NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 K 4.3627 8.4145 122.1404 54.3946 35.7173 178.1169 8 K 3.7371 8.3194 108.3239 56.8309 33.4465 181.8212 9 R 4.2313 10.0655 116.9583 57.6726 31.3836 183.0611 10 K 3.6580 9.5071 123.3223 56.2937 31.5339 179.0459 11 L 3.8316 8.6788 119.9271 59.5744 41.3647 181.0363 12 V 3.7234 7.7044 114.0567 63.6669 32.1032 180.5617 13 A 4.2746 8.0935 125.6052 56.0486 17.7475 179.6497 14 D 4.5267 9.2978 121.3347 57.7320 39.7834 181.4623 15 G 4.1977 8.1700 110.3891 48.5272 0.0000 175.6358 16 V 4.4807 8.9166 132.2300 63.4349 31.4566 185.0000 *17 F 4.4260 8.6560 121.0650 64.1895 37.9056 175.4114 *18 Y 4.1875 8.8104 119.7549 61.0012 36.2487 182.8610 19 A 4.1380 6.6588 124.0041 56.3104 19.5431 181.0344 20 E 3.8948 8.5299 112.3764 60.0985 29.4916 181.2604 21 L 4.2363 8.4822 125.4459 59.1979 40.6366 183.9869 22 N 4.1754 7.2257 122.4929 57.9245 39.0504 178.6103 23 E 3.8728 8.5716 120.8606 62.5805 28.1273 181.4795 *24 F 4.3542 8.2959 121.1783 62.8533 38.2039 179.7393 *25 F 4.4003 7.8984 119.1948 60.2269 37.6411 178.2050 26 T 4.5916 9.5952 112.4118 63.8464 70.9376 179.9181 27 R 4.2966 7.4061 124.0322 58.2616 31.3810 179.7505 28 E 4.1556 8.8168 113.1065 58.8915 27.1719 172.8660 29 L 4.6326 8.0324 121.8842 55.6768 47.5195 179.9698 30 A 4.0778 8.2107 122.1229 55.9030 18.4985 179.7448 31 E 4.1186 8.3819 113.4227 58.5129 29.6472 183.1386 32 E 4.4472 8.4850 111.9863 55.2310 32.0458 177.6793 33 G 3.7758 8.0820 113.1438 46.7168 0.0000 173.8120 *34 Y 4.5544 8.0731 126.8409 56.9930 38.0357 175.1723 35 S 4.7134 8.3648 109.1845 59.3650 66.4779 173.2741 36 G 3.8056 8.1471 110.1445 47.5222 0.0000 173.6578 37 V 4.8800 7.2028 132.1257 62.1118 34.6773 168.4455 38 E 4.8447 8.2907 124.8584 54.6026 33.9766 173.1115 39 V 5.5391 8.4453 124.3307 58.7999 35.6952 173.2727 40 R 4.8362 8.5104 125.9098 55.6983 34.3852 172.2350 41 V 5.1494 8.0783 116.7351 62.7691 35.4012 173.5616 42 T 3.8590 9.1150 117.3238 61.8846 67.6794 175.3853 43 P 4.7775 0.0000 0.0000 61.6384 32.4865 177.0365 44 T 3.4507 8.3997 118.9086 61.9228 66.3289 172.5537 45 K 4.8971 7.6928 127.8561 55.3809 30.9411 178.5945 46 T 4.2293 8.4901 120.7722 62.2329 70.1460 175.8939 47 E 5.1641 9.2552 128.5201 54.3441 32.9478 172.8881 48 V 4.0289 9.0844 128.7237 60.4703 32.9156 173.7801 49 I 4.9141 7.7937 125.7521 59.1929 35.0006 175.9168 50 I 3.8548 8.1457 127.3459 61.4079 36.3182 178.9735 51 R 4.4121 8.5988 129.8164 55.8350 30.4734 172.7623 52 A 4.8642 8.3014 128.2207 50.0628 21.4344 178.0835 53 T 3.9034 9.1081 118.8941 63.9704 69.1288 175.7981 54 R 4.6763 7.4127 123.0221 56.8088 29.6056 180.8859 55 T 4.3030 8.3097 116.1948 62.1324 67.4405 176.7883 56 Q 4.4825 8.5151 129.2871 55.1126 29.4030 178.6106 57 D 5.2912 9.6256 123.0513 57.7559 40.2755 181.1780 58 V 3.8769 8.0443 116.3884 63.4015 31.5711 180.4062 59 L 4.8104 10.3098 115.8641 53.3726 43.4800 182.4741 60 G 5.0347 7.3963 123.4613 47.2624 0.0000 173.1395 61 E 3.8913 7.4625 118.2594 57.8689 29.1595 180.2808 62 N 4.5028 8.9761 121.2531 51.6457 36.7153 172.2039 63 G 3.5273 8.0190 110.6144 47.0357 0.0000 176.7264 64 R 3.8350 8.3773 121.9166 59.8619 29.0402 181.8285 65 R 3.9325 7.2070 118.2718 62.9954 28.4950 183.5744 66 I 3.8124 8.6577 117.1757 66.1505 35.6813 180.8019 67 N 4.4064 8.4535 120.8483 59.0253 38.5760 178.2747 68 E 4.3844 8.7624 123.7325 60.4648 29.5993 182.1602 69 L 4.1373 9.3670 121.6102 59.9373 41.0724 184.2745 70 T 3.9288 6.5957 114.2217 65.8881 69.8941 178.0332 71 L 4.2471 7.9735 127.6014 60.2053 40.9122 181.2688 72 L 4.1462 8.3196 125.9937 60.5113 40.4972 182.0862 73 V 3.9021 8.1426 122.7640 65.9668 31.6880 181.1335 74 Q 4.3301 8.7653 121.1650 58.8318 27.8047 182.2347 75 K 4.5746 6.1710 123.7285 58.9523 34.4997 181.4852 76 R 3.6462 8.3666 110.9859 58.6126 28.3315 180.7357 *77 F 4.0279 9.4884 123.5055 58.2994 37.4302 176.4290 78 K 4.9727 8.3630 130.1161 