NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 D 4.5839 8.2233 120.1884 53.1301 41.2174 175.3675 -1 P 4.0758 0.0000 0.0000 64.8077 31.7923 176.7211 0 M 4.1391 7.6271 115.6567 58.5735 33.3932 179.7414 1 V 4.3550 7.4897 118.6238 61.8901 31.0128 176.1017 2 S 4.4011 7.8964 113.4881 60.6298 64.2136 175.0128 3 K 3.9511 7.4989 119.1071 59.5718 32.1501 178.3161 4 G 3.9494 8.1226 104.9668 48.2022 0.0000 174.2956 5 E 3.9915 8.2517 121.2933 58.9972 29.3890 178.7787 6 E 3.9989 8.5067 117.7942 59.2248 29.6926 178.4028 7 L 3.9303 7.7449 117.6226 56.1786 40.9616 177.5877 8 F 4.8936 8.0406 117.0527 57.2217 39.7159 177.2238 9 T 4.1258 8.2097 112.6862 63.4541 69.0820 173.7241 10 G 4.4385 7.0788 107.7395 43.5580 0.0000 171.6297 11 V 4.1371 8.3696 119.5773 62.6581 32.4517 176.6372 12 V 4.6262 8.8727 128.4270 60.1346 34.0843 172.9712 13 P 4.8319 0.0000 0.0000 63.0909 32.7310 175.1905 14 I 5.1220 8.8223 122.7556 59.4430 41.2414 174.0346 15 L 5.1434 8.7008 127.3264 53.2383 45.0970 175.2216 16 V 5.1018 9.2771 125.6598 61.2779 35.2102 173.9754 17 E 5.2898 9.2012 125.4356 54.6812 34.1269 174.1936 18 L 5.2144 9.2739 125.4611 53.5039 45.9317 174.4420 19 D 5.1009 9.0987 126.3231 52.4858 43.2576 175.5507 20 G 3.1862 8.6379 110.7982 43.9106 0.0000 171.5735 21 D 4.9560 8.3573 122.6244 52.8248 44.5505 174.1939 22 V 4.6255 8.7738 127.4096 61.1704 33.9019 175.2046 23 N 4.3951 10.4323 127.6432 54.3258 36.6353 175.8710 24 G 3.8620 8.7898 105.9917 45.5476 0.0000 174.0284 25 H 4.5133 8.1100 118.2490 55.0677 28.7394 174.2884 26 K 5.2088 8.3250 124.4157 55.1968 33.9897 175.9944 27 F 4.9167 8.1855 116.0852 56.3482 41.6264 172.9478 28 S 5.2653 8.9184 115.8160 56.8919 66.9954 173.2893 29 V 5.1845 8.8798 122.1953 61.4614 35.0483 174.1065 30 S 5.2728 9.2265 123.6968 56.7767 65.4817 173.3519 31 G 4.1340 9.6385 111.9114 44.3550 0.0000 171.5775 32 E 5.0571 8.6023 121.4906 53.9094 33.9683 175.5578 33 G 4.0848 8.0408 110.6694 45.9599 0.0000 171.8592 34 E 4.9587 8.1706 120.2511 55.0088 33.5809 174.9404 35 G 3.2735 8.7690 107.8074 44.2668 0.0000 171.4644 36 D 5.1012 9.2727 122.2770 51.5459 41.6390 175.7819 37 A 4.5385 9.0415 126.9944 54.6334 19.1247 180.1973 38 T 3.7031 8.1751 112.0464 66.3154 68.4801 174.6592 39 Y 4.6032 7.9625 115.8990 56.8269 38.3395 175.6056 40 G 4.2375 8.0635 108.0755 46.4445 0.0000 172.8791 41 K 4.5586 8.1116 119.8595 54.0574 34.7451 174.5559 42 L 5.0189 8.4071 126.5640 53.1283 45.8803 175.6291 43 T 4.8878 8.6330 119.0161 61.7858 71.9887 173.0224 44 L 4.9764 8.9943 126.1195 52.5741 46.5344 175.3726 45 K 4.6563 8.3900 123.6267 54.5548 34.9661 174.6532 46 F 5.2353 8.7791 126.2626 55.9207 41.7675 174.8420 47 I 5.1799 9.0534 122.6681 59.6900 41.0381 174.1355 48 C 5.1819 9.5797 128.3858 59.2757 31.5061 173.2230 49 T 4.5875 8.9617 116.9409 62.2614 68.9618 175.5067 50 T 4.4835 8.0946 111.2840 60.8607 70.8562 173.8753 51 G 4.1180 7.7741 107.6171 44.4438 0.0000 176.0810 52 K 4.1973 8.6729 127.6763 55.2793 32.5055 175.9875 53 L 3.6592 9.0770 129.8368 54.3241 42.1472 174.9352 54 P 4.3152 0.0000 0.0000 63.5316 31.8969 175.8331 55 V 4.0882 6.3437 111.0364 58.2751 35.3751 173.2996 56 P 4.4129 0.0000 0.0000 62.2011 32.0519 177.6267 57 W 4.3324 9.1900 123.2860 59.8479 28.9182 176.6695 58 P 4.5634 0.0000 0.0000 66.1269 30.4917 178.5440 59 T 4.1445 8.0229 107.5392 64.0093 68.9296 175.5873 60 L 4.2583 7.8561 120.3152 54.5081 40.3488 178.4249 61 V 3.6327 7.6950 120.5884 66.4005 31.3066 178.0656 62 T 4.2011 7.9658 107.4338 64.9595 68.6822 176.1969 63 T 4.0908 7.1411 117.3264 66.1115 69.5850 176.9289 64 F 4.8178 7.8050 119.6312 56.8701 37.5216 176.3447 *68 L 4.3743 7.4842 116.9537 55.2495 43.2973 179.0711 69 M 3.9307 7.7616 119.0875 57.6224 32.5211 178.9805 70 C 4.0659 7.5693 112.5590 60.2783 29.7666 174.3568 71 F 4.4804 8.0418 118.7355 57.2978 38.8264 175.1520 72 A 4.2673 7.6441 123.7784 51.6838 19.2082 177.9240 73 R 4.1701 8.8677 122.7409 56.5324 31.0734 174.9689 74 Y 4.5289 8.5600 125.2753 55.8121 39.0802 174.1297 75 P 4.1915 0.0000 0.0000 62.7766 32.2489 176.5284 76 D 4.4344 9.0589 121.5360 57.9109 41.0300 178.3464 