NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0942 8.0244 121.4491 61.5294 38.4528 174.1549 4 T 4.5305 8.2060 118.2853 58.6309 70.7117 170.5138 5 T 4.5828 8.8588 112.8761 58.9842 71.9024 172.3051 6 P 4.4082 0.0000 0.0000 62.1989 32.5564 174.7758 7 E 4.3716 8.4003 119.3328 55.6192 29.9614 176.8303 8 Q 3.9609 7.9580 124.3902 56.9042 30.0945 176.5802 9 R 4.9336 8.6415 122.3512 54.9493 31.6931 175.6596 10 I 4.4801 8.8941 125.9391 59.4499 39.8107 174.2006 11 E 5.0157 8.8782 128.4648 54.4890 31.1009 174.9211 12 K 4.8224 9.1114 125.2992 54.5463 36.9995 175.4989 13 A 4.9530 8.6017 123.4194 50.5782 20.3938 176.9612 14 K 4.0687 8.2672 119.8175 57.4111 33.0869 178.1112 15 G 4.0051 10.3219 111.7624 45.7259 0.0000 172.8878 16 E 5.3772 7.5650 118.8225 54.7456 33.3491 173.9896 17 T 5.1206 8.3995 114.4707 62.3896 71.9018 172.9580 18 A 4.6958 9.1052 128.8188 50.7318 21.0138 175.1217 19 Y 5.0722 8.4154 123.6946 55.3100 40.3997 174.9747 20 L 3.9088 7.8595 128.5291 51.7828 43.6791 174.1695 21 P 4.4553 0.0000 0.0000 62.5435 32.3067 177.9069 22 C 5.1414 9.2719 123.7684 55.3191 44.4698 171.4429 23 K 5.1987 8.2487 120.5482 54.5146 33.7945 176.0136 24 F 5.1045 8.7313 118.8027 55.3795 41.8849 173.9630 25 T 4.7047 8.5585 116.6189 61.6183 70.3499 174.2756 26 L 4.3181 8.6099 126.7381 54.7439 42.7288 176.7495 27 S 4.8739 8.8994 117.7827 56.0327 65.0846 173.6726 28 P 4.4171 0.0000 0.0000 65.9526 31.2582 177.9525 29 E 4.0436 8.1638 116.4399 59.3159 29.8110 177.0582 30 D 4.7393 8.5250 119.9500 53.9418 38.9523 175.8384 31 Q 4.5189 8.1974 123.2412 55.5586 31.0840 175.7389 32 G 3.8941 8.1016 106.6787 44.5021 0.0000 171.1575 33 P 4.3605 0.0000 0.0000 62.0723 31.7755 175.9839 34 L 4.3587 8.3763 125.2429 55.4380 43.1348 175.8472 35 D 4.9627 8.7001 124.2673 53.6230 45.0225 173.7954 36 I 5.0347 8.8832 126.8821 59.6699 40.8758 174.7791 37 E 5.0051 8.8223 126.6251 55.0788 32.8512 173.6843 38 W 4.9575 9.7475 128.6006 55.6876 31.1528 175.5508 39 L 5.2658 8.7896 124.1527 52.9479 44.6147 175.1932 40 I 4.1264 8.9151 124.0654 59.5180 40.1694 174.3578 41 S 4.8342 8.3433 124.0267 54.9659 63.0431 169.8431 42 P 4.3342 0.0000 0.0000 63.5225 32.3515 175.9250 43 S 3.5727 9.1028 117.7396 59.1599 61.3272 172.7464 44 D 4.5406 8.3506 117.7949 54.3749 39.2178 173.4004 45 N 4.2456 7.8047 117.5979 53.9996 37.2602 175.1950 46 Q 4.4448 8.6700 120.2636 56.0006 29.0244 176.2593 47 I 4.1816 7.2094 119.3181 62.3263 38.1218 176.4684 48 V 4.4541 7.1807 115.3769 61.2484 34.4957 173.2413 49 D 5.2577 8.5106 124.9719 52.6186 44.5477 175.0403 50 Q 4.6944 9.1058 118.4178 54.0021 32.7933 175.1757 51 V 4.2051 8.3877 123.1675 63.2475 31.8248 174.6824 52 I 4.4668 8.8297 121.4823 62.2440 38.8533 175.5605 53 I 5.1151 7.7656 123.2190 58.3270 41.7674 173.0809 54 L 5.5772 9.0833 128.2698 53.6760 46.2913 174.2090 55 Y 5.1575 9.4553 126.2151 56.2005 41.6576 174.1376 56 S 4.6406 9.1843 118.8837 58.1197 66.6647 175.3201 57 G 3.7479 9.1999 113.7604 46.3091 0.0000 172.7997 58 D 3.9243 8.1576 115.0010 54.3674 39.8490 173.6749 59 K 4.3384 7.3618 115.7295 54.4517 36.2518 176.8280 60 I 4.5328 7.8691 123.7848 61.1982 38.3552 175.1071 61 Y 4.6157 9.0382 120.2644 56.7145 40.7931 175.6524 62 D 4.8481 8.4978 123.1931 53.0245 39.8154 177.4321 63 N 4.3342 7.5441 118.8166 55.6781 39.0522 173.2672 64 Y 4.8751 6.3116 113.0442 55.7965 41.5287 174.3220 65 Y 3.4358 8.6617 118.5941 57.2156 36.2476 168.1311 66 P 4.0683 0.0000 0.0000 65.0999 32.2112 178.4412 67 D 4.2889 7.9256 116.7095 56.6932 41.3679 176.5106 68 L 4.5245 8.9412 117.7409 53.9961 41.8230 175.2865 69 K 3.9104 7.4530 121.2628 59.2235 31.6851 176.7706 70 G 3.9971 9.0991 114.7324 45.3454 0.0000 172.6429 71 R 5.2515 8.6239 117.6273 54.8330 32.1376 175.7930 72 V 4.9016 7.5883 118.4079 60.1537 34.1104 174.8140 73 H 4.8355 9.0564 120.2428 53.8754 33.7009 172.8352 74 F 4.6734 8.7512 121.3887 58.1018 