53.9021 33.2781 173.6842 *79 Y 4.3804 8.3527 127.7746 54.7112 42.2934 174.5602 80 A 3.4426 9.6259 124.9617 51.2324 18.7908 178.1382 81 P 4.3138 0.0000 0.0000 62.0426 30.6369 176.7939 82 G 4.0977 8.2569 107.7982 47.4433 0.0000 175.7370 83 T 4.5058 7.4835 117.2217 64.6994 68.8477 180.6097 84 I 4.1946 7.7839 124.2240 61.8545 36.5893 178.1700 85 V 4.3163 8.7565 122.9456 61.1323 36.3920 172.7711 86 L 5.3217 8.7997 129.7728 53.3050 44.6075 172.8970 *87 Y 4.7815 8.3200 117.6284 56.7001 41.7146 174.7967 88 A 4.7307 8.8047 128.6995 51.2314 20.0219 177.2675 89 E 4.6340 8.8054 122.7515 55.5780 33.8272 172.1555 90 R 4.5150 8.4238 119.8807 57.2729 30.2715 174.7956 91 V 3.7382 8.2116 126.7632 61.0637 32.6866 173.6095 92 Q 4.2255 8.6228 122.0861 55.6905 28.6914 179.2855 93 D 4.5301 8.9074 116.3641 56.9748 37.1195 177.5372 94 R 2.6623 8.1806 118.2394 54.8056 31.9201 177.1836 95 G 3.9718 7.3519 120.8714 49.1815 0.0000 174.0096 96 L 4.3692 9.9308 130.1970 55.3975 44.2745 173.0690 97 S 3.9503 9.4556 112.3841 60.6932 59.1968 169.6033 98 A 3.7263 7.3303 125.7207 54.0425 18.8051 181.0568 99 V 3.6387 7.5649 111.3886 62.7426 34.2602 181.0419 100 A 4.4046 8.7789 119.7950 54.8546 17.9485 179.7827 101 Q 4.1473 9.4293 129.4364 58.5259 28.6518 179.0147 102 A 4.3451 7.9215 123.6667 56.5464 18.7641 180.0149 103 E 4.0091 8.2305 118.3174 62.5271 29.3171 180.9576 104 S 4.3386 8.6465 120.9762 63.3787 61.9213 179.9144 105 M 4.4357 8.8286 124.4835 60.9708 31.4041 181.7256 106 K 4.1748 7.8955 126.0554 59.9660 32.1731 180.2198 *107 F 4.8238 9.6057 121.9618 59.6308 38.4207 179.6751 108 K 4.5050 8.7218 125.9910 59.9628 32.0081 184.2781 109 L 4.2804 7.9888 122.3189 57.9119 40.6738 181.1898 110 L 4.0148 7.8414 120.0479 58.0245 41.1918 180.4886 111 N 4.5050 8.2533 116.9213 53.5367 37.8267 177.4641 112 G 4.1364 8.9256 116.1008 46.4823 0.0000 174.7073 113 L 3.6809 8.1630 118.1984 53.7495 41.2713 178.2150 114 A 3.9841 8.9468 128.3469 52.6404 18.3241 179.1980 115 I 4.1083 8.4724 121.6238 61.4305 34.2011 175.2664 116 R 4.3490 7.9311 127.1436 61.5575 29.2801 181.7736 117 R 4.1607 7.7595 119.8703 60.0563 28.6852 179.7912 118 A 3.9732 8.1579 117.1012 56.9076 18.1788 179.1699 119 A 4.2642 8.0476 119.1881 55.7686 18.7060 179.6774 *120 Y 4.1018 7.5067 119.0768 63.0417 36.4720 180.4195 121 G 3.9982 8.4491 108.1321 46.9065 0.0000 176.3557 122 V 3.8389 7.7097 122.4982 66.6876 32.0767 180.9290 123 V 3.8672 8.3213 122.2523 67.0442 32.0119 179.6623 124 R 4.9965 8.5909 125.6294 57.8680 27.3314 178.1123 *125 Y 5.0482 7.3311 123.3542 59.3100 45.5433 180.2260 126 V 3.6278 8.2944 120.0191 64.5404 31.8334 179.7656 127 M 4.2021 7.7919 119.9380 58.0035 31.5371 180.3338 128 E 4.2038 8.3349 116.5766 59.6794 30.1237 182.0894 129 S 4.4900 8.4038 114.8798 57.8665 61.9259 174.3129 130 G 3.7791 7.9904 116.5593 47.2267 0.0000 174.6605 131 A 4.4992 8.6936 133.4735 56.7625 21.3488 177.5671 132 K 3.9057 8.2462 119.2585 56.0047 29.6489 177.3507 133 G 4.7743 7.6728 117.2348 46.1016 0.0000 172.7249 134 C 5.2019 7.7622 119.4368 58.8263 31.5234 171.0286 135 E 5.4099 8.2238 124.1358 55.1427 31.8233 174.3530 136 V 5.6771 7.6692 122.1591 63.9675 32.7308 169.2409 137 V 4.1545 7.5468 128.4747 61.3706 33.9245 175.7235 138 V 4.5328 8.5952 124.7858 59.7299 33.7514 177.7881 139 S 5.2166 8.0309 124.5125 56.5111 63.5720 169.3288 140 G 4.3399 7.6112 116.2925 45.0010 0.0000 173.3712 141 K 4.3757 8.4716 121.2710 53.4776 29.9329 170.4681 142 L 3.9286 8.3462 126.2721 55.1060 40.2290 178.5537 143 R 3.5220 8.4071 122.9038 55.3642 28.5166 173.6810 144 A 4.0378 8.5574 115.3167 53.5139 18.9728 178.0405 145 A 4.4547 7.9615 126.3240 53.8507 24.3159 175.3004 146 R 4.7734 7.8786 119.8191 56.0093 27.9314 176.0363 147 A 4.7008 8.2790 119.1679 52.5580 21.9194 177.1380 148 K 4.1472 7.4824 117.9798 55.0429 37.3224 173.9252 149 A 5.0239 8.4333 118.5260 53.9506 22.6906 176.2693 150 