NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 E 4.2571 8.4449 118.7985 56.2668 29.8975 174.6427 21 E 4.2578 7.9977 128.2842 55.4487 32.0671 174.5000 22 D 4.5411 9.5808 116.3688 55.3764 39.5914 175.9669 23 V 3.1210 7.3906 114.0613 64.0478 31.5645 177.3286 24 R 4.3987 7.9367 115.7147 55.6713 30.3248 175.5871 25 I 4.1941 8.3395 121.3164 59.4809 37.2721 175.9294 26 L 4.0569 8.3314 126.3832 55.6278 41.8561 177.2565 27 G 4.3969 6.7715 106.6269 44.1500 0.0000 171.2677 28 Y 4.6374 8.1622 118.2347 56.0136 40.1167 175.3333 29 D 5.0425 8.4383 124.0882 51.4236 43.2678 174.5691 30 P 4.3316 0.0000 0.0000 62.7654 31.8377 175.5697 31 L 4.7127 8.2621 122.0299 52.7167 43.9530 175.8487 32 A 4.0512 8.7184 129.8782 52.7308 18.8987 177.8779 33 S 4.5421 8.4957 117.2948 57.0545 65.5002 173.8782 34 P 3.3688 0.0000 0.0000 65.4832 30.9767 178.5308 35 A 3.9123 8.2983 119.7558 55.3253 18.2042 179.5047 36 L 3.9777 7.8619 118.3648 58.2599 42.1698 178.9484 37 L 4.0264 8.1303 120.4059 58.3250 41.7975 178.8393 38 Q 4.0370 8.8741 117.7907 58.0068 28.2922 178.4786 39 V 3.8589 6.9898 117.2424 65.2855 32.1446 177.5409 40 Q 4.3041 8.0607 116.6293 57.5273 29.7318 176.7604 41 I 4.5577 7.6703 120.2342 58.2608 37.5312 173.1633 42 P 4.6001 0.0000 0.0000 61.6937 32.3303 176.5965 43 A 4.4776 8.2875 123.2616 51.1574 19.9753 178.3536 44 T 4.1667 8.2812 113.7936 60.9785 71.1922 173.8136 45 P 4.2983 0.0000 0.0000 65.9610 31.2483 179.2890 46 T 3.8909 7.8212 114.2094 66.6356 68.4909 176.5715 47 S 4.5172 8.1244 118.4914 61.2612 62.8194 177.0300 48 L 4.0902 8.0549 121.2340 57.4491 41.1633 179.3913 49 E 3.9357 8.0042 119.1379 59.5565 29.6811 178.6894 50 T 3.8419 8.2946 116.0116 66.7593 68.5622 176.3377 51 A 4.2686 7.9288 123.8001 54.6831 18.5104 179.9124 52 K 4.0369 7.9531 117.0590 59.2855 31.9972 179.6474 53 R 3.9594 8.3738 119.4403 59.4743 30.0218 178.5389 54 G 3.7929 8.1728 105.5024 48.2894 0.0000 175.6948 55 R 4.0586 7.9692 119.7229 58.8391 29.9922 179.4933 56 R 3.9153 7.8264 117.4495 59.3036 30.1764 178.7498 57 E 3.9193 8.4264 118.3021 59.5013 29.5305 179.2784 58 A 3.9577 8.2753 120.9040 55.3118 18.4948 179.7857 59 I 3.5881 7.8321 118.1315 64.5875 37.1876 178.4070 60 D 4.3449 8.2198 119.7607 57.3682 40.4680 179.0082 61 I 3.6619 7.8218 120.4808 64.3427 37.1613 178.4819 62 I 3.7120 7.7783 113.4606 62.9322 37.3301 177.1070 63 T 4.4187 7.6419 109.7860 61.4808 69.2785 175.5046 64 G 3.9643 7.7549 110.5614 45.4425 0.0000 174.6997 65 K 4.1526 7.8030 118.6482 57.7506 32.4653 176.6684 66 D 4.8766 7.6964 117.4862 52.2403 43.7847 174.7209 67 D 4.5717 8.6404 123.8605 54.0111 39.9331 176.2967 68 R 4.3997 7.4024 118.5607 56.0624 31.9111 175.5318 69 V 4.5027 8.1463 119.6443 61.0280 34.1994 174.2558 70 L 4.5222 9.1222 131.1888 54.7793 43.3664 175.4580 71 V 4.5485 8.7843 126.7430 61.3510 34.0933 174.6316 72 I 4.7322 8.3788 131.2316 59.9590 37.5746 175.0889 73 V 5.2713 9.3476 127.0492 57.6210 34.8414 175.9549 74 G 4.2572 8.6558 111.3973 44.0754 0.0000 169.5266 75 P 4.4776 0.0000 0.0000 61.6143 31.7680 176.5487 76 C 4.1379 8.5146 120.1213 62.3024 31.7913 174.1686 77 S 4.9115 7.2077 109.3229 57.6101 65.5044 175.0446 78 I 4.3233 8.6284 125.1659 60.8540 37.8343 175.5563 79 H 4.8249 8.5379 116.8423 54.4893 30.1164 172.5496 80 D 4.5068 7.4301 119.4071 51.6437 42.1860 175.6971 81 L 4.0855 8.3504 127.9207 57.3099 41.5875 179.3992 82 E 3.9721 8.1713 118.2911 59.3683 29.7565 178.6464 83 A 3.9223 9.2363 121.6727 55.2113 18.3053 179.5550 84 A 3.8961 8.0049 119.1330 55.1414 18.4922 179.6666 85 Q 3.9409 7.7194 118.0055 58.9538 29.2334 177.8604 86 E 3.8581 8.2274 120.4827 59.3919 29.2418 177.9577 87 Y 3.5580 7.9476 119.2849 60.6957 38.7120 177.9413 88 A 4.1016 8.0616 121.4534 55.1926 18.4279 179.5896 89 L 3.8658 7.6926 116.7842 58.0451 41.6566 179.6984 90 R 3.7983 7.3962 117.3117 59.3689 29.9708 178.8229 91 L 4.1067 7.5136 120.0760 58.0131 41.8171 179.2239 92 K 3.9260 8.1184 119.8616 59.2355 32.1665 178.4423 93 K 3.8508 8.0383 119.8736 59.7406 32.1452 178.1634 94 L 3.9869 8.3866 120.7173 58.5247 41.6610 178.9937 95 S 4.2059 8.0101 112.1022 61.1701 62.4468 175.5795 96 D 4.4801 8.1856 120.9523 56.6499 40.7550 177.7991 97 E 4.2073 7.8765 120.0405 58.8203 29.9100 177.6543 98 L 4.3598 7.8664 115.9741 55.1296 41.3009 178.5862 99 K 3.9263 7.7225 122.2430 59.5380 32.0763 177.9958 100 G 3.8343 7.9957 105.1826 47.0600 0.0000 173.4653 101 D 4.8250 8.0528 117.7374 54.1041 44.6341 175.5037 102 L 5.0117 8.4577 118.3021 52.7988 44.3095 176.6742 103 S 4.4615 8.6697 119.6205 57.4020 63.0510 172.4715 104 I 4.8168 8.1939 128.4116 59.9221 38.4654 175.4644 105 I 4.5903 9.0403 127.5925 59.6687 40.5484 174.5251 106 M 5.5126 8.5197 124.9766 53.9586 34.4138 175.5763 107 R 4.6945 8.4808 123.1246 54.9598 30.5291 176.9274 108 A 4.8719 8.3086 130.9912 51.4798 18.6155 176.5740 109 Y 4.2567 8.3263 118.5561 59.0857 39.6397 177.7787 110 L 4.8585 8.3715 121.3475 54.1306 43.3110 175.4336 111 E 4.7588 7.6486 115.5755 55.9469 31.3863 174.9743 112 K 4.6419 8.2431 119.1003 53.9424 35.5413 173.5959 113 P 4.1471 0.0000 0.0000 62.1305 31.7498 176.3733 *119 W 4.7538 7.6873 125.9575 57.6268 31.7709 174.3593 120 K 4.1422 8.1832 123.4788 56.1782 32.0948 176.3868 121 G 2.9524 5.4553 105.9240 44.0752 0.0000 175.1629 122 L 4.3138 8.6520 121.2629 57.2665 42.6271 179.1890 123 I 3.8662 7.4655 118.8858 63.3504 37.9617 177.4364 124 N 4.4401 7.7992 117.0629 54.9461 39.3321 173.8257 125 D 5.3892 7.9221 118.0577 50.7029 41.4182 173.7606 126 P 4.5809 0.0000 0.0000 64.0886 31.3392 177.6469 127 D 4.6379 7.9289 114.2829 51.6897 40.2988 172.8292 128 V 3.5036 7.8282 125.8024 64.0820 29.9415 171.4886 129 N 5.2768 9.4229 135.0000 55.8873 38.5624 174.3224 130 N 4.2275 8.0265 110.3910 56.1564 36.6904 175.8604 