NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 Y 4.4716 8.1401 119.1539 56.1863 39.5271 174.3679 2 A 4.6869 7.6216 122.2781 49.4325 21.5042 173.0850 3 L 4.6815 8.1341 117.0369 53.7353 45.9531 174.8899 4 T 4.5839 8.2684 115.9885 59.5949 70.8178 173.3934 5 E 3.2499 8.3360 124.9660 56.8591 30.2729 176.7604 6 G 3.8313 8.4074 114.8039 45.1306 0.0000 173.6525 7 E 4.2811 7.7203 118.2112 57.7497 30.8952 176.0348 8 D 4.9169 7.4031 116.4751 54.8325 43.2198 175.2793 9 Y 5.0529 6.9537 114.5039 56.2281 41.3120 172.9415 10 L 4.7782 8.8712 120.2607 52.7912 45.1392 176.4297 11 V 4.7476 8.6697 124.3462 62.1588 31.3614 174.9468 12 L 3.7428 9.2829 129.4567 57.6300 40.1462 179.2224 13 D 3.5976 7.7386 121.2345 52.2667 42.8152 175.5837 14 K 4.4971 7.6556 125.0304 53.1699 34.1894 174.2295 15 P 4.4660 0.0000 0.0000 63.0667 32.0612 175.9062 16 I 3.8282 8.6583 123.8877 59.6537 38.6468 173.4514 17 P 4.5567 0.0000 0.0000 62.2882 32.3672 176.3331 18 Q 4.4487 8.7452 122.3393 56.2226 29.5064 176.1993 19 E 4.7736 8.3025 114.1805 56.1934 29.9742 177.2036 20 Q 4.4887 7.6818 118.6008 55.7407 31.0150 172.6142 21 S 4.0513 8.4578 117.0824 58.0247 63.0887 172.3848 22 G 3.5886 8.4975 118.9374 44.4634 0.0000 173.7487 23 K 4.7244 6.9556 118.1573 54.0485 35.1496 176.0250 24 I 4.1413 9.1098 124.0126 60.9332 38.0391 175.0892 25 E 3.9033 9.0577 128.9339 55.3328 30.8852 175.6315 26 V 4.1528 8.0712 127.0827 61.3112 33.4259 173.7961 27 L 5.0389 8.7263 131.0113 53.1704 44.9032 174.6580 28 E 5.1113 8.6567 125.6938 54.5417 32.9736 174.2381 29 F 5.1122 9.2114 126.5199 56.9434 40.8925 175.1690 30 F 5.1764 8.2804 117.0299 56.4890 41.8112 172.8708 31 G 3.0941 8.1605 102.9814 45.1132 0.0000 174.3355 32 Y 4.1363 7.9409 120.4326 59.7397 38.1973 177.1650 33 F 5.0056 7.0054 113.6864 56.8091 38.4877 174.9967 34 C 4.7625 7.8942 122.6766 57.8037 32.9716 174.1658 35 V 2.7447 7.9787 127.5896 66.2488 31.1832 177.3617 36 H 3.9119 7.7682 115.3094 59.0003 28.4550 177.2568 37 C 3.9632 7.7820 117.6979 63.1284 27.8715 175.1395 38 H 2.5800 7.8347 118.5843 59.5702 29.3215 176.4211 39 H 4.3285 7.7240 116.2197 58.2536 28.9464 177.2032 40 F 4.4047 8.2972 122.9622 60.8514 39.1103 176.6825 41 D 4.0894 8.1902 118.3350 57.1748 40.9655 177.2985 42 P 4.0095 0.0000 0.0000 65.3467 30.9623 178.6503 43 L 3.9514 7.6174 117.8607 57.0360 41.3525 179.1144 44 L 3.6912 6.9416 120.0136 57.8710 42.4060 178.3657 45 L 3.9760 8.3733 119.4144 57.9376 41.4260 179.6177 46 K 3.9635 8.0370 119.3968 59.2233 31.9963 178.6570 47 L 4.0011 7.6777 120.3268 58.0945 41.8685 178.8214 48 G 4.0640 8.1138 104.7663 48.1311 0.0000 175.2453 49 K 4.0904 7.8732 119.3366 58.9629 32.1738 178.9142 50 A 4.1128 7.6194 119.5651 53.8922 18.5519 178.1935 51 L 3.7780 7.5848 115.9309 54.6577 42.3753 175.8107 52 P 4.4923 0.0000 0.0000 62.2041 32.0104 177.3011 53 S 4.1409 8.6726 114.5348 61.6657 62.8222 175.0918 54 D 4.6548 8.1338 117.8055 53.3974 39.2778 174.7778 55 A 5.7638 8.2401 120.5203 50.4684 22.7918 175.2040 56 Y 4.7842 8.2857 114.7907 56.0822 41.3748 173.3551 57 