M 4.7565 8.7765 119.3015 54.8842 35.9818 174.7447 151 K 4.8041 9.1217 128.4332 56.3595 34.9989 175.7062 *152 F 5.1445 8.0357 124.7270 58.6709 41.5905 167.9445 153 A 4.7199 7.9057 135.0000 51.3933 25.1863 176.5255 154 D 4.8186 8.8808 130.2153 55.4770 40.0131 175.0091 155 G 4.9729 8.5013 120.0050 45.4234 0.0000 173.9083 *156 F 4.3890 8.6776 124.0204 56.3914 41.4799 173.8262 157 L 4.1739 9.6286 119.5070 52.3130 37.9774 167.5438 158 I 3.1334 8.2434 127.3916 60.4102 35.6063 178.1179 *159 H 4.5779 8.7451 128.7078 54.2109 26.2882 171.5466 160 S 4.7717 7.4531 120.6328 57.5432 64.9584 176.2471 161 G 4.2733 8.5069 107.1200 48.5838 0.0000 176.4508 162 Q 4.2562 7.9792 122.4531 56.1450 26.5118 178.9332 163 P 3.9793 0.0000 0.0000 63.2276 31.1136 179.2034 *164 V 3.9686 8.2720 112.5970 62.9699 30.0447 174.0782 165 N 4.6504 8.7300 130.0083 54.0165 37.3701 178.2747 166 D 4.4661 7.8559 115.9459 52.8504 35.9826 177.9318 *167 F 5.1436 8.0354 129.7616 58.2755 37.1351 175.6323 168 I 4.4594 7.0940 132.3308 60.0866 35.2430 178.7910 169 D 5.1583 8.3844 134.3574 53.0550 38.7290 174.8167 170 T 4.6714 7.6962 114.1019 61.3585 70.3775 177.1211 171 A 4.7053 8.5327 125.8669 51.7440 23.0732 176.0749 172 T 4.9070 8.6132 116.0071 60.8468 71.3825 175.5530 173 R 4.5974 8.6869 125.5496 58.0639 34.0293 176.2678 *174 H 4.2279 9.2340 119.9540 57.1892 28.7671 173.7954 175 V 3.4498 9.2051 115.5156 62.5328 28.4483 175.3559 176 L 4.5876 7.2078 126.3817 53.7043 39.7304 178.2943 177 M 4.4748 8.0975 126.6870 54.2805 32.6579 179.1610 178 R 4.1995 8.4771 116.3182 60.5031 29.8290 175.9871 179 Q 4.4203 7.9769 113.3931 56.8567 29.3924 181.6114 180 G 4.0829 6.9974 110.4595 47.1442 0.0000 176.2281 181 V 5.0010 8.3738 124.1903 58.7848 32.9221 173.6441 182 L 3.9722 8.0391 126.1130 54.5416 41.7253 175.4389 183 G 4.3262 8.3966 112.9400 47.3643 0.0000 172.8877 184 I 4.4341 7.8457 127.5289 60.4098 37.8477 173.1328 185 K 4.8362 8.2975 130.3355 56.1713 34.4279 176.3795 186 V 4.6687 8.3672 128.4784 60.2220 34.1295 173.4153 187 K 4.7650 9.0105 125.2666 55.1114 36.2102 177.2914 188 I 4.7646 8.1254 120.4940 60.4613 39.3279 177.6492 189 M 4.1315 8.7485 127.3033 55.4497 31.4320 177.9384 190 R 3.2141 8.3499 118.0073 58.0563 28.4641 182.5246 191 D 4.4125 8.8286 118.7892 55.7029 39.4058 173.2069 192 P 4.3232 0.0000 0.0000 61.5585 30.3713 173.7308 193 A 3.8255 9.5103 125.4152 53.8744 15.9047 178.1322 194 K 4.0918 8.0847 120.4775 55.0243 33.9085 176.8390 195 S 4.2818 8.6757 120.8163 57.7300 62.1068 168.4550 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 7 K 8.41 4.36 0.00 1.79 1.80 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 8 K 8.32 3.74 0.00 1.86 1.44 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.07 7.81 9 R 10.07 4.23 0.00 1.82 1.41 0.00 3.38 0.00 0.00 3.26 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 10 K 9.51 3.66 0.00 1.74 0.83 0.00 1.80 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 0.98 7.81 11 L 8.68 3.83 0.00 1.56 1.64 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.70 3.72 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 0.69 0.00 0.00 0.93 0.00 0.00 13 A 8.09 4.27 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 14 D 9.30 4.53 0.00 2.60 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 15 G 8.17 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 0.00 0.00 0.00 16 V 8.92 4.48 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 0.77 0.00 0.00 0.93 0.00 0.00 *17 F 8.66 4.43 0.00 2.42 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 0.00 0.00 0.00 0.00 *18 Y 8.81 4.19 0.00 2.26 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 0.00 0.00 0.00 19 A 6.66 4.14 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 20 E 8.53 3.89 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.92 0.00 21 L 8.48 4.24 0.00 1.62 1.62 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.23 