NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3443 8.0976 120.8638 56.4597 32.2626 177.4792 3 Q 3.9463 8.0126 116.3722 58.8512 28.3353 177.1710 4 R 3.8819 8.7271 120.7818 59.0755 30.6076 179.5139 5 D 4.3452 8.1573 118.1241 57.7534 40.8541 178.6258 6 D 4.3014 8.5375 119.4302 57.3552 40.7792 178.8438 7 S 4.0146 8.0869 113.5866 61.2598 62.3913 176.4706 8 K 3.6706 7.8184 121.1370 59.2587 31.7701 179.4556 9 R 4.0548 7.8716 118.6974 59.5233 30.0399 179.1176 10 I 3.3911 7.9751 119.5563 64.1591 37.0144 178.2751 11 A 3.8193 7.8369 121.5240 55.2112 18.1686 179.7927 12 F 4.2310 7.7764 116.1554 60.4583 39.0020 178.0250 13 L 3.7191 8.2991 118.9391 57.8531 41.3737 179.5011 14 E 3.9678 8.5076 118.5225 59.2066 29.3110 179.2096 15 A 3.9960 8.0821 120.9000 55.4661 18.3454 179.8640 16 T 3.8106 7.9343 114.1232 66.6538 68.4781 176.7350 17 V 3.5192 7.6243 120.1500 66.3054 31.4653 178.3264 18 R 3.9204 8.0773 117.2083 59.3538 29.9024 178.9329 19 E 4.0431 8.5632 118.7555 59.5812 29.5120 179.7430 20 V 3.7054 8.2738 118.2843 65.8581 31.3626 177.9582 21 A 4.1102 8.1515 119.9406 55.1230 18.2635 178.9361 22 D 4.4363 8.0744 116.5843 56.5509 41.1795 177.0508 23 H 4.7405 8.2772 112.7592 54.2306 30.7218 174.4530 24 G 3.8871 8.4571 106.0698 44.7647 0.0000 174.1440 25 F 4.5960 8.3683 116.3775 60.8798 39.2034 178.4436 26 S 4.2089 8.4426 114.6404 61.6771 62.6645 175.6465 27 A 4.1000 8.0221 120.4170 53.8574 18.5125 177.0654 28 T 4.3731 7.6146 113.0312 62.4062 68.6346 175.2151 29 S 4.7759 8.2154 121.9156 56.3379 66.5426 174.8248 30 V 3.5968 8.3900 121.4430 66.3807 31.0259 178.0092 31 G 3.7355 8.1664 104.5044 48.0797 0.0000 175.5626 32 K 4.0770 8.2256 121.0664 58.9541 32.0631 179.6621 33 I 3.7244 8.0335 120.0107 64.3071 37.0462 178.1660 34 A 4.3010 8.2153 121.7960 55.2761 18.2863 179.6339 35 K 3.8836 8.2009 117.7852 59.6406 32.0839 178.8737 36 A 4.0117 7.9979 119.7422 55.0136 18.3680 178.9500 37 A 4.0877 7.9618 117.6526 52.5892 18.6349 178.0725 38 G 3.7720 7.9049 104.9092 46.2123 0.0000 173.1813 39 L 4.8699 7.9020 117.8998 51.8539 45.9158 176.8492 40 S 4.7152 8.2966 114.7406 57.0081 65.8797 173.4352 41 P 4.0232 0.0000 0.0000 65.3678 30.7809 178.8098 42 A 4.1446 7.9854 118.6932 55.6244 18.5031 179.3147 43 T 4.0538 8.0066 114.1757 66.4962 68.5283 176.4693 44 L 2.9021 7.8900 122.3121 58.3311 41.7960 178.8510 45 Y 5.0981 7.4689 115.7835 60.1636 37.7590 178.1011 46 I 3.6605 7.2943 120.5659 63.8479 37.1491 176.3963 47 Y 4.2892 7.6385 115.4389 58.3861 39.3834 175.6605 48 Y 4.7368 7.4267 116.7608 55.8074 41.7895 175.3657 49 E 3.9562 9.2353 126.1151 59.1119 30.1139 176.1897 50 D 4.7758 7.6989 115.9967 51.2177 43.1480 175.6680 51 K 3.7463 8.6228 119.3279 59.7971 32.0629 177.6185 52 E 3.1254 8.1844 118.8319 59.5792 29.3727 178.8730 53 Q 4.0428 8.7320 118.0716 58.7879 28.6585 178.4900 54 L 3.5657 7.7911 121.4675 57.7890 41.9954 178.9120 55 L 4.1542 8.1259 120.8226 57.0898 41.4044 179.3272 56 L 3.7095 7.8198 119.9341 57.9901 42.0909 178.7065 57 A 4.1631 8.1573 120.8195 55.6770 18.2613 179.8006 58 T 3.7372 8.0800 114.3791 66.5261 68.3748 176.6501 59 F 4.0965 8.2242 122.7028 61.6234 39.1584 176.8821 60 Y 4.2373 7.9970 116.5241 60.9847 37.7338 177.5489 61 Y 4.1455 8.5828 121.0288 60.7269 38.9331 178.5166 62 V 3.3193 8.1003 119.3543 66.0132 31.7066 178.1111 63 S 3.8943 7.9132 115.1545 61.7115 62.5615 176.5115 64 D 4.3354 8.2560 121.7503 57.3219 40.6539 178.7928 65 Q 3.8537 7.6507 118.0350 58.9171 28.6283 179.2877 66 V 3.5715 7.5504 118.8381 66.1298 31.6054 178.1023 67 I 3.6736 8.1454 119.8794 64.5011 36.9205 178.1864 68 D 4.3500 8.3732 119.7010 57.2728 40.6609 178.7948 69 A 3.9810 7.9559 120.5942 54.9804 18.3336 179.3520 70 A 4.0566 8.2492 119.5428 55.5527 18.5046 179.8941 71 L 4.0457 8.3484 117.7558 57.9085 41.4566 179.2619 72 D 4.3814 8.0904 116.9504 57.5392 41.6388 178.2575 73 S 4.3003 8.2481 115.5873 61.5926 