38.7894 175.2154 75 T 3.9625 8.8754 115.6382 64.7635 68.8106 174.8635 76 S 4.2331 8.0823 116.7118 57.9641 62.7064 173.7082 77 N 4.4946 8.5028 121.5092 55.4071 39.1537 176.3949 78 D 4.6561 7.5475 122.3740 52.3742 40.1759 176.9474 79 V 4.2823 7.7505 124.3384 64.8526 32.2614 178.4485 80 K 4.0262 7.9258 119.1880 59.1816 32.0263 178.6047 81 S 4.1215 7.4999 111.9347 59.2434 62.9044 174.6239 82 G 2.9595 7.7257 111.1912 45.8590 0.0000 172.8825 83 D 4.7101 8.3042 119.1520 52.3674 43.2606 174.9653 84 A 5.0120 9.0958 127.7132 51.7102 20.2211 176.5004 85 S 4.7839 9.0711 114.0274 59.3695 64.2648 173.5955 86 I 4.9196 8.1934 114.8549 59.2198 40.9347 173.5722 87 N 5.3045 9.4012 121.0378 51.4859 41.5661 173.9160 88 V 4.5379 8.7831 123.5354 61.3767 33.7724 174.4826 89 T 5.0108 9.3846 119.5253 59.6518 71.3513 173.2548 90 N 4.6018 8.4414 119.0461 53.3885 36.4393 173.6023 91 L 4.2667 8.7293 120.5998 54.7800 42.9678 177.0579 92 Q 4.8566 9.1424 121.3825 53.6831 32.3409 176.3450 93 L 4.1800 8.3216 117.7216 57.4388 41.7700 179.4219 94 S 4.3646 8.0124 111.5570 59.9241 63.3837 174.3469 95 D 4.8090 7.7791 120.0069 54.5566 40.8771 176.7678 96 I 4.0074 7.6872 122.0092 60.2029 38.1330 176.6583 97 G 4.0705 6.8689 109.4149 45.9613 0.0000 170.1455 98 T 5.1874 7.6733 115.8161 61.9721 71.7724 172.7782 99 Y 5.1747 9.8817 124.8923 56.2484 41.0982 174.5314 100 Q 5.0714 9.2383 124.6801 54.3836 33.0578 172.9361 101 C 3.7327 9.0118 126.6768 54.5280 41.1470 172.6325 102 K 4.5360 8.0431 127.2707 54.8016 33.9827 175.3420 103 V 4.5530 8.1807 126.1848 60.9188 33.8553 174.7094 104 K 4.8188 8.8466 126.6554 54.6917 36.0552 175.4923 105 K 4.5532 9.2435 126.1462 53.2685 34.2962 173.8659 106 A 4.2645 8.4501 127.0200 51.7923 19.0572 175.7968 107 P 4.5429 0.0000 0.0000 62.4805 32.5200 176.4070 108 G 3.7483 8.2110 109.2494 45.3265 0.0000 173.0859 109 V 5.0179 7.7954 119.5046 60.3183 34.2899 173.0446 110 A 4.8069 8.9412 124.3407 50.6485 23.2488 174.2208 111 N 5.7079 8.2611 116.1683 52.3040 42.3180 173.8601 112 K 4.5467 8.4503 123.7918 54.5968 36.6434 174.9532 113 K 4.9841 8.3799 123.4374 54.6934 34.8438 175.1003 114 F 5.0087 9.9435 124.0601 55.6646 42.5557 173.8121 115 L 4.8106 9.5670 127.2150 53.6830 43.2404 174.6177 116 L 5.0485 8.8330 129.6496 54.2190 44.1141 175.3417 117 T 4.7503 8.9798 121.9158 61.7711 72.4662 172.9669 118 V 4.6632 8.5630 125.8933 61.2487 32.8216 174.7893 119 L 4.5746 8.7885 128.6220 53.7950 43.9191 176.1039 120 V 4.7623 7.7556 120.4031 60.5620 33.6423 175.5903 121 K 4.0270 8.7837 128.1720 55.8775 32.9286 174.8795 122 P 4.4909 0.0000 0.0000 62.9001 31.4439 175.5386 123 S 4.8497 8.6134 115.2051 59.4140 66.2538 174.5560 124 G 3.8108 9.2673 112.6577 47.1709 0.0000 172.8800 125 T 4.9658 7.5169 107.8002 60.2326 70.8639 175.2549 126 R 4.5500 9.1655 125.4464 55.3154 32.1681 174.6436 127 C 5.4453 8.8808 121.3632 55.3457 36.9375 173.1382 128 F 5.2966 8.6011 118.8348 55.2789 41.2501 174.1892 129 V 4.4231 8.5653 119.9894 61.4524 32.9269 175.2954 130 D 4.5896 8.5389 120.4905 55.7690 41.5786 179.5011 *136 G 3.8339 7.5921 104.6059 45.1763 0.0000 171.6685 137 N 4.5820 7.8905 119.8343 51.8176 42.3259 173.4973 138 D 5.1065 7.1058 112.7949 53.6983 40.4938 177.2846 139 F 4.5015 7.9258 117.3973 57.9809 41.2278 176.2635 140 K 4.8064 8.5363 119.0561 55.2397 36.1888 175.3061 141 L 4.5650 8.5343 126.0978 53.3526 43.8511 175.8364 142 K 4.7781 8.4490 123.2882 55.0355 35.7954 174.1950 143 C 5.3760 8.8888 127.0070 54.4120 41.5237 170.4608 144 E 4.6952 9.3280 124.3107 53.6387 30.7040 172.5775 145 P 5.0740 0.0000 0.0000 61.8486 33.3101 175.1930 146 K 4.2240 8.2485 117.5750 56.0839 36.5275 174.3470 147 E 4.3967 8.3057 126.3332 56.2004 31.6948 175.9135 148 G 4.4307 7.9384 107.5017 46.7697 0.0000 172.5525 149 S 4.5625 8.1332 110.9713 57.4799 65.1482 174.7724 150 L 4.4594 8.2823 122.7166 53.1873 42.6184 174.6674 151 P 4.4674 