4.18 0.00 2.85 2.74 0.00 0.00 6.48 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 23 E 8.57 3.87 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 *24 F 8.30 4.35 0.00 2.27 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 0.00 0.00 0.00 0.00 *25 F 7.90 4.40 0.00 2.40 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 0.00 0.00 0.00 26 T 9.60 4.59 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 27 R 7.41 4.30 0.00 1.84 1.88 0.00 3.25 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.44 0.00 28 E 8.82 4.16 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.87 0.00 29 L 8.03 4.63 0.00 1.51 1.62 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.21 4.08 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 31 E 8.38 4.12 0.00 2.00 1.89 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 2.23 1.88 0.00 32 E 8.48 4.45 0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 33 G 8.08 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *34 Y 8.07 4.55 0.00 2.35 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 0.00 0.00 0.00 35 S 8.36 4.71 0.00 3.56 3.69 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 36 G 8.15 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 37 V 7.20 4.88 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 0.64 0.00 0.00 0.93 0.00 0.00 38 E 8.29 4.84 0.00 1.59 1.77 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 2.20 1.85 0.00 39 V 8.45 5.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.93 0.00 0.00 40 R 8.51 4.84 0.00 1.43 1.77 0.00 3.16 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.20 0.00 41 V 8.08 5.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.93 0.00 0.00 42 T 9.12 3.86 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 43 P 0.00 4.78 0.00 2.03 1.83 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.53 0.00 44 T 8.40 3.45 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 45 K 7.69 4.90 0.00 1.42 1.72 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.35 0.98 7.81 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0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 55 T 8.31 4.30 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56 Q 8.52 4.48 0.00 1.92 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.83 0.00 0.00 0.00 0.00 0.00 2.24 1.87 0.00 57 D 9.63 5.29 0.00 2.59 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.04 3.88 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 0.86 0.00 0.00 0.93 0.00 0.00 59 L 10.31 4.81 0.00 1.61 1.53 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.40 5.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.46 3.89 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.89 0.00 62 N 8.98 4.50 0.00 2.91 2.87 0.00 0.00 6.98 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.02 3.53 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 64 R 8.38 3.84 0.00 1.75 1.99 0.00 3.28 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.23 0.00 65 R 7.21 3.93 0.00 1.81 1.83 0.00 3.27 0.00 0.00 3.20 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 66 I 8.66 3.81 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.53 0.91 0.00 0.00 67 N 8.45 4.41 0.00 2.73 2.84 0.00 0.00 6.71 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 68 E 8.76 4.38 0.00 1.98 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 69 L 9.37 4.14 0.00 1.65 1.52 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 70 T 6.60 3.93 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 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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 80 A 9.63 3.44 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 81 P 0.00 4.31 0.00 2.26 2.03 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.57 0.00 82 G 8.26 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 83 T 7.48 4.51 