77 H 4.4306 8.2075 111.8898 57.5527 28.9188 175.4528 78 M 4.7580 8.2642 119.5362 54.9498 32.5009 177.5748 79 K 4.1566 7.9037 121.2476 59.3468 32.2509 178.9200 80 Q 4.0317 7.9047 116.0140 57.8832 28.6919 176.2417 81 H 4.6636 8.0670 114.4049 55.8681 29.4020 175.5895 82 D 3.6769 7.0199 120.7043 52.1278 39.7839 176.1260 83 F 3.8775 8.1074 126.1084 60.6052 39.3938 175.8965 84 F 3.9376 7.4689 115.4463 60.7944 39.0622 177.4956 85 K 4.0822 8.1215 117.9055 59.2523 31.6049 179.6399 86 S 4.0897 7.3785 113.4688 60.6827 63.2100 175.5078 87 A 4.1007 7.4982 122.6457 52.2080 18.4009 176.5759 88 M 4.8219 7.3073 117.4752 53.1929 33.5141 174.6741 89 P 4.8297 0.0000 0.0000 63.8528 32.2799 178.0114 90 E 3.8819 8.1564 118.8230 57.8078 29.9094 177.1015 91 G 3.8721 9.9930 105.4857 44.3575 0.0000 171.1083 92 Y 5.3722 7.8889 114.6313 55.5937 42.0037 174.2366 93 V 4.6359 9.2489 122.1972 62.2911 33.3939 174.3060 94 Q 5.3238 9.1950 129.0591 54.5023 31.5746 173.8143 95 E 5.3099 9.3672 125.9583 54.8596 33.0762 175.3247 96 R 5.2914 8.8809 120.5033 55.0865 35.5099 173.9929 97 T 4.8676 8.7774 116.7641 61.7931 72.3206 173.2863 98 I 4.3327 8.6248 126.4418 59.4640 40.2960 174.7211 99 F 4.7110 8.8005 127.8753 55.7855 40.3624 175.6133 100 F 4.7468 8.7732 124.7585 56.2780 39.7531 175.5493 101 K 3.8264 8.6455 125.1098 58.3236 32.1667 175.5420 102 D 4.4844 8.9095 124.4719 54.8525 38.7417 172.7448 103 D 4.3591 8.0353 118.2137 53.4352 43.7891 173.8726 104 G 2.7141 7.4949 105.8045 45.5890 0.0000 172.0172 105 N 5.6122 8.2876 115.8640 51.2636 40.8497 173.3731 106 Y 5.5322 8.7281 118.7993 57.0627 40.6514 174.6764 107 K 5.1804 9.3449 122.0472 54.8754 35.8818 175.4554 108 T 5.1704 9.0969 114.6035 59.9462 72.7021 172.9297 109 R 5.1127 8.9435 122.7005 54.8654 33.6282 173.5541 110 A 5.3658 9.2243 127.6067 50.1762 22.9089 174.2298 111 E 5.0726 9.2388 120.3679 54.5038 32.6166 175.2112 112 V 4.7641 8.3291 125.3507 61.0514 33.9888 174.4772 113 K 4.6108 8.5331 125.6334 56.0038 36.3654 174.3502 114 F 4.5711 8.4599 119.5731 57.2108 39.8102 175.8999 115 E 4.5261 9.2988 123.2484 54.9865 31.3893 176.6834 116 G 3.8805 8.2423 116.6663 47.2021 0.0000 173.8253 117 D 4.6480 8.8426 123.6635 55.1522 41.4010 175.9148 118 T 4.6466 7.6735 118.0424 62.3917 70.4309 173.5832 119 L 3.9885 8.8434 129.2620 53.9957 43.4610 175.3503 120 V 4.9028 8.8489 126.5311 61.0451 34.9608 173.8605 121 N 5.2594 9.0195 125.4014 52.1288 41.4140 172.7333 122 R 5.1415 8.9204 126.4028 54.5503 32.4742 175.6728 123 I 5.1523 8.9575 124.6893 59.4643 41.5119 174.2282 124 E 5.0021 9.1569 125.2019 54.3976 32.6426 174.6818 125 L 5.1554 8.9451 126.2672 53.0598 45.4174 175.0525 126 K 4.9685 9.5051 125.2906 54.4835 35.7273 175.2371 127 G 5.0322 9.6227 112.4426 44.5809 0.0000 171.9631 128 I 5.1596 8.6060 116.2412 59.8984 41.6922 174.9400 129 D 4.4950 8.9540 120.5326 55.3434 37.8896 174.4254 130 F 4.3547 8.4144 117.4683 56.8702 39.6761 175.7047 131 K 4.2014 9.6991 124.6116 57.3613 32.2487 178.7414 132 E 3.8463 8.1375 124.8304 59.0511 29.6448 179.0638 133 D 4.9092 7.8839 116.1338 52.8469 40.1182 176.6158 134 G 3.9626 7.9587 110.8053 45.6386 0.0000 174.6972 135 N 4.3309 8.7432 115.1408 55.8108 38.4653 176.4551 136 I 3.8935 7.1098 118.3769 62.9388 38.2991 177.7958 137 L 3.7106 7.6289 121.6302 57.3972 41.7825 178.4289 138 G 3.8289 7.9572 105.7073 44.6687 0.0000 173.4911 139 H 3.9448 7.3729 115.4520 56.8893 26.6413 174.9275 140 K 4.5507 8.3457 115.2065 56.2460 33.7806 177.4885 141 L 4.9964 7.6800 120.4607 53.0781 42.9871 176.5195 142 E 4.1502 8.9559 123.0135 56.4260 30.8447 176.3521 143 Y 4.7115 8.4864 124.7494 55.6010 37.3541 173.2110 144 N 4.8978 7.4971 118.9622 52.4533 40.6355 173.6739 145 Y 4.4391 8.0900 116.4567 56.8723 41.5175 173.3712 146 N 4.8819 8.0387 123.6269 52.0662 40.4963 174.6537 147 S 4.8980 8.2370 116.4070 58.6533 64.4630 173.7017 148 H 4.8970 8.8122 119.7323 54.5486 33.2990 172.9144 149 N 4.9692 8.8562 120.7833 53.1256 39.6475 174.5536 150 V 4.0593 8.4537 122.3891 61.2404 34.4225 173.7580 151 Y 5.0605 8.5519 125.8010 56.9961 39.6519 174.5683 152 I 5.1466 8.8120 125.6179 59.7021 