0.0000 0.0000 62.4059 31.8759 175.9946 152 L 4.4014 8.2587 123.3273 54.0944 42.8810 176.1465 153 Q 4.5300 8.9097 120.7563 54.0155 32.4129 174.6159 154 F 5.3257 8.6085 120.0631 55.7601 43.4764 173.8988 155 E 4.9972 8.9556 122.9206 54.8277 32.4366 174.0483 156 W 5.1980 9.3168 127.5224 56.1773 30.6545 176.3032 157 Q 4.2313 8.1000 119.4980 57.1969 32.6245 173.7759 158 K 4.4913 8.7232 120.2418 58.2992 36.2743 177.2205 *165 M 4.2885 8.8884 122.2934 54.8640 33.8951 174.3747 166 P 4.1985 0.0000 0.0000 62.7290 32.3340 177.1157 167 T 3.8395 8.5455 114.2885 64.0862 68.9155 174.0332 168 P 4.6823 0.0000 0.0000 62.3903 31.8718 176.1116 169 W 4.9755 7.6682 117.9682 57.2213 30.4252 177.9431 170 L 4.1248 7.7088 119.0522 57.7784 41.2495 179.4564 171 A 4.0290 7.9910 120.1358 54.6725 18.2729 177.8701 172 E 4.4148 8.5983 113.7867 56.4282 30.2281 178.2568 173 M 4.0104 7.3071 119.5894 58.1614 32.2682 178.2893 174 T 5.3439 7.9174 112.9641 63.6524 70.4277 175.4452 175 S 4.4186 7.8159 115.6485 57.5041 64.0714 172.6609 176 P 4.2417 0.0000 0.0000 63.7397 32.2423 175.3398 177 V 4.5408 7.1300 120.4548 61.4344 34.0692 175.9457 178 I 4.0974 8.2541 130.2740 58.6795 36.2843 173.6797 179 S 4.4956 8.2077 118.6153 58.3244 61.9417 173.8693 180 V 4.3109 8.4232 127.9190 62.7998 33.0517 174.6711 181 K 4.8482 8.3183 125.1973 55.9763 35.7223 176.2934 182 N 4.0792 9.5964 121.1561 54.6377 38.9398 172.4693 *191 Y 4.6058 7.5218 116.9447 58.6210 39.6807 173.8840 192 S 4.9650 8.4284 121.0054 57.7767 67.7245 174.8471 193 C 4.3717 8.5723 119.8534 56.3490 43.0424 171.8228 194 T 4.6944 8.6451 122.9135 62.6151 69.9207 173.7546 195 V 4.6906 8.7619 126.5762 61.0394 34.3755 174.0432 196 Q 4.9225 8.9434 128.7828 54.6309 32.5269 173.5000 197 N 5.1281 8.4189 123.9522 52.0947 39.3913 174.9948 198 R 4.6135 8.4734 118.8386 56.6399 30.5303 177.3239 199 V 4.4070 8.4643 107.8216 60.4325 35.4075 175.0200 200 G 4.0045 7.0723 110.2246 45.6986 0.0000 171.3624 201 S 5.6396 7.7388 114.4634 56.0805 66.8762 172.7278 202 D 4.4949 7.8783 115.7977 54.1498 44.0557 174.6033 203 Q 4.7483 8.6846 122.1137 54.4048 32.7273 175.0164 204 C 5.0258 8.5336 121.7902 55.4008 47.7122 172.4297 205 M 5.3203 8.5702 122.4473 53.6017 35.3381 174.5108 206 L 4.7899 8.4618 122.2244 53.2490 45.7457 175.3503 207 R 4.4460 8.2362 121.7675 54.2087 33.0828 174.2085 208 L 4.8002 8.0470 124.0725 53.3668 45.3650 175.1042 209 D 4.6198 8.2446 121.6210 52.8753 44.3107 175.2483 210 V 4.0190 8.3204 124.5625 63.0296 31.6943 174.9798 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 I 8.02 4.09 1.86 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 1.29 1.06 0.90 0.00 0.00 4 T 8.21 4.53 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 5 T 8.86 4.58 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 6 P 0.00 4.41 0.00 2.04 2.05 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 7 E 8.40 4.37 0.00 1.81 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 2.25 2.35 0.00 8 Q 7.96 3.96 0.00 1.67 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.18 0.00 9 R 8.64 4.93 0.00 1.72 1.91 0.00 3.18 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 10 I 8.89 4.48 1.90 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.04 0.90 0.00 0.00 11 E 8.88 5.02 0.00 1.97 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 2.20 2.32 0.00 12 K 9.11 4.82 0.00 1.62 1.61 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.46 7.81 13 A 8.60 4.95 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 14 K 8.27 4.07 0.00 1.89 1.69 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 15 G 10.32 4.01 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 16 E 7.57 5.38 0.00 1.98 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 2.27 2.22 0.00 17 T 8.40 5.12 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 18 A 9.11 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.42 