NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *3 K 4.3430 8.1614 122.1368 54.6245 34.5916 177.6826 4 G 3.5761 8.0253 106.6444 47.3130 0.0000 172.2401 5 E 4.2269 8.4899 121.8590 59.7901 29.7347 177.8704 *6 E 4.2009 7.6567 116.6365 60.0412 29.9096 181.3652 7 L 4.2168 7.6611 115.4371 56.5818 41.7436 177.8174 8 F 4.9156 7.8147 116.4772 57.1520 40.0032 176.1019 9 T 4.0937 8.2618 109.9927 63.7081 69.1740 174.0340 10 G 4.4406 7.7029 111.1633 44.2023 0.0000 171.5858 11 V 4.1731 8.4333 121.3494 62.6584 32.4808 176.9394 12 V 4.6608 9.0282 128.3406 60.1978 34.2495 173.0446 13 P 4.8392 0.0000 0.0000 62.9728 32.8981 175.0497 14 I 5.0464 8.6338 122.4141 59.5665 40.9133 174.4425 15 L 5.1932 8.8216 125.0472 52.8701 45.4524 175.5888 16 V 4.9578 8.7583 122.9360 61.1499 34.7065 173.9113 17 E 5.2027 9.2386 126.8629 54.4659 33.0153 174.6019 18 L 5.2657 9.1662 126.0109 53.3309 45.7747 174.5249 19 D 5.1556 8.9110 125.7522 52.4672 43.4601 175.5625 20 G 3.9164 8.0391 110.2199 43.9250 0.0000 171.8347 21 D 4.8729 8.0817 119.7700 53.5827 43.8463 174.0440 22 V 4.6908 8.9470 127.7845 61.2034 33.6687 175.4558 23 N 4.2542 10.0865 128.2027 54.4723 36.5487 175.9953 24 G 3.8872 8.3492 105.1243 45.9367 0.0000 173.8756 25 H 4.5923 8.1281 118.6293 55.0976 29.0174 174.1401 26 K 5.2383 8.5871 124.5580 55.0404 33.7490 175.8096 27 F 5.0876 8.3459 118.0841 55.8830 42.1283 173.1017 28 S 5.0947 9.1234 114.0455 56.8848 67.5172 173.6268 29 V 5.0593 8.8512 121.4416 61.6200 34.8379 174.0674 30 S 5.3545 9.3061 124.1168 56.8451 65.4131 173.4986 31 G 4.2024 9.5352 111.5204 44.3776 0.0000 171.2735 32 E 4.9915 8.0894 118.5232 54.2806 33.2389 174.6598 33 G 4.0554 8.3737 110.7579 45.8182 0.0000 172.1732 34 E 4.8847 8.1507 121.1363 55.3260 33.4916 174.7983 35 G 3.6311 8.7349 107.0982 44.4461 0.0000 171.3089 36 D 5.3500 9.1515 120.5479 51.7193 41.9874 175.7407 37 A 4.5150 9.0836 127.9847 54.9647 19.0198 180.0694 38 T 3.8785 8.3579 111.8104 66.3644 68.5149 174.4559 39 Y 4.3983 8.1886 116.2552 57.0577 39.1538 176.2840 40 G 4.2834 8.1514 108.1724 46.0465 0.0000 172.4046 41 K 4.5353 8.0132 120.3439 54.3280 34.3985 175.0034 42 L 5.0397 8.6166 126.0088 53.2816 46.4712 175.7282 43 T 4.8401 8.3594 117.8488 62.0412 72.3982 173.0515 44 L 4.9759 9.1087 125.8611 52.8004 46.9124 175.2641 45 K 4.7442 8.3879 122.2327 54.5645 35.6708 174.8718 46 F 5.2404 9.0792 125.3486 55.6043 42.8160 174.0688 47 I 5.0854 8.7300 123.0635 59.4888 40.5534 174.3575 48 C 5.0287 9.5129 128.2999 59.6795 31.5308 174.0939 49 T 4.3233 8.8484 117.8866 63.2459 68.9818 175.6931 50 T 4.4140 8.5828 110.8506 61.4578 70.6646 172.5821 51 G 4.1536 6.5266 109.8706 44.6241 0.0000 177.2878 52 K 4.3521 8.5275 124.2571 55.0383 32.4190 175.8356 53 L 3.8026 9.0480 125.8363 53.8293 42.0516 175.7288 54 P 4.2021 0.0000 0.0000 63.8083 31.5408 175.9454 55 V 4.1266 6.2280 111.1548 58.6305 35.6192 173.2914 56 P 4.4420 0.0000 0.0000 61.8847 32.2561 177.4960 57 W 4.5952 9.0691 123.4013 59.9895 28.9592 177.1395 58 P 4.5989 0.0000 0.0000 65.4264 30.5572 178.4103 59 T 4.2954 8.1875 107.8881 63.6396 69.1062 175.5316 60 L 4.3496 7.9387 120.8890 54.4734 40.7647 178.2925 61 V 3.5826 7.5982 120.7531 66.2926 31.2717 178.0817 62 T 4.2481 7.9760 107.6178 64.9383 68.6685 176.2193 63 T 4.1512 7.0687 118.2617 66.0723 69.8437 176.6380 64 F 4.8411 7.5048 119.1105 56.7195 37.0365 177.5408 *68 V 4.1304 7.1614 113.9032 61.7225 32.8282 177.2240 69 Q 4.0230 7.7784 119.4826 57.2956 29.1801 178.4017 70 C 3.9346 7.4358 111.8869 60.4438 29.8209 174.4796 71 F 4.4950 8.0369 118.6992 57.4554 38.7328 175.5527 72 S 4.6501 7.5148 117.7651 58.5066 63.6921 174.1167 73 R 4.3710 8.8329 124.5322 56.2941 30.7924 174.6197 74 Y 4.5598 8.6036 124.7760 55.7541 39.2743 174.3072 75 P 4.3684 0.0000 0.0000 62.6089 32.5875 176.7317 76 D 4.4602 9.0721 121.7337 58.1942 40.5698 179.3056 77 H 4.4600 8.3193 112.2159 57.6063 28.9290 175.9980 78 M 4.6181 8.1255 123.3456 55.5635 32.6836 177.9550 79 K 3.8761 7.8779 