40.0915 174.7119 153 M 5.1969 8.9531 122.7108 53.0142 35.1213 174.4883 154 A 4.2015 8.6273 121.3784 52.3727 19.5932 177.2683 155 D 4.6845 8.7116 120.6130 51.7795 41.6311 176.2797 156 K 4.4754 8.3836 117.0089 56.7254 32.1032 177.7179 157 Q 4.4461 8.1955 118.3249 56.4638 31.1213 176.4719 158 K 4.2518 7.9598 113.3509 55.5706 32.3877 175.8353 159 N 4.2662 8.3148 116.1764 54.4349 37.9451 173.2690 160 G 3.9376 7.5848 105.0238 44.7487 0.0000 171.9670 161 I 4.9442 8.0091 113.6663 58.9576 41.4739 174.8421 162 K 5.0370 8.8655 122.8397 54.8169 35.1777 175.4737 163 V 5.0698 8.8319 122.8055 61.4000 35.3060 173.6947 164 N 5.3848 8.9362 124.8282 52.1175 42.8256 172.7561 165 F 5.0523 7.6049 117.0294 56.5116 41.7078 172.4347 166 K 4.9186 8.9921 118.6610 54.6903 34.8162 175.6081 167 I 4.1607 8.6121 124.9072 59.4619 39.9145 174.6520 168 R 4.9116 8.5699 125.3418 54.8696 31.9467 175.0473 169 H 4.7326 9.1319 122.2504 54.1711 30.9616 174.5101 170 N 4.8693 8.7366 121.0581 53.5420 39.5840 174.4874 171 I 4.8267 8.6400 124.9043 59.7569 38.9375 177.0187 172 E 4.1985 9.1806 122.6279 58.7240 29.4235 177.7552 173 D 4.5181 8.0223 116.6821 53.6088 39.7830 176.8879 174 G 3.9478 8.4041 109.3456 45.3255 0.0000 173.7792 175 S 4.6393 8.2503 114.5541 57.5550 65.0290 172.7246 176 V 4.8908 8.1429 111.4193 59.7454 35.5301 175.2423 177 Q 4.5402 9.4962 126.4712 54.5533 30.5343 174.6311 178 L 4.7251 8.5663 126.9662 54.5572 43.5285 176.1553 179 A 4.5551 9.1242 124.5900 50.1793 21.8471 174.5569 180 D 4.7228 8.9089 123.2777 54.2057 42.7062 174.9046 181 H 4.8590 8.5149 124.7244 54.4544 30.5875 173.9302 182 Y 4.7710 8.8888 121.2139 56.1354 41.0025 174.6520 183 Q 5.1934 9.3187 124.3374 54.6762 33.4057 173.5856 184 Q 5.0662 9.1868 122.4684 54.3724 33.5107 173.7037 185 N 6.2600 9.3529 120.2673 50.7290 42.4463 173.6082 186 T 5.1198 8.4864 111.6945 59.2418 72.5965 171.5529 187 P 4.9424 0.0000 0.0000 63.0243 31.7222 176.7573 188 I 3.9194 9.0469 124.5048 63.9796 37.3643 177.1533 189 G 3.9423 7.8229 107.8087 44.9564 0.0000 172.3247 190 D 4.6781 8.4322 116.5646 53.8426 41.7812 176.3224 191 G 3.9269 7.6770 106.8678 44.6459 0.0000 171.6823 192 P 4.4241 0.0000 0.0000 62.6432 31.8494 176.6968 193 V 4.4775 7.8392 113.5004 59.2688 35.5535 175.2702 194 L 4.1151 8.4489 123.1258 54.4939 41.9469 176.8251 195 L 4.6067 8.3943 123.9312 52.2803 42.6076 174.5394 196 P 4.6999 0.0000 0.0000 61.8017 32.5058 175.9174 197 D 4.6037 8.3839 119.2839 53.8474 41.4884 176.0419 198 N 4.8224 8.5408 118.6445 54.7318 39.2088 174.1016 199 H 5.0805 8.9344 117.9295 55.1365 32.5863 171.3559 200 Y 5.2865 8.5819 115.1615 55.5847 41.8938 173.9509 201 L 4.9703 8.9133 119.9847 53.0914 44.9909 175.7519 202 S 5.0370 8.8816 119.7514 57.6039 64.8798 172.8224 203 Y 5.2442 8.8623 121.9071 56.3695 41.3095 174.8272 204 Q 5.0251 9.0188 120.6864 54.5681 33.4719 174.3373 205 S 5.1975 8.8635 117.2906 56.8819 67.3174 173.2064 206 A 4.7438 9.2693 125.1587 50.2245 21.7448 174.8115 207 L 5.1641 8.5594 122.7183 53.4594 44.0433 175.8778 208 S 4.8758 8.9113 116.1554 57.6516 67.0651 172.5716 209 K 4.9603 8.4933 118.1459 54.5065 35.5279 175.8472 210 D 4.6008 8.8835 122.9456 52.4915 41.5739 175.5806 211 P 4.3187 0.0000 0.0000 65.2690 31.4311 176.6865 212 N 4.5831 8.6501 115.0146 52.9786 38.9182 174.0950 213 E 4.3894 7.7966 120.6233 54.5751 30.2558 175.6929 214 K 4.2747 8.4683 125.3204 57.4031 32.9958 177.4066 215 R 4.2693 7.9133 117.7584 55.3622 30.9067 175.3875 216 D 4.8682 8.6287 120.0798 54.6869 42.2295 174.7363 217 H 4.9892 8.5456 119.9018 54.9807 31.8935 172.2556 218 M 4.5007 7.9318 117.5575 53.0574 35.9266 173.4173 219 V 4.6884 8.6122 125.7999 61.1475 33.9339 174.0267 220 L 5.2683 9.2595 129.6693 53.1070 45.4700 174.5483 221 L 5.0733 8.9943 127.8363 53.2727 45.0654 174.7786 222 E 5.2365 8.8842 124.9600 54.5374 33.6575 174.6745 223 F 5.3701 9.1302 121.9029 55.7422 42.4822 174.6120 224 V 5.1680 8.8687 122.4233 60.6494 34.9688 174.0352 225 T 4.9241 8.1188 122.7113 61.5269 72.6540 173.1103 226 A 4.2404 8.5675 128.1003 52.1270 19.3537 176.4579 227 A 3.9950 8.4509 121.7392 51.1868 23.1108 