5.07 0.00 2.89 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 20 L 7.86 3.91 0.00 0.84 0.63 0.34 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.46 0.00 2.16 1.99 0.00 3.28 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.02 0.00 22 C 9.27 5.14 0.00 3.32 3.30 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 23 K 8.25 5.20 0.00 1.72 1.68 0.00 1.80 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.50 7.81 24 F 8.73 5.10 0.00 3.03 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 25 T 8.56 4.70 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 1.23 0.00 0.00 26 L 8.61 4.32 0.00 1.72 1.66 1.05 0.94 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 27 S 8.90 4.87 0.00 4.01 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 28 P 0.00 4.42 0.00 2.04 2.14 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 29 E 8.16 4.04 0.00 1.94 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 2.32 2.40 0.00 30 D 8.53 4.74 0.00 2.79 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 31 Q 8.20 4.52 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 32 G 8.10 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 33 P 0.00 4.36 0.00 2.22 2.02 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 34 L 8.38 4.36 0.00 1.68 1.68 0.76 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.70 4.96 0.00 2.79 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.88 5.03 2.14 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.69 1.15 0.00 0.00 37 E 8.82 5.01 0.00 2.08 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 2.25 2.37 0.00 38 W 9.75 4.96 0.00 3.38 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 39 L 8.79 5.27 0.00 1.58 1.50 0.89 0.62 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 40 I 8.92 4.13 1.39 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.17 0.45 0.00 0.00 41 S 8.34 4.83 0.00 3.84 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.33 0.00 2.14 2.04 0.00 3.80 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 2.22 2.27 0.00 43 S 9.10 3.57 0.00 4.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.35 4.54 0.00 2.95 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 45 N 7.80 4.25 0.00 2.94 2.99 0.00 0.00 6.94 6.98 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 46 Q 8.67 4.44 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 47 I 7.21 4.18 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 1.18 0.52 0.90 0.00 0.00 48 V 7.18 4.45 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 0.75 0.00 0.00 0.92 0.00 0.00 49 D 8.51 5.26 0.00 2.53 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 50 Q 9.11 4.69 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 51 V 8.39 4.21 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 0.86 0.00 0.00 0.83 0.00 0.00 52 I 8.83 4.47 1.80 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.60 0.00 0.00 53 I 7.77 5.12 1.73 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.44 0.64 0.00 0.00 54 L 9.08 5.58 0.00 2.08 1.84 1.14 0.59 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 55 Y 9.46 5.16 0.00 3.20 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 56 S 9.18 4.64 0.00 4.03 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 57 G 9.20 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 0.00 0.00 0.00 58 D 8.16 3.92 0.00 2.77 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 59 K 7.36 4.34 0.00 1.65 1.23 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.20 1.48 7.81 60 I 7.87 4.53 1.88 0.00 0.00 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 1.81 0.53 1.09 0.00 0.00 61 Y 9.04 4.62 0.00 2.97 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 62 D 8.50 4.85 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.54 4.33 0.00 2.51 2.16 0.00 0.00 6.91 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 64 Y 6.31 4.88 0.00 3.14 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 65 Y 8.66 3.44 0.00 3.40 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 66 P 0.00 4.07 0.00 2.15 2.10 0.00 3.52 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 67 D 7.93 4.29 0.00 2.49 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 68 L 8.94 4.52 0.00 2.08 1.72 0.68 1.06 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 69 K 7.45 3.91 0.00 1.75 1.86 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.41 7.81 70 G 9.