62.9748 176.2445 74 F 4.4295 8.7273 124.0114 61.5628 38.8867 177.2890 75 S 4.2310 8.2414 112.2663 60.8701 62.8451 175.8552 76 R 4.2343 7.7031 119.9170 56.2061 30.4720 176.7583 77 G 3.6314 7.2591 111.0850 45.3874 0.0000 175.1003 78 K 4.1077 8.4325 124.6846 56.1607 32.3089 174.6398 79 D 4.7862 7.3773 115.7912 51.2522 43.7381 175.7644 80 L 3.9655 8.4142 120.2054 58.4194 41.9704 178.5677 81 R 3.3939 7.7484 118.0015 59.3190 29.7450 177.9062 82 E 3.8095 8.5468 119.2834 58.8902 29.5424 178.8954 83 G 3.1925 7.9969 105.9139 47.8604 0.0000 175.7236 84 L 4.4127 8.2913 122.0645 57.2750 41.6635 179.7124 85 R 2.5100 7.8798 119.0826 58.8533 29.9099 178.8013 86 R 3.8888 8.1278 118.2414 59.3667 30.0146 178.7631 87 Q 4.1455 8.4584 119.4441 58.9083 28.9357 178.2770 88 W 4.2589 8.4958 129.4061 61.0071 30.9016 177.5458 89 H 4.2964 8.5231 116.1041 59.3577 28.0974 177.9439 90 T 3.9597 8.1484 117.3208 66.7406 68.2649 176.8031 91 L 4.1235 8.3240 121.1122 57.7524 41.6666 179.2967 92 F 3.8180 8.6067 121.0545 61.2232 39.2915 177.1804 93 R 3.9618 8.3449 118.3316 59.4571 29.8895 178.5233 94 I 3.7241 8.0513 119.8711 64.3503 37.0540 178.6182 95 G 2.2314 7.7624 106.6213 47.3218 0.0000 175.7370 96 L 4.0447 7.6555 120.2281 56.8268 41.6964 178.5022 97 E 4.3760 7.9981 117.1281 56.7159 31.6603 176.6102 98 R 4.7783 8.2015 117.1475 53.4102 30.8828 174.5079 99 P 4.1278 0.0000 0.0000 65.1604 31.5074 178.0255 100 E 4.1062 8.2297 116.8979 59.3066 29.2088 179.1695 101 L 4.0914 8.0543 119.9173 57.7436 41.7441 179.2879 102 F 4.3806 8.4368 117.2629 60.8079 38.8655 177.6044 103 R 4.1116 8.7185 118.7344 59.5256 29.4112 177.7798 104 Y 3.8912 8.6164 119.8659 60.9640 38.7488 177.6501 105 H 4.5046 8.5780 119.1078 59.3998 29.8882 176.8296 106 E 3.9759 8.5322 121.0673 59.6331 29.2781 178.9095 107 T 3.8657 7.9095 114.6628 66.4841 68.8007 176.2132 108 F 4.3436 8.4235 122.9309 61.6616 39.3140 177.3613 109 T 3.9315 8.3324 108.0903 64.1923 68.3505 174.8278 110 H 4.8222 7.7068 117.9805 54.5327 29.7444 174.0542 111 S 4.6515 7.3285 114.9126 55.9865 65.4172 173.8486 112 A 3.9139 7.8984 121.3036 53.0709 18.4987 177.9354 113 W 4.2489 6.7696 117.6237 55.9427 28.3798 176.5065 *115 T 4.1358 7.3389 109.3495 60.8831 71.0786 172.4951 116 P 4.2435 0.0000 0.0000 65.8408 31.3620 178.5228 117 E 3.9656 8.2217 117.5992 59.3384 29.5396 178.9116 118 I 3.9913 7.6905 119.3962 64.3816 37.1453 178.0007 119 Q 4.0415 8.3266 120.2516 59.3647 28.8342 178.3606 120 A 3.9744 8.3548 121.9302 55.0270 18.3900 179.5441 121 R 3.8174 8.1577 117.1514 59.8259 30.2331 178.5712 122 N 4.4102 8.3287 116.2350 56.3455 38.2992 177.1931 123 E 3.8966 8.2853 119.4153 59.4174 29.8133 179.0852 124 S 4.1902 8.4610 113.4975 61.4491 62.2756 176.2020 125 R 3.9123 7.8795 119.8887 58.9785 29.9909 177.2632 126 A 4.3954 8.0208 118.7534 51.8986 18.5395 178.4154 127 A 3.9039 7.7296 123.8670 56.5903 18.4575 180.4593 128 N 4.2175 8.1523 114.0329 56.2816 38.5994 177.2713 129 L 3.2368 7.6473 121.1568 57.9507 42.2865 178.7018 130 L 4.0604 7.9731 118.8811 58.0743 41.6035 179.4451 131 N 4.3450 9.0073 116.6272 56.0747 38.5275 177.3192 132 A 4.1361 7.9956 121.8320 55.2267 18.5589 179.8550 133 V 3.7020 8.0808 116.7485 66.2552 31.6654 177.5240 134 D 4.4192 8.4724 118.0519 57.6998 41.0748 178.2036 135 Q 4.1807 8.4956 119.9302 59.0086 28.9091 178.3965 136 G 3.9001 8.1495 106.7143 47.2605 0.0000 176.0326 137 K 4.6114 7.9711 122.2319 59.1947 31.8660 179.4747 138 Q 4.1267 7.9836 117.5471 58.3587 28.8121 178.0064 139 S 4.5484 8.2551 113.8718 58.4912 63.3698 175.7076 140 G 4.0796 7.6832 109.8575 45.4379 0.0000 174.2830 141 L 4.3205 7.9256 120.9728 56.6203 43.3238 176.8193 142 I 4.6625 7.9279 119.6548 58.7276 39.8680 175.7096 143 K 4.0884 8.6404 126.2768 56.6192 32.4729 176.2931 144 P 4.6005 0.0000 0.0000 61.4293 29.9749 175.3894 145 V 4.5597 7.2763 117.1422 59.1255 35.9245 174.0963 146 P 4.4745 0.0000 