177.3800 228 G 4.1810 9.3518 105.3882 45.9155 0.0000 174.5239 229 I 4.6618 7.0054 118.1510 59.2000 37.6763 175.3821 230 T 4.0424 7.9161 113.2335 61.9527 68.4221 175.0522 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 -2 D 8.22 4.58 0.00 2.67 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 -1 P 0.00 4.08 0.00 2.14 2.11 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 2.02 2.12 0.00 0 M 7.63 4.14 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 1 V 7.49 4.36 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 0.67 0.00 0.00 0.89 0.00 0.00 2 S 7.90 4.40 0.00 3.94 3.82 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 3 K 7.50 3.95 0.00 1.90 1.77 0.00 2.06 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.42 7.81 4 G 8.12 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 0.00 0.00 0.00 5 E 8.25 3.99 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 6 E 8.51 4.00 0.00 2.17 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 2.28 2.34 0.00 7 L 7.74 3.93 0.00 1.64 0.88 0.41 0.19 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 8 F 8.04 4.89 0.00 3.18 3.11 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 9 T 8.21 4.13 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 10 G 7.08 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 11 V 8.37 4.14 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 0.76 0.00 0.00 0.98 0.00 0.00 12 V 8.87 4.63 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 1.14 0.00 0.00 13 P 0.00 4.83 0.00 2.15 2.15 0.00 3.91 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 2.21 2.02 0.00 14 I 8.82 5.12 1.76 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 0.97 0.00 0.00 15 L 8.70 5.14 0.00 1.72 1.46 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 16 V 9.28 5.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 1.10 0.00 0.00 17 E 9.20 5.29 0.00 1.93 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 2.25 2.41 0.00 18 L 9.27 5.21 0.00 1.98 1.79 0.81 1.31 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 19 D 9.10 5.10 0.00 2.55 2.44 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 20 G 8.64 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.36 4.96 0.00 2.57 2.41 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 22 V 8.77 4.63 2.05 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 0.56 0.00 0.00 0.90 0.00 0.00 23 N 10.43 4.40 0.00 2.96 2.96 0.00 0.00 7.21 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 24 G 8.79 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.11 4.51 0.00 3.35 3.29 0.00 5.60 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.32 5.21 0.00 1.65 1.70 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.22 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.41 7.81 27 F 8.19 4.92 0.00 3.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.92 5.27 0.00 3.83 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 29 V 8.88 5.18 2.53 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 1.43 0.00 0.00 1.26 0.00 0.00 30 S 9.23 5.27 0.00 3.85 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 31 G 9.64 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 32 E 8.60 5.06 0.00 1.72 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 33 G 8.04 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 34 E 8.17 4.96 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 35 G 8.77 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.27 5.10 0.00 2.78 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 37 A 9.04 4.54 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.18 3.70 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 0.46 0.00 0.00 39 Y 7.96 4.60 0.00 3.12 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.06 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 41 K 8.11 4.56 0.00 1.87 1.70 0.00 1.32 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 0.89 7.81 42 L 8.41 5.02 0.00 1.52 1.35 0.