131 T 4.4443 8.6641 118.1289 61.3872 68.1686 174.1491 *132 F 4.7304 8.0254 120.8097 56.5938 39.1500 175.7191 133 N 4.6418 8.1998 117.5561 50.8939 40.4352 174.3806 134 I 4.4363 7.3914 125.1372 63.5574 37.7045 177.2913 135 N 4.2464 8.0224 116.5551 56.3945 38.4426 177.2813 136 K 4.2844 8.2507 120.4085 59.0261 32.3270 178.9737 137 G 3.5355 8.0869 106.4172 47.8838 0.0000 175.7827 138 L 4.0191 8.4889 122.4478 57.2242 41.4898 179.7769 139 Q 3.9798 7.8559 117.9069 58.8873 28.6054 178.8442 140 S 4.0455 8.2874 116.0481 61.9428 62.9213 175.8862 141 A 3.7987 8.3559 123.2729 55.7460 17.9351 179.3769 142 R 3.6513 8.4014 115.6925 59.3350 30.2685 178.7378 143 Q 3.9578 8.4893 119.5407 59.3534 29.0143 177.6107 144 L 3.9507 8.5624 121.3975 58.6697 42.0743 178.6634 145 F 4.2061 8.8139 117.2445 60.9674 38.9770 178.2008 146 V 3.6633 8.1646 117.4504 66.0474 31.1645 177.6507 147 N 4.3370 8.4155 115.3585 56.4958 38.7280 177.1177 148 L 4.1412 8.1909 120.3898 58.0928 41.8037 179.7298 149 T 4.2286 8.0088 110.6217 63.8571 68.3318 175.6473 150 N 4.4845 8.0517 119.7636 55.5840 38.9258 175.0551 151 I 4.2085 7.5567 112.6155 60.5469 37.7965 176.2552 152 G 4.2626 8.2999 106.8641 45.9907 0.0000 173.2815 153 L 4.5072 7.4923 121.8228 52.1285 43.0766 174.0962 154 P 4.5714 0.0000 0.0000 62.6965 32.8727 175.3849 155 I 5.0560 8.1827 113.8834 59.1834 41.4692 174.2207 156 G 4.6831 8.9512 109.7359 44.8362 0.0000 171.4948 157 S 4.7718 8.5429 115.6632 56.3337 66.8734 171.9701 158 E 4.6622 7.6201 123.6125 54.6736 30.3707 176.3622 159 M 4.0828 8.3785 126.9957 54.3636 30.6269 176.2472 160 L 4.0025 8.5755 122.5565 56.3604 42.6864 178.4077 161 D 5.1716 7.5307 120.0231 52.2258 42.0534 176.3707 162 T 4.4938 8.4240 111.9328 62.0142 69.3416 174.2279 163 I 4.4397 7.8956 121.8084 63.7357 39.7551 177.6416 164 S 4.1879 10.0231 116.6826 61.5955 62.9927 175.2193 165 P 4.3835 0.0000 0.0000 65.9013 30.7476 178.5539 166 Q 3.5580 8.2401 115.9435 58.8717 28.6485 177.8228 167 Y 4.2829 7.9805 115.9375 59.1634 38.4071 175.9976 168 L 4.7909 7.6439 116.3249 53.6758 44.8815 177.9391 169 A 4.2990 9.3165 124.0785 55.4494 18.2576 179.4244 170 D 4.5846 8.2970 113.0759 55.5648 39.3243 176.9128 171 L 4.6051 8.1233 117.9868 54.4582 43.1954 176.5471 172 V 3.7929 7.6154 118.9618 62.2532 32.1819 175.5384 173 S 4.7208 8.5034 121.8826 59.0957 65.1590 173.8028 174 F 4.9685 7.6195 121.0420 56.2700 43.1346 173.4685 175 G 4.0266 7.9807 111.2465 44.0174 0.0000 171.1384 176 A 4.8503 8.0443 124.6236 49.7168 22.3619 175.0178 177 I 4.2026 8.1757 124.0354 59.8637 38.7170 176.6069 178 G 3.8084 8.7053 115.5925 45.2860 0.0000 173.9779 179 A 4.0250 8.3950 121.6572 54.9137 18.4475 178.8468 180 R 4.3454 7.9068 112.4197 57.0070 30.4024 176.7602 181 T 4.5440 7.7099 107.0185 60.8854 70.1631 175.8427 182 T 3.9456 8.1852 118.7348 66.9290 68.5323 174.9516 183 E 4.0191 7.9850 118.9090 58.0000 30.2593 176.6637 184 S 4.1085 8.0578 115.0823 58.0329 62.8446 174.0336 185 Q 3.8723 8.9949 129.2488 59.4774 28.8454 177.9047 186 L 3.7504 7.9630 120.5137 58.6865 42.0521 178.2483 187 H 4.3372 8.1338 114.7002 57.5699 28.8090 177.9979 188 R 4.0744 7.6553 120.1818 59.2694 29.8945 178.4542 189 E 3.7958 7.8082 117.1034 59.1583 29.5286 178.7556 190 L 3.7338 7.4260 119.7323 58.0677 42.1823 179.0014 191 A 3.9904 7.8282 120.4750 54.7770 18.3759 179.0988 192 S 4.7952 8.2459 110.9120 59.8290 62.7574 175.3953 193 G 4.1119 7.5960 108.9827 44.9999 0.0000 172.9950 194 L 3.9709 7.3946 119.4913 54.3287 42.1816 176.6340 195 S 4.4672 7.6806 116.9771 58.4327 62.6745 173.3927 196 F 5.0584 6.4437 114.8608 55.0762 41.1576 171.6385 197 P 4.8581 0.0000 0.0000 62.6573 32.6620 175.8762 198 V 4.6048 8.6068 123.3399 61.0491 34.2603 174.2211 199 G 3.4202 8.5116 115.7578 44.4601 0.0000 172.1870 200 F 5.0693 8.6476 124.6942 55.8692 40.8037 175.6607 201 K 4.9203 8.3050 122.6324 55.6586 32.8987 176.8949 202 N 4.6016 8.6440 121.0215 52.3991 38.2669 174.9472 203 G 4.1218 8.5050 107.2614 47.1282 0.0000 174.3790 204 T 4.3301 8.8559 111.7138 62.4775 70.0829 174.6703 205 D 4.9063 8.0006 122.4692 53.1954 40.0073 178.8808 206 G 4.0689 7.9276 108.4422 47.2889 0.0000 175.2445 207 T 4.1380 7.4847 110.0487 61.5437 69.2799 174.8657 208 L 4.6257 8.2283 122.8775 55.1734 42.7069 178.1187 209 N 4.3450 7.9466 116.0670 57.4126 38.6734 177.2625 210 V 3.6854 7.8415 113.0183 64.4942 31.6200 178.3557 211 A 3.9657 7.8930 119.9463 54.8270 18.3426 179.6969 212 V 3.5988 7.5156 116.5987 66.1830 31.5025 178.0349 213 D 4.3400 8.1870 118.5269 56.7071 40.5779 178.6185 214 A 3.4963 7.5146 121.5340 55.1999 17.9952 179.3420 215 C 4.2334 7.3520 113.6303 63.0553 28.4382 176.1698 216 Q 4.1596 7.9360 119.2301 58.9316 28.2824 178.7596 217 A 3.9316 8.1181 121.4358 55.2918 18.4702 179.5145 218 A 4.1524 8.4903 118.9859 54.9255 17.9471 179.4399 219 A 4.1726 7.8090 120.3037 53.6772 18.7588 177.3069 220 H 4.4793 8.1295 115.1480 55.1706 30.8759 174.4499 221 S 4.8959 8.3763 114.3482 58.0876 63.2593 172.7462 222 H 5.1566 9.3244 122.8530 54.3976 33.1856 172.5197 223 H 5.3036 9.1085 117.0843 54.1544 30.6763 172.6983 224 F 5.1248 8.6281 118.0407 55.0889 42.1471 173.6149 225 M 4.7315 8.9048 118.7731 54.4530 32.9167 175.8774 226 G 4.3893 8.7997 112.1425 44.9199 0.0000 171.0225 227 V 4.9510 8.3815 112.1246 59.5300 34.5804 175.9563 228 T 4.2792 8.6631 114.3003 60.4895 70.0543 175.6871 229 K 3.9598 8.4405 119.7727 59.0249 31.9546 178.0188 230 H 4.9564 8.0014 116.6421 55.4610 28.9698 175.6933 231 G 4.2410 7.8348 104.8146 46.3120 0.0000 173.9865 232 V 4.4948 6.9895 118.6002 60.2528 34.1754 174.8316 233 A 4.7013 8.5815 129.0180 52.1984 18.9221 176.4908 234 A 4.5615 9.2025 123.1444 50.4016 23.5207 175.8409 235 I 4.1923 8.2270 120.5915 61.3952 37.2710 175.9827 236 T 4.0882 8.6958 