0.0000 62.6361 32.0373 177.4142 147 F 3.9315 9.0889 122.7419 61.1208 39.2129 175.5620 148 P 4.3105 0.0000 0.0000 65.8643 31.0219 178.4502 149 L 4.0944 7.8797 117.0668 57.6524 41.3234 179.4978 150 L 3.9345 7.5353 117.5415 57.6736 41.9187 178.5833 151 E 4.3929 8.1002 119.6048 59.7539 29.3397 178.8761 152 T 3.7916 7.6729 114.4535 66.1271 68.4694 175.6579 153 F 4.6833 7.4926 116.1895 57.4968 39.6891 176.7645 *155 F 4.9222 7.8027 119.1026 57.7080 40.7187 177.3463 156 R 3.9590 8.5927 120.3938 59.0865 29.6750 176.6659 157 P 4.3789 0.0000 0.0000 65.2243 31.1599 178.5367 158 I 3.2352 7.4263 118.5989 64.3248 36.9834 177.2624 159 Y 4.0340 8.0393 119.7690 61.2592 38.4907 177.7953 160 H 4.2108 8.1496 118.7988 59.3906 29.9238 177.2720 161 L 3.9984 8.1421 120.9475 57.5279 41.4728 179.3949 162 V 3.3562 7.5674 118.5821 65.9642 31.2611 177.8115 163 Q 3.8040 7.7152 119.0032 59.3649 28.9236 178.5579 164 R 3.9232 7.9375 118.9644 59.3378 30.0532 178.9058 165 C 5.1087 8.4634 118.1494 62.6351 27.9967 176.2497 166 L 4.0702 7.8656 119.1691 57.5363 41.2778 178.7125 167 Q 4.3278 8.1728 115.5434 55.8183 28.8973 176.9030 168 G 3.9356 7.7784 108.3460 45.7686 0.0000 174.2672 169 S 4.6717 7.9278 112.3686 57.6147 63.6761 173.7093 170 F 4.8777 7.6338 121.0822 57.7152 41.8202 172.1861 171 E 4.5830 8.1553 126.6309 54.8378 30.7313 177.3726 172 G 3.7740 8.2193 117.0750 45.1638 0.0000 173.7576 173 T 4.1392 7.0115 109.7245 60.9174 71.7260 174.6555 174 D 4.3575 8.4880 121.7409 57.7134 40.8387 179.0105 175 E 3.9896 8.0339 118.4660 59.8635 29.5578 179.0251 176 H 4.5122 8.2004 116.1778 58.7727 28.7573 177.9867 177 I 3.7203 8.1143 122.2812 64.1535 36.8194 178.0931 178 E 4.0163 8.4383 120.2032 59.2813 29.3210 178.5480 179 L 3.9991 7.9174 117.5468 58.0523 41.8257 179.1803 180 A 4.2435 8.0553 119.0637 55.0948 18.7043 179.0882 181 F 2.4723 8.0312 119.0141 60.8171 39.2821 177.2745 182 N 4.0754 8.1823 113.8689 54.2941 38.9397 176.4264 *184 A 4.2398 7.9107 125.1440 52.0220 20.7314 179.6279 185 W 3.7950 7.8272 125.6817 60.5783 30.8998 177.7029 186 D 4.0859 7.9444 116.5277 57.3095 40.5084 178.0682 187 A 3.7639 7.7781 120.4740 54.8328 18.5467 178.6048 188 V 3.7230 7.1178 106.9654 61.8853 32.3977 175.8792 189 A 3.9138 7.0347 122.9466 51.2555 18.5549 176.9630 190 D 4.3078 8.5203 123.8122 54.1824 42.1000 176.4308 191 R 4.2765 8.3935 123.3899 56.3209 30.0068 176.2541 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 R 8.10 4.34 0.00 1.88 2.00 0.00 3.16 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 3 Q 8.01 3.95 0.00 2.43 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 4 R 8.73 3.88 0.00 1.87 2.04 0.00 3.29 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 5 D 8.16 4.35 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 6 D 8.54 4.30 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.09 4.01 0.00 3.94 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 8 K 7.82 3.67 0.00 1.57 1.56 0.00 1.88 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.53 7.81 9 R 7.87 4.05 0.00 1.87 2.00 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.36 0.00 10 I 7.98 3.39 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.87 0.86 0.00 0.00 11 A 7.84 3.82 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 12 F 7.78 4.23 0.00 3.21 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 13 L 8.30 3.72 0.00 1.01 0.93 0.56 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.51 3.97 0.00 1.92 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 15 A 8.08 4.00 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 16 T 7.93 3.81 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 1.29 0.00 0.00 17 V 7.62 3.52 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 1.20 0.00 0.00 0.79 0.00 0.00 18 R 8.08 3.92 0.00 2.05 1.97 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 19 E 8.56 4.04 