L 4.7048 8.5431 123.4941 53.8891 43.1078 175.4251 58 R 4.6919 8.6996 128.1951 55.2820 32.1668 175.1134 59 T 5.2388 8.1469 113.7980 60.3052 72.1255 172.8297 60 E 4.4623 9.4230 123.3448 55.0207 34.2282 174.2335 61 H 3.8090 8.3580 124.0186 54.0530 29.6044 173.6292 62 V 3.2792 7.0240 116.7225 60.3176 32.0296 175.8467 63 V 4.3333 8.2815 124.5819 60.9168 33.5722 175.3130 64 W 5.2177 8.7943 123.6933 56.5325 32.2848 175.3105 65 Q 4.6358 7.9652 116.2385 53.5526 29.7788 174.6429 66 P 4.1341 0.0000 0.0000 64.3874 32.4873 176.1915 67 E 4.5644 8.0350 118.5575 55.0112 29.1339 175.5152 *69 L 4.3335 7.6598 121.5924 54.7767 44.4100 180.0630 70 G 4.4033 8.2703 105.5970 48.3826 0.0000 174.6115 71 L 4.1339 7.9678 118.6179 57.1940 42.1326 178.4326 72 A 3.9040 7.7665 121.2100 55.1168 18.5645 179.6545 73 R 3.9904 8.4696 115.4110 56.5722 29.6795 178.2607 *75 A 4.4858 8.4782 119.8165 51.8721 20.6669 179.4221 76 A 3.9630 8.5336 117.5979 55.4731 18.2420 179.2998 77 A 3.9519 8.8063 119.7764 55.6028 18.3947 179.6760 78 V 3.6632 7.9383 116.8792 65.4513 31.4704 177.6775 79 N 4.2389 8.3116 116.2567 56.7480 38.7004 176.6880 80 L 4.0335 8.2682 119.5661 57.9065 41.8057 179.4681 81 S 4.3677 9.1319 114.0271 58.9920 62.7004 175.7718 82 G 4.0402 7.8029 110.3386 46.6883 0.0000 174.4167 83 L 4.5716 7.5533 118.7039 54.5117 41.7098 178.1956 84 K 3.4761 7.8759 123.0844 59.7876 31.8280 178.1356 85 Y 4.2211 7.8495 115.2158 59.8961 37.9300 176.8412 86 Q 4.5557 7.8082 116.4209 56.1855 31.3908 176.9759 87 A 3.2231 8.5449 122.6781 54.6433 18.6028 178.5315 88 N 4.1495 7.8163 114.1470 56.8029 38.5877 175.3488 89 P 4.4165 0.0000 0.0000 65.9502 31.5842 178.6563 90 A 4.2415 8.1416 118.9173 55.1529 18.3901 179.7466 91 V 3.2463 8.5233 117.0985 65.9731 31.4920 178.1176 92 F 4.0676 8.5824 117.9120 60.7284 38.8146 177.4623 93 K 3.8812 8.6926 119.1892 59.6677 31.7936 178.5452 94 A 4.3537 7.7173 122.1112 54.3726 18.1597 179.5719 95 V 3.4902 7.5967 116.8735 66.0810 31.5087 177.7520 96 Y 4.0121 8.2613 118.8643 60.7091 38.9463 176.8839 97 E 4.1248 8.2009 117.3423 59.5002 29.9436 178.0355 98 Q 4.2230 8.3342 115.9240 55.5036 29.3127 176.9971 99 K 3.9757 7.6920 116.0588 57.1710 30.0715 175.6032 100 I 3.9017 7.9243 120.4121 61.2958 37.7623 177.1661 101 R 4.2908 8.1716 124.7689 55.1537 28.6109 176.5960 102 L 4.2629 7.7825 118.9704 54.8686 42.7185 177.8989 103 E 4.0321 8.2405 119.8815 59.0824 29.8319 176.3911 104 N 4.9834 7.8729 117.4781 52.0333 40.2665 175.1252 105 R 3.9755 8.8459 130.4988 60.7680 30.2798 178.4798 106 S 4.0776 8.3056 117.3182 63.6986 61.9936 178.0080 107 V 3.7590 7.9443 120.8099 66.0456 31.2162 177.9424 108 A 4.0553 8.0024 120.1999 55.3270 18.0394 179.7879 109 G 3.5303 8.0428 103.7533 47.9853 0.0000 175.9101 110 K 3.9158 7.8858 121.4963 58.1675 32.3889 178.5409 111 W 4.1788 8.5766 129.1774 60.3207 30.4386 177.5128 112 A 3.7546 8.8800 121.4368 55.5906 17.5608 179.7273 113 L 3.9774 7.9793 118.2770 58.3585 41.7178 180.2587 114 S 4.1307 7.6315 118.0223 62.0348 62.4031 178.2690 115 Q 3.9232 6.0968 117.7887 