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.63 4.89 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 1.09 0.00 0.00 44 L 8.99 4.98 0.00 1.37 0.63 1.11 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.39 4.66 0.00 1.60 1.39 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.73 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.14 1.25 7.81 46 F 8.78 5.24 0.00 2.58 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 47 I 9.05 5.18 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.98 0.99 0.00 0.00 48 C 9.58 5.18 0.00 3.14 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 49 T 8.96 4.59 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 1.32 0.00 0.00 50 T 8.09 4.48 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 51 G 7.77 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 52 K 8.67 4.20 0.00 1.71 1.69 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.37 7.81 53 L 9.08 3.66 0.00 1.03 1.03 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.32 0.00 1.94 1.99 0.00 2.38 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.91 0.00 55 V 6.34 4.09 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 0.36 0.00 0.00 0.39 0.00 0.00 56 P 0.00 4.41 0.00 2.16 2.02 0.00 3.38 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 57 W 9.19 4.33 0.00 3.73 3.46 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 58 P 0.00 4.56 0.00 2.26 2.37 0.00 3.78 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.22 0.00 59 T 8.02 4.14 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 1.04 0.00 0.00 60 L 7.86 4.26 0.00 1.61 0.54 0.70 0.48 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 61 V 7.69 3.63 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 0.50 0.00 0.00 0.96 0.00 0.00 62 T 7.97 4.20 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 63 T 7.14 4.09 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 1.09 0.00 0.00 64 F 7.81 4.82 0.00 2.93 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 *68 L 7.48 4.37 0.00 1.98 2.15 1.07 1.13 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 69 M 7.76 3.93 0.00 0.58 0.89 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 70 C 7.57 4.07 0.00 2.35 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 71 F 8.04 4.48 0.00 3.32 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 72 A 7.64 4.27 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 73 R 8.87 4.17 0.00 2.12 1.81 0.00 3.04 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 74 Y 8.56 4.53 0.00 2.82 2.87 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 75 P 0.00 4.19 0.00 1.86 1.97 0.00 3.43 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 1.98 2.01 0.00 76 D 9.06 4.43 0.00 2.75 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 77 H 8.21 4.43 0.00 3.31 3.42 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.26 4.76 0.00 2.14 2.11 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 2.18 2.49 0.00 79 K 7.90 4.16 0.00 1.74 1.81 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.75 7.81 80 Q 7.90 4.03 0.00 1.85 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 81 H 8.07 4.66 0.00 3.28 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.02 3.68 0.00 1.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.11 3.88 0.00 2.99 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 0.00 0.00 0.00 0.00 84 F 7.47 3.94 0.00 3.16 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 85 K 8.12 4.08 0.00 1.65 1.80 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.36 1.08 7.81 86 S 7.38 4.09 0.00 3.84 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 87 A 7.50 4.10 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 88 M 7.31 4.82 0.00 2.41 2.42 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.10 3.01 0.00 89 P 0.00 4.83 0.00 2.27 2.13 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.91 0.00 90 E 8.16 3.88 0.00 1.99 2.09 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 2.33 2.39 0.00 91 G 9.99 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 0.00 0.00 0.00 92 Y 7.89 5.37 0.00 3.40 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 93 V 9.25 4.64 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.02 0.00 0.00 