125.0985 62.9815 70.0381 174.4128 237 T 4.9601 7.9874 120.7329 62.0467 71.4240 173.6430 238 T 4.4768 8.8756 117.5051 60.2609 70.4563 175.0057 239 K 4.0178 8.5487 123.5930 58.0594 32.7920 177.5337 240 G 4.3709 7.6986 105.9977 45.1339 0.0000 172.3335 241 N 4.8030 9.7991 122.9160 51.7437 40.1797 174.6527 242 E 4.6002 8.7276 122.4089 56.6582 30.7592 175.7263 243 H 5.2507 9.3072 118.0973 56.1219 28.9920 173.8174 244 C 5.9782 8.5653 115.5823 57.5148 30.1496 174.2899 245 F 5.2288 8.3964 117.7023 55.0332 41.8012 173.5516 246 V 4.8339 8.5727 118.0817 61.6826 33.7222 174.1942 247 I 5.0874 8.9761 127.9818 59.6150 40.1738 174.3682 248 L 5.1489 9.1480 127.7376 53.1287 43.5196 176.9786 249 R 4.6793 9.3798 120.8003 55.8396 31.3315 177.2235 250 G 4.3366 8.1604 110.4151 47.1097 0.0000 174.9600 251 G 4.1250 7.8438 105.8771 46.6747 0.0000 173.8820 252 K 4.1408 7.5906 116.1568 59.0303 32.4273 178.7712 253 K 4.0384 7.9340 117.2252 56.9976 32.1863 176.1360 254 G 4.0512 7.6176 104.7086 44.9853 0.0000 173.8477 255 T 4.2902 8.2835 109.4642 61.9783 69.0864 173.3926 256 N 5.3980 8.9745 118.9948 51.8388 37.7983 174.9092 257 Y 4.5230 7.9427 118.1407 58.7051 39.5581 175.5194 258 D 4.1417 6.6335 119.8626 52.5336 40.5310 176.6126 259 A 4.2492 8.5849 123.6453 54.9244 18.2335 179.9081 260 K 3.7650 7.8579 117.0754 59.9098 32.1570 179.0785 261 S 4.2138 8.1621 115.3567 61.4407 62.7933 176.7043 262 V 3.6795 7.7670 119.9913 65.4298 31.0832 177.9338 263 A 3.9544 7.9033 120.7300 55.3112 18.1210 179.3520 264 E 3.9104 7.5992 114.0477 59.9098 29.7003 178.9208 265 A 4.0615 8.0881 120.8609 54.8282 18.2234 179.4608 266 K 3.7977 8.4993 117.7837 58.9703 32.4477 178.3507 267 A 4.4467 7.5057 118.7432 52.4194 18.9370 177.3579 268 Q 4.4725 8.4190 116.4602 56.0951 31.1495 176.4495 269 L 4.0805 7.8897 118.1244 54.0222 42.1569 175.3222 270 P 4.3175 0.0000 0.0000 61.5881 32.0168 174.7422 271 A 4.0883 8.4575 123.0839 56.4281 17.7577 177.5273 272 G 4.0966 8.9316 109.7845 46.2074 0.0000 172.9668 273 S 4.4099 7.7977 115.0948 58.2370 63.5195 174.4958 274 N 4.8128 8.4809 119.7473 52.5804 40.6560 174.0381 275 G 4.1148 8.1495 106.4392 45.1456 0.0000 174.1403 276 L 4.4165 7.8862 123.5609 55.4937 43.1375 176.0616 277 M 5.3084 9.3556 121.4699 53.8532 35.9654 174.1699 278 I 5.0658 8.7423 124.8213 59.5644 40.8072 173.9105 279 D 4.9347 9.6788 128.3989 53.5758 41.7933 175.5956 280 Y 4.7465 9.2343 123.5893 58.8025 39.3180 175.3396 281 S 4.8880 7.6822 113.5380 57.6023 67.0124 174.1362 282 H 3.9798 8.4484 117.6745 57.0306 26.6409 178.6589 283 G 4.2140 9.0282 115.6199 48.3708 0.0000 173.1800 284 N 4.7406 7.8620 115.4841 54.4506 39.6270 176.5216 285 S 4.0423 8.1399 113.2333 59.2488 62.9305 173.4334 286 N 4.1158 8.3240 115.2702 55.2668 34.9814 173.9189 287 K 3.8904 8.3102 111.1635 57.0946 30.3931 175.7631 288 D 4.5576 7.5755 118.8002 51.4916 41.2848 175.8755 289 F 4.0143 8.7072 119.7294 58.5752 37.8736 177.0125 290 R 4.0858 7.3808 120.0935 57.8665 30.6148 177.7780 291 N 4.2666 8.8841 116.1591 54.7207 38.3705 176.7872 292 Q 3.9401 7.5114 120.4133 58.6428 28.7027 176.8676 293 P 4.2097 0.0000 0.0000 65.1346 31.6056 178.7157 294 K 3.9832 7.5985 117.3322 59.4159 32.1600 179.0289 295 V 2.9509 7.1457 118.0434 65.8280 30.9691 177.4005 296 N 4.0618 7.3515 117.8335 56.1031 38.3046 176.4175 297 D 4.2711 7.7853 120.0564 57.4777 40.9679 178.9347 298 V 3.7500 7.6500 117.7107 64.9490 31.6359 178.0118 299 V 3.8464 7.6324 118.2143 66.0206 31.7284 177.5043 300 C 4.0695 9.0627 117.4785 62.8708 27.9087 176.1563 301 E 3.8985 7.9359 120.3153 59.4409 29.2149 178.7364 302 Q 4.0356 7.5624 117.3684 59.2187 28.7742 179.1271 303 I 3.7510 7.9479 120.5459 64.2212 36.8882 178.3734 304 A 4.2513 7.7619 120.5484 54.6498 18.1822 178.3312 305 N 4.7717 7.7765 112.6127 52.7865 39.2755 175.3799 306 G 3.6283 8.0905 107.4864 46.1646 0.0000 174.5708 307 E 4.3277 7.7048 120.7396 54.9423 29.6437 174.5829 308 N 4.7748 8.7082 122.9408 53.3027 39.1510 175.7089 309 A 4.3652 7.7858 121.7015 54.0254 20.7904 177.7779 310 I 4.3173 7.8359 116.9393 61.7826 36.5721 175.9057 311 T 4.3506 8.8832 118.8309 62.1827 70.9365 174.8176 312 G 4.4382 7.7632 107.4697 44.6741 0.0000 171.8928 313 V 4.8685 8.9616 113.8556 59.3101 35.8509 174.3324 314 M 4.9907 9.0134 124.0923 53.8895 34.5556 174.5271 315 I 4.8532 8.6457 126.6485 59.4775 40.9438 174.4541 316 E 5.0035 8.9000 125.2461 54.9385 31.0769 175.2184 317 S 4.8494 8.6524 118.6864 57.2253 67.1107 172.4038 318 N 4.9495 8.7931 119.0439 51.9681 42.1328 174.0783 319 I 4.0715 8.7544 120.2088 62.6621 38.3795 176.5083 320 N 5.3644 7.8045 117.7471 52.6075 41.6757 176.5696 321 E 4.5550 9.1060 127.1620 57.7633 31.7985 175.7124 322 G 3.2569 7.7894 106.1566 44.4035 0.0000 171.6335 323 N 5.2878 8.2149 115.2206 51.3674 40.5534 173.8310 324 Q 4.7923 8.5158 118.7133 54.5635 31.9832 173.4775 325 G 4.1342 8.5382 105.5207 44.9369 0.0000 173.2400 326 I 4.3690 8.0854 120.5118 58.6799 37.1454 174.4885 327 P 4.3411 0.0000 0.0000 65.2530 33.0529 178.5038 *335 K 4.4205 7.2205 117.0806 54.1447 32.9957 178.5315 336 Y 4.7351 9.4009 134.3922 59.2778 40.2199 172.2649 337 G 3.8816 7.2430 112.2403 45.7112 0.0000 172.9167 338 V 4.2583 7.0738 118.6774 60.3780 33.7974 175.0506 339 S 4.0552 8.4168 122.3588 57.9415 62.6171 174.4101 340 I 4.0428 7.9538 118.9817 61.9601 38.5168 175.4633 341 T 4.5323 7.4390 111.3568 62.1666 68.0409 177.4913 342 D 4.5349 9.1068 115.7671 53.5767 41.6127 174.9489 343 A 4.4628 8.1722 123.3407 51.3382 20.0721 177.3889 344 C 5.0434 8.2207 122.4731 58.5296 30.7547 172.9134 345 I 4.7937 8.2022 116.5702 60.0942 41.3036 175.2836 346 G 4.5512 8.7538 109.8837 45.8856 0.0000 174.3608 347 W 4.9535 8.8763 132.1133 60.7487 30.4091 178.1234 348 E 3.6778 8.2527 118.9340 59.0822 29.0455 