125.5957 59.7133 31.5236 183.8229 80 R 4.1898 7.7531 113.0526 58.5864 29.8097 176.7578 81 H 4.6391 7.8094 114.7248 56.0933 29.0184 175.8267 82 D 3.6526 7.4026 121.8559 52.2809 39.3348 176.1439 83 F 4.0080 7.9219 127.2990 60.0488 39.4031 176.1513 84 F 3.7223 7.5971 116.2760 60.1530 39.0154 177.1658 85 K 4.0797 8.0801 118.1607 58.7956 32.0575 179.1616 86 S 4.0376 7.5813 114.5504 61.7101 62.6084 176.3753 87 A 4.1422 7.4830 122.8748 53.0249 18.1039 177.3550 88 M 4.8021 7.5323 117.5527 54.0497 33.2924 174.9465 89 P 4.6369 0.0000 0.0000 64.9167 32.2158 178.3549 90 E 3.8400 8.2545 118.6079 58.8548 29.6341 175.8773 91 G 3.8192 8.6767 103.3881 44.3124 0.0000 171.3233 92 Y 5.3927 8.0760 115.0209 55.3225 41.9167 174.5143 93 V 4.6212 9.3496 121.5150 62.3438 33.4003 174.4087 94 Q 5.2974 9.5212 128.8582 54.4686 32.1385 173.7751 95 E 5.3263 9.5182 125.3546 54.8461 33.4700 175.0759 96 R 5.4020 9.0745 121.7924 54.8134 35.4625 173.9170 97 T 5.0605 8.6859 111.1261 60.0625 71.8419 173.0915 98 I 4.6121 9.1859 124.9952 59.6497 40.7225 174.4748 99 S 4.7297 8.7132 124.4165 56.7874 64.9094 173.3839 100 F 4.6649 8.5262 124.8288 55.8182 40.1554 175.8818 101 K 4.0967 8.7046 125.9385 57.8543 32.4047 175.9372 102 D 4.4893 8.9262 124.3720 54.8894 38.5241 172.9291 103 D 4.3649 7.6193 118.0179 53.8700 44.1143 173.5300 104 G 2.8368 7.7773 107.8886 44.5866 0.0000 171.8621 105 N 5.5660 7.8440 114.6750 51.6473 41.2394 173.0754 106 Y 5.7233 9.0551 117.7879 56.6560 40.9820 174.7898 107 K 5.2541 9.3676 122.3942 54.8780 35.3668 175.3543 108 T 5.1413 9.0453 114.1687 59.8758 72.4290 172.6852 109 R 5.1610 8.9756 123.6229 54.6254 33.3345 173.8471 110 A 5.7809 9.1915 127.0874 49.3034 23.2086 174.2077 111 E 4.9613 8.8197 120.4332 54.6386 32.2853 175.0055 112 V 4.7214 8.1825 125.4991 61.1864 33.5323 174.4466 113 K 4.7710 8.3436 125.6850 55.8362 36.2528 174.7572 114 F 4.5944 8.7828 120.4581 57.3961 40.0741 175.6625 115 E 4.5220 9.5084 123.0337 55.0256 31.3894 176.6937 116 G 3.8053 8.2203 116.5939 47.2643 0.0000 173.2142 117 D 4.7653 8.8931 124.2382 54.6184 41.3699 175.6333 118 T 4.7186 7.7217 117.2938 61.7442 70.8997 173.5130 119 L 3.8366 8.5270 128.9050 54.1876 43.5400 175.3734 120 V 4.7564 8.5252 126.4121 61.0042 34.7157 173.5130 121 N 5.0622 9.4192 126.9564 52.1540 41.1232 173.2196 122 R 5.1382 8.8957 126.5378 54.6327 32.5593 175.4469 123 I 5.0866 9.1622 125.1169 59.3338 41.1563 174.1142 124 E 5.0570 9.1491 126.8572 54.2761 32.3012 174.1891 125 L 5.2351 9.0104 131.4538 53.7191 45.3887 175.6427 126 K 5.0612 9.2310 129.1406 53.3469 35.6344 172.4291 127 G 5.0108 9.6650 113.2981 43.6163 0.0000 171.9850 128 I 5.1415 8.7650 116.2351 59.5840 41.7740 174.5946 129 D 4.2977 8.7824 119.7748 55.4198 38.2033 174.3117 130 F 4.5238 8.4189 116.8777 56.7435 39.9180 175.7798 131 K 4.1836 9.0236 125.7218 56.6561 32.3364 178.4806 132 E 4.0709 9.1120 123.4291 59.3643 29.5876 174.6407 *133 D 5.0011 7.8541 116.0973 52.3394 41.5185 179.0962 134 G 4.0499 8.4039 109.1475 44.6160 0.0000 174.0328 135 N 4.3838 8.7236 116.2036 56.3797 38.3003 176.5390 136 I 3.7921 7.5247 120.9524 63.2639 37.4029 177.8243 137 L 3.9441 7.6511 120.9739 57.2202 41.8460 178.4138 138 G 3.7828 7.8366 105.3998 44.8235 0.0000 173.0314 139 H 3.9081 7.6063 115.7901 57.2898 26.3166 174.9700 140 K 4.7323 8.4004 115.8826 56.1774 34.0046 177.6870 141 L 4.7692 7.7651 120.9496 53.8665 42.4312 176.7550 142 E 4.0673 8.8150 123.4931 56.9135 30.2655 177.4380 143 Y 4.5362 8.6396 124.9820 55.4203 37.3571 173.4891 144 N 4.5729 7.6664 120.0564 52.5453 40.1991 173.5294 145 Y 4.4956 7.9902 116.7645 56.8876 41.3241 172.4664 146 N 5.1669 7.9493 121.2809 50.8086 42.3766 174.0591 147 S 4.7523 8.3051 114.0984 59.0019 63.9907 173.4158 148 H 5.0105 9.2111 118.5431 54.4176 33.5786 171.7324 149 N 5.2998 8.7876 118.0930 51.6536 40.6746 174.6410 150 V 4.0227 8.5934 124.5265 61.0100 33.1808 173.9661 151 Y 4.5215 8.6489 126.6934 58.0450 39.0958 174.9446 152 I 4.7612 9.0910 126.6222 