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.62 5.25 0.00 1.87 2.11 0.00 3.26 0.00 0.00 3.33 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.40 0.00 72 V 7.59 4.90 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.66 0.00 0.00 73 H 9.06 4.84 0.00 2.97 3.17 0.00 5.62 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 74 F 8.75 4.67 0.00 3.03 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 75 T 8.88 3.96 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 1.40 0.00 0.00 76 S 8.08 4.23 0.00 3.89 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 77 N 8.50 4.49 0.00 2.76 2.83 0.00 0.00 6.82 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 7.55 4.66 0.00 2.79 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 79 V 7.75 4.28 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.48 0.00 0.00 80 K 7.93 4.03 0.00 1.87 1.89 0.00 1.83 0.00 0.00 2.22 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.50 7.81 81 S 7.50 4.12 0.00 3.94 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.73 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 0.00 0.00 0.00 83 D 8.30 4.71 0.00 2.51 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 84 A 9.10 5.01 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 9.07 4.78 0.00 3.96 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 86 I 8.19 4.92 1.25 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 -0.30 -0.21 -0.11 0.00 0.00 87 N 9.40 5.30 0.00 2.55 2.68 0.00 0.00 6.78 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.78 4.54 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 0.86 0.00 0.00 0.49 0.00 0.00 89 T 9.38 5.01 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 90 N 8.44 4.60 0.00 2.82 2.84 0.00 0.00 7.38 7.78 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 91 L 8.73 4.27 0.00 1.72 1.57 0.86 0.96 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 92 Q 9.14 4.86 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 93 L 8.32 4.18 0.00 1.73 1.74 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.01 4.36 0.00 4.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 7.78 4.81 0.00 2.91 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 96 I 7.69 4.01 2.00 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 1.29 0.98 0.97 0.00 0.00 97 G 6.87 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.67 5.19 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 99 Y 9.88 5.17 0.00 3.18 3.16 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 0.00 100 Q 9.24 5.07 0.00 2.12 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 101 C 9.01 3.73 0.00 1.68 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 0.00 102 K 8.04 4.54 0.00 1.75 1.61 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.74 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.26 1.23 7.81 103 V 8.18 4.55 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 0.16 0.00 0.00 0.72 0.00 0.00 104 K 8.85 4.82 0.00 1.64 1.60 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.28 7.81 105 K 9.24 4.55 0.00 1.70 1.58 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.30 7.81 106 A 8.45 4.26 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 0.00 107 P 0.00 4.54 0.00 2.17 2.15 0.00 3.96 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 1.92 1.94 0.00 108 G 8.21 