178.2508 349 T 3.8470 7.8763 108.7610 66.2187 68.7541 175.1499 350 T 3.7562 8.6529 118.6561 65.6653 68.3160 176.3624 351 E 3.2611 7.8312 120.5160 59.2418 30.2585 179.3707 352 D 4.4378 7.7470 118.0569 56.1008 40.9374 178.9681 353 V 3.5928 8.3320 120.2811 65.8774 31.4501 178.0069 354 L 3.9859 7.7370 118.3225 57.8035 41.5545 179.4433 355 R 3.8125 7.8932 118.0993 58.9569 29.8551 179.1062 356 K 3.8998 8.1873 119.5165 59.4224 32.0441 178.6210 357 L 3.9398 7.9060 119.3463 58.0009 42.2467 178.5454 358 A 4.0812 8.6748 120.9016 55.0751 18.3099 179.0295 359 A 3.8734 8.0640 119.1535 55.7242 18.4323 179.6143 360 A 3.9094 8.3004 119.0266 55.5317 18.1138 180.0456 361 V 3.6198 7.5598 115.9073 66.0269 31.3429 178.2392 362 R 4.0655 8.1724 118.3209 58.8264 29.8832 178.8117 363 Q 4.2169 7.7817 120.4191 58.7992 29.0910 177.9304 364 R 3.9761 7.7632 117.9668 59.1011 30.2878 178.4803 365 R 4.0568 7.6296 117.2621 59.4534 30.0399 178.6913 366 E 3.9412 8.0767 117.8090 59.4927 29.3929 179.1606 367 V 3.5584 7.3960 116.9069 65.4952 32.7084 177.0197 368 N 4.7561 7.4269 117.2840 49.7106 35.4134 174.2286 369 K 4.2608 6.8740 120.0383 56.1826 36.7227 177.0103 *370 K 4.1215 8.5731 121.6505 54.9887 32.3269 176.7483 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 20 E 8.44 4.26 0.00 2.10 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 2.18 2.35 0.00 21 E 8.00 4.26 0.00 2.15 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 2.33 2.41 0.00 22 D 9.58 4.54 0.00 2.98 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.39 3.12 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 0.71 0.00 0.00 0.93 0.00 0.00 24 R 7.94 4.40 0.00 1.76 1.90 0.00 3.17 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 25 I 8.34 4.19 2.01 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 1.27 0.97 0.61 0.00 0.00 26 L 8.33 4.06 0.00 1.57 1.69 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 27 G 6.77 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 28 Y 8.16 4.64 0.00 2.88 2.89 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 29 D 8.44 5.04 0.00 2.66 2.58 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 30 P 0.00 4.33 0.00 2.19 2.07 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 31 L 8.26 4.71 0.00 1.58 1.62 0.85 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.72 4.05 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.50 4.54 0.00 4.21 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 3.37 0.00 1.97 1.68 0.00 3.57 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.78 0.00 35 A 8.30 3.91 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 36 L 7.86 3.98 0.00 1.81 1.88 0.93 0.57 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 37 L 8.13 4.03 0.00 2.07 1.83 0.97 0.93 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 38 Q 8.87 4.04 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.46 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 39 V 6.99 3.86 2.24 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 0.85 0.00 0.00 0.98 0.00 0.00 40 Q 8.06 4.30 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 41 I 7.67 4.56 1.90 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 1.37 0.62 1.01 0.00 0.00 42 P 0.00 4.60 0.00 2.19 2.06 0.00 3.38 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 43 A 8.29 4.48 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 44 T 8.28 4.17 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 1.23 0.00 0.00 45 P 0.00 4.30 0.00 2.19 2.16 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 46 T 7.82 3.89 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 1.31 0.00 0.00 47 S 8.12 4.52 0.00 4.06 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 48 L 8.05 4.09 0.00 1.72 1.75 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.00 3.94 0.00 2.29 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 0.00 2.32 2.40 0.00 50 T 8.29 3.84 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 51 A 7.93 4.27 1.36 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 52 K 7.95 4.04 0.00 1.93 1.90 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.70 7.81 53 R 8.37 3.96 0.00 1.97 2.08 0.00 3.12 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 54 G 8.17 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 55 R 7.97 4.06 0.00 2.09 2.12 0.00 3.25 0.00 0.00 3.54 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 56 R 7.83 3.92 0.00 2.10 1.98 0.00 3.15 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 57 E 8.43 3.92 0.00 1.99 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 2.33 2.34 0.00 58 A 8.28 3.96 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 59 I 7.83 3.59 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.30 0.73 0.00 0.00 60 D 8.22 4.34 0.00 2.80 2.70 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 0.00 0.00 0.00 0.00 61 I 7.82 3.66 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.77 0.88 0.00 0.00 62 I 7.78 3.71 1.59 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.61 0.40 0.00 0.00 63 T 7.64 4.42 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 1.31 0.00 0.00 64 G 7.75 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 65 K 7.80 4.15 0.00 1.89 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.37 7.81 66 D 7.70 4.88 0.00 2.54 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.64 4.57 0.00 2.79 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.40 4.40 0.00 1.94 2.00 0.00 3.03 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 69 V 8.15 4.50 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.91 0.00 0.00 70 L 9.12 4.52 0.00 1.62 1.32 0.85 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.78 4.55 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 