60.2389 39.3389 175.1637 153 T 5.1015 8.7276 115.4550 59.5288 72.3739 173.3846 154 A 4.2429 8.6648 124.6645 52.0867 19.5127 176.9736 155 D 4.7250 8.8422 121.0999 52.4345 40.2648 176.6721 *156 K 3.7963 8.5992 126.5746 58.3404 32.2549 179.8200 *157 Q 4.2080 8.3703 118.7467 58.5149 27.9503 180.9614 *158 K 3.9916 8.0220 119.0825 55.4137 32.1749 178.0952 159 N 4.2690 8.1169 114.1302 54.0696 38.0128 173.1726 160 G 3.8170 6.7175 109.6492 46.5212 0.0000 172.7333 161 I 5.1146 7.4805 117.9137 59.1529 41.8764 174.5285 162 K 5.1351 8.6262 119.6764 56.3372 36.2931 174.5650 163 A 5.1672 8.9509 120.7331 52.0003 23.0877 175.0974 164 N 5.1665 8.5645 116.6447 51.3466 40.3071 173.5889 165 F 4.8637 8.4885 115.8262 55.8857 41.9018 172.8885 166 K 4.8488 8.6065 119.8459 54.9282 33.6597 175.9647 167 I 3.7618 8.5955 127.4713 60.6029 38.6227 175.4632 168 R 4.5624 8.6839 126.3661 55.7007 30.8104 175.6205 169 H 4.8225 8.7193 122.9335 53.8516 30.7195 174.6404 170 N 4.7212 8.7802 121.8605 53.5544 39.6927 174.4681 171 I 4.6937 8.4212 124.1413 59.8808 38.9508 176.9323 172 E 4.0010 9.0723 125.6932 59.6646 29.4053 178.3503 173 D 4.4596 7.9699 115.4819 54.1766 39.6112 176.8119 174 G 3.9961 8.1947 109.1890 45.2068 0.0000 173.8463 175 S 4.6522 8.6487 114.9475 57.3711 66.1302 172.6496 176 V 4.8481 8.1536 118.4536 61.5825 34.1672 175.1564 177 Q 4.5823 9.0754 127.4969 54.5270 30.4379 174.9982 178 L 4.8139 8.5817 124.4526 54.2755 43.6143 175.6860 179 A 4.6636 8.9983 125.3057 50.0379 21.4596 174.8085 180 D 4.7504 9.0021 124.0735 53.9029 42.5806 174.7527 181 H 5.1170 8.9617 124.2422 54.1982 31.2185 173.5108 182 Y 4.7226 8.6315 120.4986 56.0941 40.9970 174.4539 183 Q 5.3590 9.5960 125.6931 54.2231 32.7090 173.9047 184 Q 5.2369 9.1757 123.0490 54.4965 32.4561 173.8283 185 N 6.2600 8.7996 117.8326 51.0512 42.5083 173.5064 186 T 5.0956 8.5604 118.9888 60.6604 72.4194 171.8031 187 P 4.8969 0.0000 0.0000 63.6790 31.4732 176.2025 188 I 3.6424 8.7807 122.5557 64.2713 37.5256 177.0202 189 G 3.4581 8.5633 113.4046 47.7668 0.0000 174.1044 *193 V 3.7698 7.7023 117.8338 60.2463 33.7547 177.9884 *194 L 4.3948 8.3976 125.0015 52.2167 41.2337 173.8577 195 L 4.2948 8.4398 125.5673 52.5265 41.9994 175.3294 196 P 4.6409 0.0000 0.0000 61.9913 32.3540 175.8207 197 D 4.5999 8.4127 119.7698 53.8854 41.4988 175.8961 198 N 4.7977 8.5186 118.2578 54.7242 39.2162 174.1127 199 H 4.8446 8.5604 116.9970 55.4284 32.6716 171.6892 200 Y 5.0563 8.2393 115.7991 55.2105 41.9002 174.0682 201 L 4.7534 8.5860 120.3334 53.0381 44.1199 175.8539 202 S 4.9089 9.0939 120.3923 58.2669 63.4431 172.3362 203 H 5.4993 9.3446 125.4568 54.4652 31.2551 174.1677 204 Q 5.1135 8.9959 119.8519 54.8455 33.4030 174.1421 205 S 5.2731 8.6702 116.1520 57.4451 67.5010 173.4687 206 A 4.7441 9.0710 123.9145 50.4287 22.4204 174.9745 207 L 5.2026 8.5231 122.0247 53.2461 44.4998 175.9940 208 S 4.8878 9.0520 116.1653 57.6216 66.6946 172.4984 209 K 4.9074 8.5096 117.1585 54.8920 36.2323 176.0232 210 D 4.6354 8.8192 121.9330 52.3818 41.2459 175.4925 211 P 4.2150 0.0000 0.0000 65.2259 31.4405 177.0267 212 N 4.6139 8.0819 113.0580 52.9854 38.9398 174.2328 213 E 4.3625 8.0351 120.9479 54.7742 30.2346 175.7826 214 K 4.3001 8.4756 125.3627 57.6159 33.0993 177.5782 215 R 4.1156 7.8527 117.4797 55.9420 30.7470 175.5378 216 D 4.8856 8.6878 120.6035 54.5888 42.2480 174.7608 217 H 5.0967 8.5492 119.9859 54.8323 32.0566 172.2085 218 M 4.4843 7.9824 117.6043 52.8454 35.8841 173.5085 219 V 4.6505 8.6594 125.7661 61.1982 33.9553 174.0498 220 L 5.2879 9.0627 130.0524 53.0758 45.1921 174.6754 221 L 5.1738 8.6365 126.4957 54.1069 43.1449 175.3231 222 E 5.1651 8.9124 120.7703 54.7775 34.7365 174.1310 223 F 5.2656 9.0411 120.4992 55.7322 42.8362 174.3172 224 V 4.8668 9.1941 123.2362 61.4751 34.5767 174.1900 225 T 5.0121 8.6540 123.8998 61.5258 72.0280 173.3208 226 A 4.2772 8.6494 127.7423 51.8588 19.5967 176.4805 227 A 4.0791 8.3489 121.8203 50.8111 22.9200 176.8862 228 G 