94 Q 9.19 5.32 0.00 2.56 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 95 E 9.37 5.31 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 96 R 8.88 5.29 0.00 1.74 1.72 0.00 3.12 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 97 T 8.78 4.87 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 0.25 0.00 0.00 98 I 8.62 4.33 1.61 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 0.71 0.89 -0.16 0.00 0.00 99 F 8.80 4.71 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.77 4.75 0.00 3.15 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.65 3.83 0.00 1.73 1.82 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.52 7.81 102 D 8.91 4.48 0.00 2.85 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.04 4.36 0.00 2.59 2.53 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 0.00 104 G 7.49 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.29 5.61 0.00 2.57 2.79 0.00 0.00 7.37 6.85 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 0.00 106 Y 8.73 5.53 0.00 2.94 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 0.00 107 K 9.34 5.18 0.00 1.64 1.66 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.28 1.45 7.81 108 T 9.10 5.17 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 109 R 8.94 5.11 0.00 1.89 1.77 0.00 3.15 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 110 A 9.22 5.37 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 0.00 111 E 9.24 5.07 0.00 1.89 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 2.25 2.24 0.00 112 V 8.33 4.76 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 0.00 0.00 0.68 0.00 0.00 0.97 0.00 0.00 113 K 8.53 4.61 0.00 1.98 1.79 0.00 1.38 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.26 1.38 7.81 114 F 8.46 4.57 0.00 2.99 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 9.30 4.53 0.00 1.94 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 2.21 2.36 0.00 116 G 8.24 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 0.00 117 D 8.84 4.65 0.00 2.71 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 0.00 118 T 7.67 4.65 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 119 L 8.84 3.99 0.00 1.26 1.56 1.04 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.85 4.90 2.05 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 0.97 0.00 0.00 0.91 0.00 0.00 121 N 9.02 5.26 0.00 2.94 2.76 0.00 0.00 6.94 7.69 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 0.00 122 R 8.92 5.14 0.00 1.81 1.84 0.00 3.13 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 123 I 8.96 5.15 1.94 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 1.32 0.83 0.91 0.00 0.00 124 E 9.16 5.00 0.00 1.85 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 2.34 0.00 125 L 8.95 5.16 0.00 1.45 1.18 0.43 -0.28 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 0.00 126 K 9.51 4.97 0.00 1.70 1.68 0.00 1.48 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.34 1.39 7.81 127 G 9.62 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 0.00 128 I 8.61 5.16 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 1.29 0.87 0.98 0.00 0.00 129 D 8.95 4.49 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.41 4.35 0.00 3.24 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 0.00 131 K 9.70 4.20 0.00 1.84 1.77 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.41 7.81 132 E 8.14 3.85 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 2.35 2.33 0.00 133 D 7.88 4.91 0.00 2.73 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.96 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 0.00 135 N 8.74 4.33 0.00 2.87 2.88 0.00 0.00 6.79 7.21 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 0.00 136 I 7.11 3.89 1.67 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.13 0.22 0.00 0.00 137 L 7.63 3.71 0.00 1.78 1.70 0.96 0.57 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 0.00 138 G 7.96 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 0.00 139 H 7.37 3.94 0.00 3.23 3.27 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.35 4.55 0.00 1.81 1.81 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.53 