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 84 I 7.78 4.19 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.10 0.91 0.00 0.00 85 V 8.76 4.32 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 0.53 0.00 0.00 0.93 0.00 0.00 86 L 8.80 5.32 0.00 1.39 1.43 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 *87 Y 8.32 4.78 0.00 1.98 2.12 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 0.00 0.00 0.00 0.00 105 M 8.83 4.44 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 106 K 7.90 4.17 0.00 1.84 1.79 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.38 7.81 *107 F 9.61 4.82 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.72 4.50 0.00 1.71 1.77 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.30 7.81 109 L 7.99 4.28 0.00 1.65 1.64 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.84 4.01 0.00 1.65 1.57 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 111 N 8.25 4.50 0.00 2.74 2.79 0.00 0.00 7.04 7.09 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 0.00 112 G 8.93 4.14 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 0.00 121 G 8.45 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 0.00 122 V 7.71 3.84 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 0.76 0.00 0.00 0.93 0.00 0.00 123 V 8.32 3.87 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 0.00 124 R 8.59 5.00 0.00 1.89 1.80 0.00 3.26 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 *125 Y 7.33 5.05 0.00 2.18 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 0.00 0.00 0.00 0.00 126 V 8.29 3.63 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 0.82 0.00 0.00 0.93 0.00 0.00 127 M 7.79 4.20 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.38 0.00 128 E 8.33 4.20 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.87 0.00 129 S 8.40 4.49 0.00 3.57 3.76 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 0.00 130 G 7.99 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.69 4.50 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 0.00 132 K 8.25 3.91 0.00 1.77 2.05 0.00 1.91 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.00 7.81 133 G 7.67 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 C 7.76 5.20 0.00 2.54 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.22 5.41 0.00 1.65 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.72 0.00 136 V 7.67 5.68 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 0.89 0.00 0.00 0.93 0.00 0.00 137 V 7.55 4.15 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 0.65 0.00 0.00 0.93 0.00 0.00 138 V 8.60 4.53 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 0.65 0.00 0.00 0.93 0.00 0.00 139 S 8.03 5.22 0.00 3.70 3.68 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 0.00 140 G 7.61 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 0.00 141 K 8.47 4.38 0.00 1.79 1.65 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.00 7.81 142 L 8.35 3.93 0.00 1.65 1.58 0.92 0.92 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 0.00 143 R 8.41 3.52 0.00 1.93 1.82 0.00 3.26 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.17 0.00 144 A 8.56 4.04 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 0.00 145 A 7.96 4.45 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 0.00 146 R 7.88 4.77 0.00 1.84 0.81 0.00 3.25 0.00 0.00 3.23 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.19 0.00 147 A 8.28 4.70 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 K 7.48 4.15 0.00 1.87 1.60 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.13 1.06 7.81 149 A 8.43 5.02 1.18 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 0.00 0.00 150 M 8.78 4.76 0.00 1.68 1.87 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 151 K 9.12 4.80 0.00 1.53 1.60 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.30 1.00 7.81 *152 F 8.04 5.14 0.00 2.31 2.30 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 0.00 153 A 7.91 4.