4.1816 9.2190 104.7882 45.4534 0.0000 173.7668 229 I 4.5896 7.1857 119.9538 59.1793 40.2544 175.4227 230 T 4.0709 8.6521 114.1219 61.9969 68.6138 174.1056 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 *3 K 8.16 4.34 0.00 1.70 1.88 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.02 7.81 4 G 8.03 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.49 4.23 0.00 2.02 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 2.34 2.30 0.00 *6 E 7.66 4.20 0.00 2.07 1.86 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 2.26 2.22 0.00 7 L 7.66 4.22 0.00 1.21 0.86 0.25 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.81 4.92 0.00 3.13 3.06 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 9 T 8.26 4.09 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 10 G 7.70 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 8.43 4.17 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 0.97 0.00 0.00 12 V 9.03 4.66 2.54 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 1.23 0.00 0.00 1.10 0.00 0.00 13 P 0.00 4.84 0.00 2.12 2.13 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 14 I 8.63 5.05 1.71 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 0.89 0.00 0.00 15 L 8.82 5.19 0.00 1.51 1.49 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.76 4.96 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 1.24 0.00 0.00 1.08 0.00 0.00 17 E 9.24 5.20 0.00 1.93 1.82 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 2.23 2.37 0.00 18 L 9.17 5.27 0.00 1.93 1.70 0.95 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.91 5.16 0.00 2.55 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 20 G 8.04 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.08 4.87 0.00 2.62 2.46 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 22 V 8.95 4.69 2.06 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 0.77 0.00 0.00 0.85 0.00 0.00 23 N 10.09 4.25 0.00 2.93 2.89 0.00 0.00 7.11 7.42 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 24 G 8.35 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.13 4.59 0.00 3.40 3.28 0.00 5.80 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.59 5.24 0.00 1.66 1.71 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.33 1.57 7.81 27 F 8.35 5.09 0.00 3.13 3.03 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 28 S 9.12 5.09 0.00 3.80 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.85 5.06 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 1.36 0.00 0.00 1.24 0.00 0.00 30 S 9.31 5.35 0.00 3.84 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 9.54 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 32 E 8.09 4.99 0.00 1.93 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 2.08 2.14 0.00 33 G 8.37 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.15 4.88 0.00 2.05 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 2.07 2.14 0.00 35 G 8.73 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 36 D 9.15 5.35 0.00 2.74 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 37 A 9.08 4.51 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 38 T 8.36 3.88 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 0.94 0.00 0.00 39 Y 8.19 4.40 0.00 3.11 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 40 G 8.15 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.01 4.54 0.00 1.96 1.66 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.04 0.63 7.81 42 L 8.62 5.04 0.00 1.38 1.31 0.95 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.36 4.84 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 1.10 0.00 0.00 44 L 9.11 4.98 0.00 1.40 0.81 1.03 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.39 4.74 0.00 1.59 1.51 0.00 1.46 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.14 1.24 7.81 46 F 9.08 5.24 0.00 2.55 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.73 5.09 1.94 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 1.10 1.00 1.00 0.00 0.00 