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 0.00 0.00 0.00 109 V 7.80 5.02 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 0.63 0.00 0.00 0.87 0.00 0.00 110 A 8.94 4.81 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 0.00 111 N 8.26 5.71 0.00 2.62 2.57 0.00 0.00 7.11 6.68 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 0.00 112 K 8.45 4.55 0.00 1.63 1.54 0.00 1.96 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.40 7.81 113 K 8.38 4.98 0.00 1.55 1.67 0.00 1.60 0.00 0.00 1.79 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.33 7.81 114 F 9.94 5.01 0.00 3.25 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 0.00 115 L 9.57 4.81 0.00 1.74 1.64 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.83 5.05 0.00 1.92 1.91 0.86 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.98 4.75 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 118 V 8.56 4.66 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 0.85 0.00 0.00 1.00 0.00 0.00 119 L 8.79 4.57 0.00 1.64 1.56 1.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.76 4.76 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 0.80 0.00 0.00 0.94 0.00 0.00 121 K 8.78 4.03 0.00 1.88 1.93 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.42 7.81 122 P 0.00 4.49 0.00 2.15 2.07 0.00 3.70 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 1.94 1.92 0.00 123 S 8.61 4.85 0.00 3.82 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 0.00 124 G 9.27 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 0.00 125 T 7.52 4.97 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 1.30 0.00 0.00 126 R 9.17 4.55 0.00 2.02 2.11 0.00 3.08 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 127 C 8.88 5.45 0.00 2.98 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.60 5.30 0.00 3.13 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 0.00 129 V 8.57 4.42 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 0.83 0.00 0.00 1.02 0.00 0.00 130 D 8.54 4.59 0.00 2.74 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 *136 G 7.59 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 0.00 137 N 7.89 4.58 0.00 2.56 1.54 0.00 0.00 6.46 8.49 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 0.00 138 D 7.11 5.11 0.00 2.63 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 0.00 139 F 7.93 4.50 0.00 3.06 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 0.00 140 K 8.54 4.81 0.00 1.65 1.59 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.44 7.81 141 L 8.53 4.56 0.00 0.95 1.33 0.69 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 142 K 8.45 4.78 0.00 1.16 0.74 0.00 1.23 0.00 0.00 1.58 0.00 0.00 2.69 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.04 1.16 7.81 143 C 8.89 5.38 0.00 2.26 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 0.00 144 E 9.33 4.70 0.00 2.17 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 2.33 2.32 0.00 145 P 0.00 5.07 0.00 2.16 2.09 0.00 3.96 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 146 K 8.25 4.22 0.00 1.88 1.66 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.33 7.81 147 E 8.31 4.40 0.00 2.02 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 2.31 2.27 0.00 148 G 7.94 4.43 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 0.00 149 S 8.13 4.56 0.00 3.93 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.28 4.46 0.00 1.67 1.64 0.96 1.12 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 0.00 151 P 0.00 4.47 0.00 2.16 2.07 0.00 3.74 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 1.96 1.97 0.00 152 L 8.26 4.40 0.00 1.39 0.96 0.94 0.76 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 0.00 153 Q 8.91 4.53 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 154 F 8.61 5.33 0.00 3.27 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 0.00 155 E 8.96 5.00 0.00 2.05 