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 D 8.88 4.82 0.00 2.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.50 4.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *156 F 8.68 4.39 0.00 2.27 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 0.00 0.00 0.00 157 L 9.63 4.17 0.00 1.73 1.73 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 158 I 8.24 3.13 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.99 0.91 0.00 0.00 *159 H 8.75 4.58 0.00 2.92 2.94 0.00 7.16 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 S 7.45 4.77 0.00 3.64 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 0.00 161 G 8.51 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 0.00 0.00 0.00 0.00 162 Q 7.98 4.26 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 5.59 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 163 P 0.00 3.98 0.00 2.15 1.67 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 *164 V 8.27 3.97 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 0.86 0.00 0.00 0.93 0.00 0.00 165 N 8.73 4.65 0.00 2.87 2.88 0.00 0.00 6.80 9.00 0.00 0.00 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 D 7.86 4.47 0.00 2.87 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 *167 F 8.04 5.14 0.00 2.40 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 0.00 168 I 7.09 4.46 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.50 0.91 0.00 0.00 169 D 8.38 5.16 0.00 2.43 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 T 7.70 4.67 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 171 A 8.53 4.71 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 0.00 172 T 8.61 4.91 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 173 R 8.69 4.60 0.00 1.40 1.81 0.00 3.24 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 *174 H 9.23 4.23 0.00 2.60 2.79 0.00 7.15 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 9.21 3.45 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 0.62 0.00 0.00 0.93 0.00 0.00 176 L 7.21 4.59 0.00 1.65 1.51 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 177 M 8.10 4.47 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 178 R 8.48 4.20 0.00 1.83 1.87 0.00 3.22 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 179 Q 7.98 4.42 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.25 1.92 0.00 180 G 7.00 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 0.00 0.00 0.00 181 V 8.37 5.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.93 0.00 0.00 182 L 8.04 3.97 0.00 1.66 1.55 0.92 0.93 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 0.00 183 G 8.40 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 I 7.85 4.43 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.74 0.91 0.00 0.00 185 K 8.30 4.84 0.00 1.53 1.69 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.78 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.28 1.10 7.81 186 V 8.37 4.67 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 0.67 0.00 0.00 0.93 0.00 0.00 187 K 9.01 4.76 0.00 1.43 1.53 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 1.24 7.81 188 I 8.13 4.76 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.66 0.91 0.00 0.00 189 M 8.75 4.13 0.00 1.86 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.37 0.00 190 R 8.35 3.21 0.00 1.91 1.62 0.00 3.26 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.17 0.00 191 D 8.83 4.41 0.00 2.59 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 0.00 192 P 0.00 4.32 0.00 2.08 1.94 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.58 0.00 193 A 9.51 3.83 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 0.00 194 K 8.08 4.09 0.00 1.74 1.59 0.00 1.92 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.26 0.98 7.81 195 S 8.68 4.28 0.00 3.80 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.