48 C 9.51 5.03 0.00 3.14 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 49 T 8.85 4.32 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 50 T 8.58 4.41 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 1.25 0.00 0.00 51 G 6.53 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.53 4.35 0.00 1.71 1.67 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.34 7.81 53 L 9.05 3.80 0.00 1.22 0.97 0.34 -0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.20 0.00 1.95 1.95 0.00 2.77 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.77 0.00 55 V 6.23 4.13 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 0.30 0.00 0.00 0.47 0.00 0.00 56 P 0.00 4.44 0.00 2.18 2.00 0.00 3.38 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 57 W 9.07 4.60 0.00 3.74 3.50 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 58 P 0.00 4.60 0.00 2.33 2.58 0.00 3.79 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 2.42 2.31 0.00 59 T 8.19 4.30 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 1.07 0.00 0.00 60 L 7.94 4.35 0.00 1.22 0.44 0.80 0.43 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 61 V 7.60 3.58 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 0.41 0.00 0.00 0.82 0.00 0.00 62 T 7.98 4.25 4.49 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 1.43 0.00 0.00 63 T 7.07 4.15 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 1.18 0.00 0.00 64 F 7.50 4.84 0.00 2.95 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 *68 V 7.16 4.13 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.12 0.00 0.00 69 Q 7.78 4.02 0.00 1.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 70 C 7.44 3.93 0.00 2.43 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 71 F 8.04 4.49 0.00 3.30 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 72 S 7.51 4.65 0.00 3.93 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 73 R 8.83 4.37 0.00 2.04 1.81 0.00 3.17 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 74 Y 8.60 4.56 0.00 2.80 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.37 0.00 2.07 1.98 0.00 3.48 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 2.05 2.03 0.00 76 D 9.07 4.46 0.00 2.74 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 77 H 8.32 4.46 0.00 3.32 3.41 0.00 5.49 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.13 4.62 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.40 0.00 79 K 7.88 3.88 0.00 1.76 1.84 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.34 7.81 80 R 7.75 4.19 0.00 1.82 2.00 0.00 2.93 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.39 0.00 81 H 7.81 4.64 0.00 3.33 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.40 3.65 0.00 1.58 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 7.92 4.01 0.00 2.98 2.55 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 84 F 7.60 3.72 0.00 3.01 3.03 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 85 K 8.08 4.08 0.00 1.62 1.74 0.00 1.61 0.00 0.00 1.47 0.00 0.00 2.87 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.24 7.81 86 S 7.58 4.04 0.00 3.88 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 87 A 7.48 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 88 M 7.53 4.80 0.00 2.32 2.40 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.30 3.04 0.00 89 P 0.00 4.64 0.00 2.20 2.06 0.00 3.69 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 2.05 1.90 0.00 90 E 8.25 3.84 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 91 G 8.68 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 0.00 0.00 0.00 92 Y 8.08 5.39 0.00 3.38 3.06 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 93 V 9.35 4.62 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 1.17 0.00 0.00 1.02 0.00 0.00 94 Q 9.52 5.30 0.00 2.55 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 95 E 9.52 5.33 0.00 1.98 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 2.28 2.34 0.00 96 R 9.07 5.40 0.00 1.80 1.79 0.00 3.23 