0.86 0.00 0.00 0.91 0.00 0.00 72 I 8.38 4.73 1.77 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 0.90 0.00 0.99 0.00 0.00 73 V 9.35 5.27 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 1.24 0.00 0.00 1.09 0.00 0.00 74 G 8.66 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.48 0.00 1.89 1.85 0.00 3.53 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 76 C 8.51 4.14 0.00 2.88 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 77 S 7.21 4.91 0.00 4.26 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 78 I 8.63 4.32 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.91 0.91 0.00 0.00 79 H 8.54 4.82 0.00 2.29 2.00 0.00 5.47 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 7.43 4.51 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.35 4.09 0.00 1.76 1.71 0.95 1.03 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 82 E 8.17 3.97 0.00 2.16 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 2.41 2.43 0.00 83 A 9.24 3.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.00 3.90 1.36 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 85 Q 7.72 3.94 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 86 E 8.23 3.86 0.00 2.12 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 2.24 2.28 0.00 87 Y 7.95 3.56 0.00 2.91 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 88 A 8.06 4.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.69 3.87 0.00 1.85 1.67 0.91 0.76 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 90 R 7.40 3.80 0.00 0.83 1.30 0.00 2.21 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 91 L 7.51 4.11 0.00 1.31 1.71 1.12 0.86 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 92 K 8.12 3.93 0.00 2.00 2.01 0.00 1.60 0.00 0.00 1.58 0.00 0.00 3.12 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 K 8.04 3.85 0.00 1.90 2.10 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.49 7.81 94 L 8.39 3.99 0.00 2.00 2.01 0.84 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.01 4.21 0.00 4.10 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 96 D 8.19 4.48 0.00 2.86 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 97 E 7.88 4.21 0.00 2.02 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 0.00 2.27 2.33 0.00 98 L 7.87 4.36 0.00 1.74 1.65 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.72 3.93 0.00 1.97 1.93 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.46 1.42 7.81 100 G 8.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 8.05 4.83 0.00 2.55 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 0.00 102 L 8.46 5.01 0.00 1.41 1.52 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.67 4.46 0.00 3.91 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.19 4.82 1.88 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 1.34 0.71 0.95 0.00 0.00 105 I 9.04 4.59 1.79 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 1.10 0.83 0.91 0.00 0.00 106 M 8.52 5.51 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.34 0.00 107 R 8.48 4.69 0.00 1.71 1.92 0.00 3.05 0.00 0.00 3.38 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 108 A 8.31 4.87 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 8.33 4.26 0.00 3.01 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 0.00 110 L 8.37 4.86 0.00 1.55 1.65 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 111 E 7.65 4.76 0.00 1.73 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 0.00 2.00 1.99 0.00 112 K 8.24 4.64 0.00 1.76 1.73 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.36 1.55 7.81 113 P 0.00 4.15 0.00 2.09 2.08 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 *119 W 7.69 4.75 0.00 3.14 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 0.00 120 K 8.18 4.14 0.00 1.58 1.60 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.35 7.81 121 G 5.46 2.95 0.00 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 0.00 130 N 8.03 4.23 0.00 2.81 2.92 0.00 0.00 7.01 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 0.00 131 T 8.66 4.44 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 1.22 0.00 0.00 *132 F 8.03 4.73 0.00 2.29 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 0.00 0.00 0.00 133 N 8.20 4.64 0.00 2.72 2.66 0.00 0.00 7.20 7.88 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 0.00 134 I 7.39 4.44 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.89 0.76 0.00 0.00 135 N 8.02 4.25 0.00 2.71 2.85 0.00 0.00 6.78 6.90 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 0.00 136 K 8.25 4.28 0.00 1.81 1.92 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.50 7.81 137 G 8.09 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.49 4.02 0.00 1.62 1.48 0.11 0.66 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 0.00 139 Q 7.86 3.98 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 140 S 8.29 4.05 0.00 4.00 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 0.00 141 A 8.36 3.80 1.08 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 0.00 0.00 142 R 8.40 3.65 0.00 1.89 1.93 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 143 Q 8.49 3.96 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.50 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 144 L 8.56 3.95 0.00 1.89 2.11 0.