56.3480 28.7718 176.6281 116 K 4.3990 8.0254 115.5768 56.4245 33.8738 176.8536 117 G 4.0727 7.2096 106.3286 45.2054 0.0000 172.6528 118 F 4.5676 7.0150 112.4908 55.7708 39.3797 172.3397 119 D 3.9234 8.5427 118.9673 53.7158 40.9509 177.1715 120 G 4.1179 8.6097 112.7654 45.7462 0.0000 174.6930 121 K 4.0606 8.0326 119.8106 59.5460 32.7540 177.9595 122 K 4.0839 8.0172 117.2489 59.7092 32.1122 179.4191 123 L 3.9729 8.1639 117.4156 56.4698 42.0986 178.5687 *125 R 4.5363 8.0420 115.7471 55.8938 32.1760 177.4506 126 A 4.0383 8.5228 120.7570 55.5934 18.6813 178.9487 127 Y 4.0074 8.9441 116.7402 61.1650 38.7177 177.0333 128 D 4.7953 7.9651 116.1731 54.6133 41.0165 177.1466 129 S 4.5975 7.9584 116.3464 57.0242 65.5308 173.3737 130 P 4.3100 0.0000 0.0000 65.6450 31.1758 178.5345 131 E 3.8725 8.1712 118.0572 59.4439 29.5243 178.3652 132 A 3.8594 8.4929 120.5621 55.6153 18.4707 179.4509 133 A 3.8580 8.0102 118.1628 55.0390 18.3305 179.6878 134 A 3.9963 7.7209 118.9966 54.9234 18.5209 179.3646 135 A 3.9158 8.2615 118.5435 55.6390 18.4327 179.2618 136 A 3.9587 7.6773 117.9426 55.4230 18.8946 179.6460 137 L 4.1053 7.7246 115.9147 56.9685 41.5816 179.2358 138 K 4.2280 7.7061 118.1425 57.2112 31.6968 177.7888 *140 Q 4.1751 7.9568 120.5385 55.6645 30.9419 177.0155 141 K 3.9736 7.8993 117.8142 59.7507 32.1767 178.6973 142 L 4.3313 8.3488 119.4150 58.5440 41.6266 179.1777 143 T 3.7907 8.0513 115.2261 66.6390 68.2482 176.0086 144 E 3.9747 8.2398 119.9318 59.6885 29.5455 179.2803 145 Q 3.7906 8.1771 118.7209 58.9706 29.0745 176.9723 146 Y 4.5009 8.1920 114.7039 57.5212 38.2975 176.3797 147 R 3.8002 7.5582 116.5120 57.1156 27.2764 180.6427 148 I 4.0759 7.5354 120.1139 61.7994 37.4205 176.5044 149 D 4.8799 8.4584 125.0150 52.4285 40.1338 175.0190 150 S 4.8980 8.0490 110.3700 58.5525 65.0875 174.4581 151 T 5.0928 8.6265 112.2695 59.3945 71.6075 171.4423 152 P 4.9237 0.0000 0.0000 62.8212 33.0624 175.1097 153 T 4.8794 8.7446 118.4137 61.9527 71.4122 173.4524 154 V 4.8923 8.6629 125.3473 61.4318 34.4778 173.8301 155 I 4.7449 8.4874 129.7981 60.1058 38.9244 175.9523 156 V 3.9843 9.2688 130.1953 62.4632 29.8308 173.6673 157 G 3.9524 7.8582 108.9758 44.2594 0.0000 170.9284 158 G 4.2696 8.0501 119.1731 43.8182 0.0000 171.7059 159 K 4.6999 7.7601 116.7417 55.6884 35.4794 175.1553 160 Y 5.3106 7.8557 119.5246 56.5081 40.0956 174.3298 161 R 4.9260 8.9202 125.7938 54.5419 31.8837 175.6083 162 V 3.9574 9.1288 127.8871 62.8679 32.4357 175.2077 163 I 4.1683 7.8215 127.8403 58.8747 38.9753 176.9570 164 F 4.4587 7.9057 130.8746 56.7722 37.8277 176.7107 165 N 4.6625 7.7097 115.5995 54.4439 39.4909 175.6449 166 N 4.9058 7.6270 115.4632 51.5779 37.6525 175.3198 167 G 4.0534 7.8723 103.3906 48.0163 0.0000 174.4242 168 F 3.4013 8.2390 119.7828 59.8592 38.7546 177.5833 169 D 4.7039 8.4454 118.7477 56.7989 38.5785 178.9262 170 G 3.7901 8.2205 106.4098 46.8773 0.0000 175.6059 171 G 3.7606 8.3637 107.6598 47.1177 0.0000 176.3505 172 V 3.8249 7.7241 114.7886 64.7476 31.6421 177.7752 173 H 4.2425 8.3549 