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 20 V 8.27 3.71 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 0.22 0.00 0.00 1.15 0.00 0.00 21 A 8.15 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.07 4.44 0.00 2.52 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.28 4.74 0.00 3.21 3.26 0.00 5.70 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 24 G 8.46 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 F 8.37 4.60 0.00 3.27 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.44 4.21 0.00 3.93 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 27 A 8.02 4.10 1.31 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 0.00 0.00 0.00 28 T 7.61 4.37 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 29 S 8.22 4.78 0.00 4.07 4.02 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 30 V 8.39 3.60 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 0.84 0.00 0.00 0.95 0.00 0.00 31 G 8.17 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.23 4.08 0.00 1.99 1.89 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.49 7.81 33 I 8.03 3.72 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.11 0.98 0.00 0.00 34 A 8.22 4.30 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.20 3.88 0.00 1.87 1.90 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 36 A 8.00 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.96 4.09 1.13 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 38 G 7.90 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.90 4.87 0.00 1.62 1.68 0.23 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.30 4.72 0.00 4.09 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 41 P 0.00 4.02 0.00 2.16 1.97 0.00 3.63 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 2.13 2.13 0.00 42 A 7.99 4.14 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.01 4.05 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 44 L 7.89 2.90 0.00 1.16 1.25 0.60 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.47 5.10 0.00 3.11 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.29 3.66 1.56 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.56 0.16 0.00 0.00 47 Y 7.64 4.29 0.00 2.78 2.40 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 48 Y 7.43 4.74 0.00 2.89 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 49 E 9.24 3.96 0.00 1.95 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 2.32 2.39 0.00 50 D 7.70 4.78 0.00 3.01 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 51 K 8.62 3.75 0.00 1.88 1.88 0.00 1.82 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.42 1.51 7.81 52 E 8.18 3.13 0.00 2.07 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 2.35 2.30 0.00 53 Q 8.73 4.04 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 54 L 7.79 3.57 0.00 1.44 1.61 -0.20 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.13 4.15 0.00 1.39 1.67 0.06 0.67 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 56 L 7.82 3.71 0.00 1.78 1.80 0.58 1.23 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 57 A 8.16 4.16 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.08 3.74 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 0.43 0.00 0.00 59 F 8.22 4.10 0.00 2.06 2.40 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 60 Y 8.00 4.24 0.00 3.20 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 61 Y 8.58 4.15 0.00 2.99 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 62 V 8.10 3.32 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 1.06 0.00 0.00 0.86 0.00 0.00 63 S 7.91 3.89 0.00 3.66 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 64 D 8.26 4.34 0.00 2.67 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 65 Q 7.65 3.85 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.10 1.93 0.00 66 V 7.55 3.57 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 1.15 0.00 0.00 1.04 0.00 0.00 67 