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 97 T 8.69 5.06 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 1.23 0.00 0.00 98 I 9.19 4.61 1.68 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.67 0.04 0.00 0.00 99 S 8.71 4.73 0.00 3.62 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 0.00 100 F 8.53 4.66 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.70 4.10 0.00 1.98 1.74 0.00 2.06 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.29 7.81 102 D 8.93 4.49 0.00 2.88 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 0.00 103 D 7.62 4.36 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 0.00 104 G 7.78 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 0.00 0.00 0.00 105 N 7.84 5.57 0.00 2.96 2.78 0.00 0.00 7.31 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 0.00 106 Y 9.06 5.72 0.00 3.00 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 0.00 107 K 9.37 5.25 0.00 1.70 1.73 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.40 7.81 108 T 9.05 5.14 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 109 R 8.98 5.16 0.00 1.92 1.80 0.00 3.07 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 110 A 9.19 5.78 1.35 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 0.00 0.00 111 E 8.82 4.96 0.00 1.92 1.86 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 2.34 2.30 0.00 112 V 8.18 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 0.82 0.00 0.00 0.86 0.00 0.00 113 K 8.34 4.77 0.00 2.14 1.86 0.00 1.38 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.30 1.42 7.81 114 F 8.78 4.59 0.00 2.92 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 9.51 4.52 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 2.23 2.21 0.00 116 G 8.22 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 0.00 117 D 8.89 4.77 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 7.72 4.72 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 1.19 0.00 0.00 119 L 8.53 3.84 0.00 1.08 1.52 1.01 0.44 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 0.00 120 V 8.53 4.76 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 1.00 0.00 0.00 121 N 9.42 5.06 0.00 2.88 2.76 0.00 0.00 6.74 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 0.00 122 R 8.90 5.14 0.00 1.80 1.84 0.00 3.12 0.00 0.00 3.18 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 123 I 9.16 5.09 1.96 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.02 0.95 0.00 0.00 124 E 9.15 5.06 0.00 2.09 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 0.00 2.19 2.08 0.00 125 L 9.01 5.24 0.00 1.58 1.24 0.51 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.23 5.06 0.00 1.42 1.61 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.25 1.23 7.81 127 G 9.66 5.01 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 0.00 0.00 0.00 128 I 8.77 5.14 1.92 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 1.31 0.67 0.98 0.00 0.00 129 D 8.78 4.30 0.00 2.70 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 0.00 130 F 8.42 4.52 0.00 3.04 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 0.00 131 K 9.02 4.18 0.00 1.90 1.76 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.43 7.81 132 E 9.11 4.07 0.00 1.98 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 2.25 1.92 0.00 *133 D 7.85 5.00 0.00 2.63 2.49 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 0.00 134 G 8.40 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 0.00 135 N 8.72 4.38 0.00 2.73 2.88 0.00 0.00 6.82 7.23 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 0.00 136 I 7.52 3.79 1.67 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.35 0.18 0.00 0.00 137 L 7.65 3.94 0.00 1.79 1.66 0.99 0.73 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 0.00 138 G 7.84 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 0.00 139 H 7.61 3.91 0.00 3.29 3.33 0.00 5.62 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 8.40 4.73 0.00 1.79 1.80 