7.81 141 L 7.68 5.00 0.00 1.56 1.63 0.83 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.96 4.15 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 143 Y 8.49 4.71 0.00 3.12 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 0.00 144 N 7.50 4.90 0.00 2.85 2.83 0.00 0.00 6.09 7.55 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 0.00 145 Y 8.09 4.44 0.00 2.92 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 0.00 146 N 8.04 4.88 0.00 2.56 2.55 0.00 0.00 7.01 7.57 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 0.00 147 S 8.24 4.90 0.00 3.76 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 0.00 148 H 8.81 4.90 0.00 3.12 3.08 0.00 5.81 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.86 4.97 0.00 2.22 1.94 0.00 0.00 6.80 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 0.00 150 V 8.45 4.06 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 0.89 0.00 0.00 -0.21 0.00 0.00 151 Y 8.55 5.06 0.00 3.20 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 I 8.81 5.15 1.67 0.00 0.00 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 1.46 0.76 0.93 0.00 0.00 153 M 8.95 5.20 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 154 A 8.63 4.20 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 0.00 155 D 8.71 4.68 0.00 2.64 2.42 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 0.00 156 K 8.38 4.48 0.00 1.78 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 157 Q 8.20 4.45 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 158 K 7.96 4.25 0.00 1.76 1.84 0.00 1.94 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.65 7.81 159 N 8.31 4.27 0.00 2.83 2.89 0.00 0.00 6.77 7.98 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 0.00 160 G 7.58 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 0.00 0.00 0.00 161 I 8.01 4.94 1.64 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.13 0.21 0.00 0.00 162 K 8.87 5.04 0.00 1.70 1.76 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.33 7.81 163 V 8.83 5.07 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 1.09 0.00 0.00 164 N 8.94 5.38 0.00 2.57 2.54 0.00 0.00 6.58 7.60 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 0.00 165 F 7.60 5.05 0.00 2.98 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 0.00 166 K 8.99 4.92 0.00 1.66 1.72 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.74 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.28 1.37 7.81 167 I 8.61 4.16 1.79 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.10 0.45 0.00 0.00 168 R 8.57 4.91 0.00 1.68 1.83 0.00 3.22 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 169 H 9.13 4.73 0.00 3.15 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.74 4.87 0.00 2.90 2.86 0.00 0.00 7.10 7.47 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 0.00 171 I 8.64 4.83 2.07 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 1.32 0.73 1.02 0.00 0.00 172 E 9.18 4.20 0.00 2.10 2.28 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 2.33 2.23 0.00 173 D 8.02 4.52 0.00 2.80 2.83 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 0.00 174 G 8.40 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 0.00 0.00 0.00 175 S 8.25 4.64 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 0.00 176 V 8.14 4.89 2.09 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 0.75 0.00 0.00 0.94 0.00 0.00 177 Q 9.50 4.54 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.01 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 178 L 8.57 4.73 0.00 1.67 1.56 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 179 A 9.12 4.56 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 0.00 180 D 8.91 4.72 0.00 3.02 2.83 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 0.00 181 H 8.51 4.86 0.00 1.73 2.18 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.89 4.77 0.00 3.01 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 0.00 183 Q 9.32 5.19 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.57 0.00 184 Q 9.19 5.07 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 185 N 9.35 