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 2.26 2.35 0.00 156 W 9.32 5.20 0.00 3.07 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 0.00 157 Q 8.10 4.23 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 158 K 8.72 4.49 0.00 1.62 1.50 0.00 1.89 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.06 7.81 *165 M 8.89 4.29 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 166 P 0.00 4.20 0.00 1.89 1.78 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 167 T 8.55 3.84 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 168 P 0.00 4.68 0.00 2.17 2.17 0.00 3.11 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.99 0.00 169 W 7.67 4.98 0.00 3.48 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 0.00 170 L 7.71 4.12 0.00 1.84 1.77 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.99 4.03 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 0.00 172 E 8.60 4.41 0.00 1.83 1.63 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 2.16 2.16 0.00 173 M 7.31 4.01 0.00 2.15 2.41 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 174 T 7.92 5.34 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 1.35 0.00 0.00 175 S 7.82 4.42 0.00 3.92 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.24 0.00 1.63 0.49 0.00 3.48 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.58 0.00 177 V 7.13 4.54 1.94 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 0.66 0.00 0.00 0.82 0.00 0.00 178 I 8.25 4.10 0.90 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 -0.36 -0.58 0.00 0.00 179 S 8.21 4.50 0.00 3.80 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 V 8.42 4.31 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 1.41 0.00 0.00 0.68 0.00 0.00 181 K 8.32 4.85 0.00 1.68 1.67 0.00 1.95 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.46 7.81 182 N 9.60 4.08 0.00 2.95 2.91 0.00 0.00 6.54 7.45 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 *191 Y 7.52 4.61 0.00 3.17 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 0.00 192 S 8.43 4.96 0.00 3.72 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 0.00 193 C 8.57 4.37 0.00 1.93 2.47 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 0.00 194 T 8.65 4.69 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 195 V 8.76 4.69 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 0.79 0.00 0.00 1.00 0.00 0.00 196 Q 8.94 4.92 0.00 2.02 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.22 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 197 N 8.42 5.13 0.00 2.78 2.76 0.00 0.00 6.92 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 0.00 198 R 8.47 4.61 0.00 1.79 1.96 0.00 3.17 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 199 V 8.46 4.41 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 0.64 0.00 0.00 0.95 0.00 0.00 200 G 7.07 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 0.00 201 S 7.74 5.64 0.00 3.68 3.72 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 0.00 202 D 7.88 4.49 0.00 2.85 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Q 8.68 4.75 0.00 1.89 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.52 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 204 C 8.53 5.03 0.00 2.84 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 0.00 205 M 8.57 5.32 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 206 L 8.46 4.79 0.00 1.59 1.44 1.02 0.81 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 0.00 207 R 8.24 4.45 0.00 1.65 1.67 0.00 3.17 0.00 0.00 3.12 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 208 L 8.05 4.80 0.00 1.48 1.41 0.44 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 209 D 8.24 4.62 0.00 2.60 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 0.00 210 V 8.32 4.02 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 0.89 0.00 0.00 0.86 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.