0.00 145 K 7.72 4.57 0.00 1.78 1.90 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.29 1.34 7.81 146 S 8.75 4.23 0.00 3.86 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 0.00 147 S 8.25 4.34 0.00 3.79 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 0.00 148 G 8.14 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 0.00 149 T 7.84 4.58 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 1.35 0.00 0.00 150 S 9.14 4.29 0.00 3.78 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.68 4.72 0.00 3.00 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 0.00 152 P 0.00 4.68 0.00 2.46 2.08 0.00 4.11 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 2.19 2.00 0.00 153 D 8.77 4.53 0.00 2.80 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 0.00 154 V 7.45 4.94 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.96 0.00 0.00 155 L 8.26 3.38 0.00 1.44 1.26 -0.78 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.89 0.00 1.67 1.50 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.46 7.81 157 C 8.61 5.34 0.00 1.51 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.44 4.96 0.00 1.74 1.47 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.10 5.10 0.00 1.80 2.04 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.65 7.81 160 A 9.08 4.78 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.94 0.00 1.99 2.06 0.00 3.21 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 162 I 8.74 4.22 1.89 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.81 0.76 0.00 0.00 163 L 8.92 4.62 0.00 1.62 1.60 0.92 1.04 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 0.00 164 S 8.05 4.32 0.00 3.83 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 0.00 165 D 8.73 4.35 0.00 2.80 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 0.00 166 S 8.02 4.21 0.00 3.92 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 0.00 167 S 8.41 4.21 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 0.00 168 C 8.45 4.32 0.00 3.23 3.35 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 0.00 169 K 8.34 3.93 0.00 2.09 1.89 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.53 1.69 7.81 170 S 7.62 4.23 0.00 3.90 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 0.00 171 A 8.04 4.12 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.18 4.63 0.00 3.15 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 4.39 0.00 2.08 2.04 0.00 3.80 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 174 G 9.48 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 7.76 4.50 0.00 2.52 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.61 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 176 I 7.94 4.40 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.96 1.00 0.00 0.00 177 T 8.22 4.54 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 178 S 8.51 4.28 0.00 4.00 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 8.13 4.86 0.00 2.87 3.09 0.00 0.00 6.61 8.75 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 0.00 180 M 8.04 5.47 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 181 F 8.72 5.17 0.00 3.12 3.14 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 0.00 182 C 8.98 5.65 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.37 5.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 7.39 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.63 4.67 0.00 3.04 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 0.00 185 L 8.79 4.06 0.00 1.71 1.75 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.29 3.59 0.00 1.99 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 0.00 2.30 2.33 0.00 187 G 7.98 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 188A G 9.16 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 0.00 188 K 7.53 4.42 0.00 1.81 1.77 0.00 0.71 0.00 0.00 1.30 0.00 0.00 2.58 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 1.16 7.81 189 D 8.37 4.66 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.45 4.85 0.00 4.07 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 0.00 191 C 9.31 4.86 0.00 2.88 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.73 4.30 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.71 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 193 G 9.20 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.45 4.71 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 0.00 195 S 8.08 4.48 0.00 3.98 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 0.00 196 G 8.52 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.68 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 4.97 0.00 2.31 2.36 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 199 V 8.75 4.55 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.67 0.00 0.00 200 V 8.61 4.65 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.83 0.00 0.00 201 C 8.89 5.10 0.00 2.78 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 0.00 202 S 9.63 3.42 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.39 4.67 0.00 1.82 1.66 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.29 7.81 *209 L 8.24 4.25 0.00 1.51 1.63 1.03 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.03 4.42 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.38 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 8.02 5.37 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 0.00 212 I 8.24 5.27 1.93 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 1.31 1.14 0.93 0.00 0.00 213 V 8.87 3.47 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.23 0.00 0.00 214 S 8.54 4.90 0.00 3.98 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 0.00 215 W 7.71 5.08 0.00 3.37 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 0.00 216 G 8.41 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 0.00 217 S 8.81 4.63 0.00 4.22 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 *219 G 7.89 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 0.00 220 C 8.17 4.93 0.00 2.96 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 221A A 8.98 4.41 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 0.00 221 Q 7.38 4.55 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 222 K 8.43 4.42 0.00 1.74 1.82 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.78 1.47 7.81 223 N 9.57 4.25 0.00 2.76 2.85 0.00 0.00 6.76 5.12 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 0.00 224 K 7.68 4.26 0.00 1.73 1.76 0.00 1.71 0.00 0.00 2.01 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.20 1.34 7.81 225 P 0.00 4.61 0.00 2.23 2.09 0.00 3.77 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 2.07 2.00 0.00 226 G 8.42 3.52 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 0.00 0.00 0.00 227 V 7.52 4.35 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 0.56 0.00 0.00 -0.70 0.00 0.00 228 Y 7.82 4.86 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.56 4.33 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 1.29 0.00 0.00 230 K 9.61 4.86 0.00 2.11 1.90 0.00 1.84 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.58 1.71 7.81 231 V 9.38 3.97 2.33 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 1.25 0.00 0.00 1.13 0.00 0.00 232 C 8.30 4.35 0.00 3.15 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 0.00 233 N 7.90 4.18 0.00 2.36 2.29 0.00 0.00 6.80 7.73 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 0.00 234 Y 8.06 4.75 0.00 3.24 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 0.00 235 V 7.77 3.72 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 1.11 0.00 0.00 236 S 8.09 4.13 0.00 3.98 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 8.44 4.29 0.00 3.43 3.52 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 0.00 238 I 8.53 3.35 2.04 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 1.70 1.07 0.82 0.00 0.00 239 K 7.99 3.80 0.00 1.99 1.78 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.48 7.81 240 Q 8.19 3.88 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 241 T 7.37 3.54 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 0.67 0.00 0.00 242 I 7.20 2.08 1.41 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.04 0.37 0.00 0.00 243 A 7.52 4.12 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 7.27 4.75 0.00 3.92 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 0.00 245 N 7.86 4.66 0.00 3.16 3.01 0.00 0.00 6.69 7.44 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 * Residues marked with a * may have inaccurate shift predictions.