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 145 F 8.81 4.21 0.00 3.20 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 0.00 146 V 8.16 3.66 2.30 0.00 0.00 0.00 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0.00 0.00 1.05 0.00 0.00 163 I 7.90 4.44 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.75 1.13 0.00 0.00 164 S 10.02 4.19 0.00 3.90 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 0.00 165 P 0.00 4.38 0.00 2.21 2.20 0.00 3.73 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 2.23 2.23 0.00 166 Q 8.24 3.56 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 167 Y 7.98 4.28 0.00 3.02 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 0.00 168 L 7.64 4.79 0.00 1.74 1.68 0.78 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 169 A 9.32 4.30 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 D 8.30 4.58 0.00 2.85 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 0.00 171 L 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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 0.00 0.00 0.00 180 R 7.91 4.35 0.00 1.79 1.96 0.00 3.16 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 181 T 7.71 4.54 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 0.98 0.00 0.00 182 T 8.19 3.95 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 1.14 0.00 0.00 183 E 7.98 4.02 0.00 1.93 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 2.26 2.26 0.00 184 S 8.06 4.11 0.00 3.83 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 0.00 185 Q 8.99 3.87 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.60 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 186 L 7.96 3.75 0.00 1.73 1.63 0.78 1.01 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 0.00 187 H 8.13 4.34 0.00 3.45 3.39 0.00 5.86 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 R 7.66 4.07 0.00 1.92 1.88 0.00 3.02 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.81 0.00 189 E 7.81 3.80 0.00 1.40 1.78 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 1.97 2.31 0.00 190 L 7.43 3.73 0.00 1.54 1.65 0.85 0.72 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 0.00 191 A 7.83 3.99 1.46 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 0.00 0.00 0.00 192 S 8.25 4.80 0.00 4.42 4.37 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 0.00 193 G 7.60 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 L 7.39 3.97 0.00 1.20 0.32 0.90 0.60 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 0.00 195 S 7.68 4.47 0.00 3.81 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 F 6.44 5.06 0.00 3.17 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 0.00 197 P 0.00 4.86 0.00 2.59 2.45 0.00 4.04 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 198 V 8.61 4.60 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 0.27 0.00 0.00 0.92 0.00 0.00 199 G 8.51 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 F 8.65 5.07 0.00 2.95 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 0.00 201 K 8.31 4.92 0.00 1.75 1.80 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.45 7.81 202 N 8.64 4.60 0.00 3.10 2.88 0.00 0.00 6.86 6.61 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 0.00 203 G 8.51 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 0.00 204 T 8.86 4.33 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 1.23 0.00 0.00 205 D 8.00 4.91 0.00 2.84 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 0.00 206 G 7.93 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 0.00 207 T 7.48 4.14 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 208 L 8.23 4.63 0.00 1.79 1.67 0.98 0.72 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 0.00 209 N 7.95 4.34 0.00 2.84 2.84 0.00 0.00 7.10 7.68 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 0.00 210 V 7.84 3.69 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 0.75 0.00 0.00 0.92 0.00 0.00 211 A 7.89 3.97 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 0.00 212 V 7.52 3.60 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 1.03 0.00 0.00 0.98 0.00 0.00 213 D 8.19 4.34 0.00 2.78 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 A 7.51 3.50 -0.06 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 0.00 215 C 7.35 4.23 0.00 3.19 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 Q 7.94 4.16 0.00 2.23 2.15 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 2.71 2.52 0.00 217 A 8.12 3.93 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 0.00 218 A 8.49 4.15 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 A 7.81 4.17 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 0.00 220 H 8.13 4.48 0.00 3.24 3.18 0.00 5.80 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 S 8.38 4.90 0.00 3.87 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 0.00 222 H 9.32 5.16 0.00 3.26 3.30 0.00 5.61 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 0.00 223 H 9.11 5.30 0.00 2.99 3.28 0.00 5.84 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 0.00 224 F 8.63 5.12 0.00 3.11 3.20 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 0.00 225 M 8.90 4.73 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 226 G 8.80 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 0.00 0.00 0.00 0.00 227 V 8.38 4.95 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 0.85 0.00 0.00 0.96 0.00 0.00 228 T 8.66 4.28 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 1.16 0.00 0.00 229 K 8.44 3.96 0.00 1.69 1.80 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.45 1.33 7.81 230 H 8.00 4.96 0.00 3.10 3.22 0.00 5.79 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 G 7.83 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 0.00 0.00 0.00 0.00 232 V 6.99 4.49 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 0.93 0.00 0.00 0.99 0.00 0.00 233 A 8.58 4.70 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 0.00 234 A 9.20 4.56 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 0.00 235 I 8.23 4.19 1.81 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 1.32 0.54 0.88 0.00 0.00 236 T 8.70 4.09 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 0.83 0.00 0.00 237 T 7.99 4.96 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 