117.4886 59.8056 29.7136 177.3062 174 T 3.7627 7.5228 117.1076 66.5181 68.2646 176.8146 175 I 3.7124 8.1542 122.1543 64.4461 36.6513 178.6328 176 K 4.0447 8.2825 119.2374 59.4289 31.8537 179.0763 177 E 4.1470 8.1031 118.3003 58.6063 29.4210 179.0201 178 L 3.9223 7.7444 119.4948 57.4205 41.7049 179.5959 179 V 3.7053 7.9975 112.2520 63.9496 31.3770 178.5376 180 A 3.9617 7.6900 119.7086 55.2680 18.2852 179.1978 181 K 3.7174 8.0755 116.8468 60.0299 31.9564 179.2716 182 V 3.6116 8.1516 117.7049 67.0696 31.3015 177.5370 183 R 3.8399 8.0265 114.6434 60.9273 29.8644 177.5823 184 E 4.0219 8.6457 120.1888 59.4910 29.8934 179.4456 185 E 4.0121 8.1937 118.7457 59.6010 29.8085 177.6304 186 R 4.0868 8.8268 123.2575 56.5309 30.1607 175.8533 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 *1 Y 8.14 4.47 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 A 7.62 4.69 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 3 L 8.13 4.68 0.00 1.54 1.49 0.78 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.27 4.58 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 1.20 0.00 0.00 5 E 8.34 3.25 0.00 1.60 1.66 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 1.87 1.47 0.00 6 G 8.41 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 7 E 7.72 4.28 0.00 1.84 2.00 0.00 0.00 0.00 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 2.25 0.00 8 D 7.40 4.92 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 6.95 5.05 0.00 3.02 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 10 L 8.87 4.78 0.00 1.58 1.58 0.91 0.73 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 11 V 8.67 4.75 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.41 0.00 0.00 12 L 9.28 3.74 0.00 1.75 1.76 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.74 3.60 0.00 2.89 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.66 4.50 0.00 1.93 1.89 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.40 1.68 7.81 15 P 0.00 4.47 0.00 1.97 2.11 0.00 3.71 0.00 0.00 3.97 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 16 I 8.66 3.83 1.67 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.36 0.63 0.00 0.00 17 P 0.00 4.56 0.00 2.09 2.08 0.00 3.49 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 2.09 2.22 0.00 18 Q 8.75 4.45 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 19 E 8.30 4.77 0.00 2.06 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 2.64 2.35 0.00 20 Q 7.68 4.49 0.00 1.70 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.07 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 21 S 8.46 4.05 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 22 G 8.50 3.59 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 0.00 23 K 6.96 4.72 0.00 1.68 1.95 0.00 1.51 0.00 0.00 1.36 0.00 0.00 3.23 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.36 7.81 24 I 9.11 4.14 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 1.15 1.38 0.93 0.00 0.00 25 E 9.06 3.90 0.00 2.00 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 2.03 1.68 0.00 26 V 