I 8.15 3.67 1.89 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.53 0.88 0.00 0.00 68 D 8.37 4.35 0.00 2.74 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 69 A 7.96 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.25 4.06 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.35 4.05 0.00 1.90 1.80 1.00 0.81 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 72 D 8.09 4.38 0.00 2.79 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 73 S 8.25 4.30 0.00 4.17 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.73 4.43 0.00 3.27 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.24 4.23 0.00 4.12 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 0.00 76 R 7.70 4.23 0.00 1.95 1.98 0.00 3.16 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 77 G 7.26 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 78 K 8.43 4.11 0.00 1.79 1.73 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 0.99 7.81 79 D 7.38 4.79 0.00 2.84 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 80 L 8.41 3.97 0.00 1.93 1.89 1.35 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.75 3.39 0.00 0.67 1.48 0.00 2.21 0.00 0.00 2.77 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.50 0.00 82 E 8.55 3.81 0.00 1.96 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 2.23 0.00 83 G 8.00 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 84 L 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0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.54 1.00 0.00 0.00 119 Q 8.33 4.04 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 120 A 8.35 3.97 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 0.00 121 R 8.16 3.82 0.00 2.08 2.32 0.00 3.26 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 122 N 8.33 4.41 0.00 3.12 2.90 0.00 0.00 7.10 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 0.00 123 E 8.29 3.90 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 124 S 8.46 4.19 0.00 3.89 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 0.00 125 R 7.88 3.91 0.00 1.82 2.01 0.00 3.27 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 126 A 8.02 4.40 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.73 3.90 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.15 4.22 0.00 2.79 3.00 0.00 0.00 6.71 6.74 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 0.00 129 L 7.65 3.24 0.00 1.40 1.73 0.52 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.97 4.06 0.00 1.66 1.59 0.77 0.52 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 0.00 131 N 9.01 4.34 0.00 2.78 2.91 0.00 0.00 6.94 7.29 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 0.00 132 A 8.00 4.14 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 8.08 3.70 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.17 0.00 0.00 134 D 8.47 4.42 0.00 2.96 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 0.00 135 Q 8.50 4.18 0.00 2.33 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 136 G 8.15 3.90 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 0.00 137 K 7.97 4.61 0.00 2.11 1.91 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.69 1.53 7.81 138 Q 7.98 4.13 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 139 S 8.26 4.55 0.00 4.12 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 0.00 140 G 7.68 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 0.00 141 L 7.93 4.32 0.00 1.88 1.91 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.93 4.66 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.41 0.93 0.00 0.00 143 K 8.64 4.09 0.00 1.48 1.71 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.40 7.81 144 P 0.00 4.60 0.00 2.18 2.09 0.00 3.67 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 1.96 1.97 0.00 145 V 7.28 4.56 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 0.74 0.00 0.00 0.97 0.00 0.00 146 P 0.00 4.47 0.00 2.23 2.04 