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.37 7.81 141 L 7.77 4.77 0.00 1.53 1.65 0.90 0.83 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 0.00 142 E 8.81 4.07 0.00 2.03 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 2.40 2.22 0.00 143 Y 8.64 4.54 0.00 3.09 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 7.67 4.57 0.00 2.83 2.79 0.00 0.00 6.08 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 7.99 4.50 0.00 2.90 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 0.00 146 N 7.95 5.17 0.00 2.54 2.60 0.00 0.00 6.99 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 8.31 4.75 0.00 4.01 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 H 9.21 5.01 0.00 3.13 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.79 5.30 0.00 2.50 2.25 0.00 0.00 6.73 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 8.59 4.02 1.87 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 0.79 0.00 0.00 -0.03 0.00 0.00 151 Y 8.65 4.52 0.00 2.96 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 9.09 4.76 1.57 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.36 0.86 0.00 0.00 153 T 8.73 5.10 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 0.00 154 A 8.66 4.24 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 0.00 155 D 8.84 4.72 0.00 2.57 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 *156 K 8.60 3.80 0.00 1.81 1.75 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.04 7.81 *157 Q 8.37 4.21 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.06 0.00 0.00 0.00 0.00 0.00 2.29 1.95 0.00 *158 K 8.02 3.99 0.00 1.79 1.77 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.39 1.26 7.81 159 N 8.12 4.27 0.00 2.86 2.94 0.00 0.00 7.00 8.01 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 0.00 160 G 6.72 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 0.00 0.00 0.00 161 I 7.48 5.11 1.58 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 -0.05 0.40 0.35 0.00 0.00 162 K 8.63 5.14 0.00 2.11 1.88 0.00 1.47 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.32 1.27 7.81 163 A 8.95 5.17 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 8.56 5.17 0.00 1.44 1.66 0.00 0.00 5.88 7.43 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 0.00 165 F 8.49 4.86 0.00 3.11 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 0.00 166 K 8.61 4.85 0.00 1.65 1.75 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.71 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.48 7.81 167 I 8.60 3.76 1.72 0.00 0.00 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 1.06 0.80 0.46 0.00 0.00 168 R 8.68 4.56 0.00 1.68 1.86 0.00 3.17 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 169 H 8.72 4.82 0.00 3.31 3.24 0.00 5.62 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.78 4.72 0.00 2.71 2.84 0.00 0.00 7.04 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.42 4.69 2.04 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 1.26 0.94 0.99 0.00 0.00 172 E 9.07 4.00 0.00 2.05 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 0.00 2.38 2.30 0.00 173 D 7.97 4.46 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 G 8.19 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 S 8.65 4.65 0.00 3.89 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.15 4.85 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 0.90 0.00 0.00 0.93 0.00 0.00 177 Q 9.08 4.58 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 178 L 8.58 4.81 0.00 1.58 1.53 0.91 0.66 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 0.00 179 A 9.00 4.66 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 9.00 4.75 0.00 2.71 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 0.00 181 H 8.96 5.12 0.00 1.43 2.43 0.00 5.80 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.63 4.72 0.00 2.94 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 0.00 183 Q 9.60 5.36 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 184 Q 9.18 5.24 