1.17 0.00 0.00 238 T 8.88 4.48 4.50 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 1.42 0.00 0.00 239 K 8.55 4.02 0.00 1.72 1.85 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.42 7.81 240 G 7.70 4.37 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 0.00 241 N 9.80 4.80 0.00 2.77 2.72 0.00 0.00 6.68 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 0.00 242 E 8.73 4.60 0.00 2.15 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 2.18 2.26 0.00 243 H 9.31 5.25 0.00 3.29 3.42 0.00 5.60 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 C 8.57 5.98 0.00 3.03 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 0.00 245 F 8.40 5.23 0.00 3.16 3.17 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 0.00 246 V 8.57 4.83 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 1.17 0.00 0.00 1.04 0.00 0.00 247 I 8.98 5.09 1.97 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.12 1.04 0.00 0.00 248 L 9.15 5.15 0.00 1.69 1.99 1.00 0.63 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 0.00 249 R 9.38 4.68 0.00 1.93 2.31 0.00 3.16 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 250 G 8.16 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 G 7.84 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 0.00 252 K 7.59 4.14 0.00 1.89 1.87 0.00 1.70 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.53 7.81 253 K 7.93 4.04 0.00 1.73 1.84 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.45 7.81 254 G 7.62 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 0.00 0.00 0.00 255 T 8.28 4.29 4.75 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 1.41 0.00 0.00 256 N 8.97 5.40 0.00 2.76 2.90 0.00 0.00 6.87 8.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 Y 7.94 4.52 0.00 3.21 3.23 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 0.00 258 D 6.63 4.14 0.00 2.65 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 0.00 0.00 0.00 0.00 259 A 8.58 4.25 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 0.00 260 K 7.86 3.76 0.00 1.78 1.95 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.49 7.81 261 S 8.16 4.21 0.00 4.11 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 0.00 262 V 7.77 3.68 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 1.16 0.00 0.00 1.02 0.00 0.00 263 A 7.90 3.95 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 0.00 264 E 7.60 3.91 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 265 A 8.09 4.06 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 0.00 266 K 8.50 3.80 0.00 1.74 1.94 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.67 7.81 267 A 7.51 4.45 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 0.00 268 Q 8.42 4.47 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 269 L 7.89 4.08 0.00 1.67 1.67 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 270 P 0.00 4.32 0.00 2.20 1.99 0.00 3.66 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 271 A 8.46 4.09 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 0.00 272 G 8.93 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 0.00 273 S 7.80 4.41 0.00 3.94 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 0.00 274 N 8.48 4.81 0.00 2.87 3.05 0.00 0.00 6.84 7.65 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 0.00 275 G 8.15 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 L 7.89 4.42 0.00 1.80 1.73 0.97 0.67 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 0.00 277 M 9.36 5.31 0.00 2.39 2.12 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 278 I 8.74 5.07 2.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.86 1.24 0.00 0.00 279 D 9.68 4.93 0.00 2.75 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 0.00 280 Y 9.23 4.75 0.00 3.06 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 0.00 281 S 7.68 4.89 0.00 3.78 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 0.00 282 H 8.45 3.98 0.00 3.50 2.90 0.00 5.84 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 G 9.03 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 284 N 7.86 4.74 0.00 3.07 2.83 0.00 0.00 6.93 7.04 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 0.00 285 S 8.14 4.04 0.00 3.86 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 0.00 286 N 8.32 4.12 0.00 2.97 2.89 0.00 0.00 7.03 7.61 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 0.00 287 K 8.31 3.89 0.00 1.86 1.88 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.50 7.81 288 D 7.58 4.56 0.00 2.54 2.76 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 0.00 0.00 0.00 0.00 289 F 8.71 4.01 0.00 3.33 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 0.00 290 R 7.38 4.09 0.00 1.73 1.77 0.00 2.86 0.00 0.00 2.79 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.50 0.00 291 N 8.88 4.27 0.00 2.82 2.72 0.00 0.00 6.82 7.20 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 0.00 292 Q 7.51 3.94 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.75 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 293 P 0.00 4.21 0.00 1.95 2.09 0.00 3.88 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 2.02 2.19 0.00 294 K 7.60 3.98 0.00 1.83 1.74 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.39 7.81 295 V 7.15 2.95 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 -0.25 0.00 0.00 296 N 7.35 4.06 0.00 2.57 2.82 0.00 0.00 6.85 8.03 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 0.00 297 D 7.79 4.27 0.00 2.97 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 0.00 298 V 7.65 3.75 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 1.08 0.00 0.00 1.10 0.00 0.00 299 V 7.63 3.85 2.36 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 1.16 0.00 0.00 1.18 0.00 0.00 300 C 9.06 4.07 0.00 3.14 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 0.00 301 E 7.94 3.90 0.00 2.10 2.20 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 2.32 2.35 0.00 302 Q 7.56 4.04 0.00 2.