6.26 0.00 2.32 2.68 0.00 0.00 6.37 6.93 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 0.00 186 T 8.49 5.12 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 187 P 0.00 4.94 0.00 2.20 2.05 0.00 3.83 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 188 I 9.05 3.92 2.16 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 1.29 0.57 0.95 0.00 0.00 189 G 7.82 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 0.00 0.00 0.00 190 D 8.43 4.68 0.00 2.63 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 0.00 191 G 7.68 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 0.00 192 P 0.00 4.42 0.00 2.04 1.99 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 193 V 7.84 4.48 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 0.70 0.00 0.00 1.12 0.00 0.00 194 L 8.45 4.12 0.00 1.57 1.68 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.39 4.61 0.00 1.63 1.61 0.92 1.20 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 0.00 196 P 0.00 4.70 0.00 2.32 2.36 0.00 3.71 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 1.99 1.97 0.00 197 D 8.38 4.60 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 0.00 198 N 8.54 4.82 0.00 2.67 2.87 0.00 0.00 6.73 8.16 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 0.00 199 H 8.93 5.08 0.00 3.36 3.34 0.00 5.21 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.58 5.29 0.00 2.71 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.91 4.97 0.00 1.62 1.37 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.88 5.04 0.00 3.76 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 0.00 203 Y 8.86 5.24 0.00 3.04 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 0.00 204 Q 9.02 5.03 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 205 S 8.86 5.20 0.00 3.59 3.45 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 0.00 206 A 9.27 4.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.56 5.16 0.00 1.00 1.01 0.63 0.71 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 0.00 208 S 8.91 4.88 0.00 3.92 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 0.00 209 K 8.49 4.96 0.00 1.59 1.70 0.00 1.31 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.14 1.11 7.81 210 D 8.88 4.60 0.00 2.60 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 P 0.00 4.32 0.00 2.20 2.16 0.00 3.78 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 1.97 1.98 0.00 212 N 8.65 4.58 0.00 2.76 2.85 0.00 0.00 6.84 7.24 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 0.00 213 E 7.80 4.39 0.00 1.88 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 1.78 2.22 0.00 214 K 8.47 4.27 0.00 1.78 1.84 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.38 7.81 215 R 7.91 4.27 0.00 2.02 1.93 0.00 3.19 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 216 D 8.63 4.87 0.00 2.94 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 0.00 217 H 8.55 4.99 0.00 3.20 3.18 0.00 5.54 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 7.93 4.50 0.00 1.33 1.02 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 219 V 8.61 4.69 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 0.82 0.00 0.00 0.91 0.00 0.00 220 L 9.26 5.27 0.00 1.86 1.67 0.84 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.99 5.07 0.00 1.68 1.43 0.59 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 222 E 8.88 5.24 0.00 1.86 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 0.00 2.24 2.25 0.00 223 F 9.13 5.37 0.00 2.93 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 0.00 224 V 8.87 5.17 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 0.19 0.00 0.00 0.29 0.00 0.00 225 T 8.12 4.92 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 0.00 226 A 8.57 4.24 0.02 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 0.00 227 A 8.45 4.00 0.68 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 0.00 0.00 228 G 9.35 4.18 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 0.00 229 I 7.01 4.66 1.85 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 1.46 0.78 0.99 0.00 0.00 230 T 7.92 4.04 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.