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.53 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 185 N 8.80 6.26 0.00 2.46 2.81 0.00 0.00 6.67 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 0.00 186 T 8.56 5.10 4.35 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 1.32 0.00 0.00 187 P 0.00 4.90 0.00 2.17 2.18 0.00 4.00 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 188 I 8.78 3.64 2.15 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 1.23 0.66 0.95 0.00 0.00 189 G 8.56 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 0.00 0.00 0.00 *193 V 7.70 3.77 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 0.74 0.00 0.00 0.93 0.00 0.00 *194 L 8.40 4.39 0.00 1.66 1.50 0.92 0.92 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 0.00 195 L 8.44 4.29 0.00 1.63 1.62 0.89 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.64 0.00 2.32 2.29 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 197 D 8.41 4.60 0.00 2.51 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 8.52 4.80 0.00 2.64 2.87 0.00 0.00 6.76 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 8.56 4.84 0.00 3.30 3.30 0.00 5.20 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.24 5.06 0.00 2.40 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 0.00 0.00 0.00 201 L 8.59 4.75 0.00 1.54 1.44 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.09 4.91 0.00 4.01 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 0.00 203 H 9.34 5.50 0.00 3.20 3.22 0.00 5.62 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 0.00 204 Q 9.00 5.11 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 205 S 8.67 5.27 0.00 3.73 3.55 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 0.00 206 A 9.07 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 8.52 5.20 0.00 0.68 1.03 0.69 0.70 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 0.00 208 S 9.05 4.89 0.00 3.87 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 0.00 209 K 8.51 4.91 0.00 1.59 1.67 0.00 1.40 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.23 1.13 7.81 210 D 8.82 4.64 0.00 2.69 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 0.00 211 P 0.00 4.22 0.00 2.07 2.11 0.00 3.71 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 212 N 8.08 4.61 0.00 2.84 2.82 0.00 0.00 6.87 7.17 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 0.00 213 E 8.04 4.36 0.00 1.86 1.70 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 1.86 2.25 0.00 214 K 8.48 4.30 0.00 2.04 1.85 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.02 7.81 215 R 7.85 4.12 0.00 1.99 1.94 0.00 3.19 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 216 D 8.69 4.89 0.00 2.94 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 H 8.55 5.10 0.00 3.20 3.19 0.00 5.53 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 7.98 4.48 0.00 1.43 0.72 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.36 0.00 219 V 8.66 4.65 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 0.87 0.00 0.00 0.92 0.00 0.00 220 L 9.06 5.29 0.00 1.92 1.61 0.89 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.64 5.17 0.00 1.70 1.69 0.94 0.77 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 0.00 222 E 8.91 5.17 0.00 1.78 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 2.17 2.24 0.00 223 F 9.04 5.27 0.00 2.99 2.92 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 0.00 224 V 9.19 4.87 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 0.59 0.00 0.00 0.85 0.00 0.00 225 T 8.65 5.01 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 226 A 8.65 4.28 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 8.35 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.22 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 7.19 4.59 1.88 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.97 0.00 0.00 230 T 8.65 4.07 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 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.