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.65 0.00 303 I 7.95 3.75 1.89 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 1.48 0.74 0.92 0.00 0.00 304 A 7.76 4.25 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 0.00 305 N 7.78 4.77 0.00 2.72 2.84 0.00 0.00 7.18 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 G 8.09 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 0.00 0.00 0.00 307 E 7.70 4.33 0.00 1.98 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 2.28 2.33 0.00 308 N 8.71 4.77 0.00 2.75 2.81 0.00 0.00 7.07 7.35 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 0.00 309 A 7.79 4.37 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 0.00 310 I 7.84 4.32 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.61 0.95 0.00 0.00 311 T 8.88 4.35 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 312 G 7.76 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 V 8.96 4.87 1.15 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 0.68 0.00 0.00 0.68 0.00 0.00 314 M 9.01 4.99 0.00 2.15 1.91 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 315 I 8.65 4.85 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.80 1.06 0.00 0.00 316 E 8.90 5.00 0.00 1.87 1.81 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 2.11 2.13 0.00 317 S 8.65 4.85 0.00 4.23 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 0.00 318 N 8.79 4.95 0.00 2.65 2.83 0.00 0.00 7.17 8.07 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 0.00 319 I 8.75 4.07 1.97 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 1.23 0.77 1.01 0.00 0.00 320 N 7.80 5.36 0.00 2.74 2.09 0.00 0.00 6.53 7.50 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 0.00 321 E 9.11 4.56 0.00 1.80 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 0.00 2.13 2.20 0.00 322 G 7.79 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 323 N 8.21 5.29 0.00 2.74 2.72 0.00 0.00 5.66 7.39 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 0.00 324 Q 8.52 4.79 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 325 G 8.54 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 0.00 0.00 0.00 326 I 8.09 4.37 1.86 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 1.41 0.46 0.88 0.00 0.00 327 P 0.00 4.34 0.00 2.17 2.12 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 *335 K 7.22 4.42 0.00 1.98 0.93 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 336 Y 9.40 4.74 0.00 3.08 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 337 G 7.24 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 0.00 338 V 7.07 4.26 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 0.80 0.00 0.00 1.01 0.00 0.00 339 S 8.42 4.06 0.00 3.79 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 340 I 7.95 4.04 1.65 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.27 0.58 0.00 0.00 341 T 7.44 4.53 4.32 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 1.41 0.00 0.00 342 D 9.11 4.53 0.00 2.70 2.66 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 0.00 0.00 0.00 0.00 343 A 8.17 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 344 C 8.22 5.04 0.00 2.80 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 0.00 345 I 8.20 4.79 1.99 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 1.57 0.83 1.12 0.00 0.00 346 G 8.75 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 347 W 8.88 4.95 0.00 3.30 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 0.00 348 E 8.25 3.68 0.00 2.07 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 2.31 2.28 0.00 349 T 7.88 3.85 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 1.33 0.00 0.00 350 T 8.65 3.76 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 351 E 7.83 3.26 0.00 1.16 1.57 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 2.02 2.04 0.00 352 D 7.75 4.44 0.00 2.66 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 353 V 8.33 3.59 2.24 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 1.26 0.00 0.00 0.99 0.00 0.00 354 L 7.74 3.99 0.00 1.82 1.66 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 355 R 7.89 3.81 0.00 1.95 1.93 0.00 3.21 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 356 K 8.19 3.90 0.00 1.90 2.04 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.43 7.81 357 L 7.91 3.94 0.00 1.86 1.83 0.98 1.36 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 0.00 358 A 8.67 4.08 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 0.00 359 A 8.06 3.87 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 0.00 360 A 8.30 3.91 1.46 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 0.00 0.00 0.00 361 V 7.56 3.62 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 0.91 0.00 0.00 0.97 0.00 0.00 362 R 8.17 4.07 0.00 2.08 1.95 0.00 3.17 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 363 Q 7.78 4.22 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 364 R 7.76 3.98 0.00 2.06 1.96 0.00 3.61 0.00 0.00 3.39 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 365 R 7.63 4.06 0.00 2.13 1.95 0.00 3.17 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 366 E 8.08 3.94 0.00 2.05 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 2.40 2.42 0.00 367 V 7.40 3.56 2.24 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 0.87 0.00 0.00 1.02 0.00 0.00 368 N 7.43 4.76 0.00 2.91 2.77 0.00 0.00 6.85 7.28 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 0.00 369 K 6.87 4.26 0.00 1.80 1.65 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.53 7.81 *370 K 8.57 4.12 0.00 1.52 1.62 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.