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 147 F 9.09 3.93 0.00 3.23 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 P 0.00 4.31 0.00 2.23 2.14 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 149 L 7.88 4.09 0.00 1.92 1.82 0.96 0.61 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 0.00 150 L 7.54 3.93 0.00 1.13 1.53 0.98 0.80 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 0.00 151 E 8.10 4.39 0.00 1.89 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 152 T 7.67 3.79 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 0.60 0.00 0.00 153 F 7.49 4.68 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 *155 F 7.80 4.92 0.00 3.26 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 0.00 156 R 8.59 3.96 0.00 2.12 2.09 0.00 3.11 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 157 P 0.00 4.38 0.00 2.54 2.28 0.00 3.76 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.32 0.00 158 I 7.43 3.24 1.77 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 -0.18 0.58 0.00 0.00 159 Y 8.04 4.03 0.00 3.01 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 0.00 160 H 8.15 4.21 0.00 3.32 3.49 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.14 4.00 0.00 1.93 2.15 1.19 0.20 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 0.00 162 V 7.57 3.36 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 0.67 0.00 0.00 0.09 0.00 0.00 163 Q 7.72 3.80 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 164 R 7.94 3.92 0.00 2.08 2.04 0.00 3.08 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 165 C 8.46 5.11 0.00 3.25 3.07 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 0.00 166 L 7.87 4.07 0.00 1.57 1.69 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.17 4.33 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.87 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 168 G 7.78 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 0.00 169 S 7.93 4.67 0.00 4.05 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 0.00 170 F 7.63 4.88 0.00 2.97 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 0.00 171 E 8.16 4.58 0.00 1.86 1.69 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 2.18 2.24 0.00 172 G 8.22 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 7.01 4.14 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 174 D 8.49 4.36 0.00 2.68 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 0.00 175 E 8.03 3.99 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 176 H 8.20 4.51 0.00 3.18 3.48 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 I 8.11 3.72 1.71 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.37 0.76 0.00 0.00 178 E 8.44 4.02 0.00 2.28 2.17 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 2.35 2.46 0.00 179 L 7.92 4.00 0.00 1.97 1.82 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.06 4.24 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 0.00 0.00 0.00 0.00 0.00 181 F 8.03 2.47 0.00 1.76 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 0.00 182 N 8.18 4.08 0.00 2.87 2.81 0.00 0.00 6.93 6.74 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 *184 A 7.91 4.24 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 W 7.83 3.79 0.00 2.61 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 0.00 186 D 7.94 4.09 0.00 2.59 2.61 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 0.00 187 A 7.78 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.12 3.72 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 0.58 0.00 0.00 0.61 0.00 0.00 189 A 7.03 3.91 0.48 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 0.00 190 D 8.52 4.31 0.00 2.57 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 0.00 191 R 8.39 4.28 0.00 1.68 1.77 0.00 3.41 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 * Residues marked with a * may have inaccurate shift predictions.