8.07 4.15 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 0.77 0.00 0.00 0.88 0.00 0.00 27 L 8.73 5.04 0.00 1.76 1.49 0.41 0.67 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 28 E 8.66 5.11 0.00 2.12 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 2.38 2.48 0.00 29 F 9.21 5.11 0.00 3.05 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 30 F 8.28 5.18 0.00 3.00 3.48 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 31 G 8.16 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 0.00 0.00 0.00 32 Y 7.94 4.14 0.00 2.93 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 33 F 7.01 5.01 0.00 3.25 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 34 C 7.89 4.76 0.00 3.05 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 35 V 7.98 2.74 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 0.78 0.00 0.00 -0.02 0.00 0.00 36 H 7.77 3.91 0.00 2.81 2.28 0.00 5.68 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 37 C 7.78 3.96 0.00 3.31 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 38 H 7.83 2.58 0.00 2.84 3.02 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 H 7.72 4.33 0.00 3.05 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.30 4.40 0.00 2.89 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.19 4.09 0.00 2.46 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.01 0.00 2.10 2.02 0.00 3.65 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 1.99 2.06 0.00 43 L 7.62 3.95 0.00 1.57 1.51 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 44 L 6.94 3.69 0.00 0.83 1.42 0.97 0.62 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 45 L 8.37 3.98 0.00 1.70 1.89 0.86 0.27 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 46 K 8.04 3.96 0.00 1.95 1.91 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 47 L 7.68 4.00 0.00 1.90 1.85 0.94 0.94 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 48 G 8.11 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 49 K 7.87 4.09 0.00 1.70 1.76 0.00 0.90 0.00 0.00 1.43 0.00 0.00 2.72 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.90 1.05 7.81 50 A 7.62 4.11 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.58 3.78 0.00 1.90 1.73 0.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.49 0.00 2.20 2.00 0.00 3.64 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 2.13 2.09 0.00 53 S 8.67 4.14 0.00 3.98 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 54 D 8.13 4.65 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 55 A 8.24 5.76 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.29 4.78 0.00 3.13 2.98 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 57 L 8.54 4.70 0.00 1.62 1.62 0.87 0.79 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 58 R 8.70 4.69 0.00 1.71 1.54 0.00 3.27 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.53 0.00 59 T 8.15 5.24 4.32 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 1.10 0.00 0.00 60 E 9.42 4.46 0.00 1.16 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 61 H 8.36 3.81 0.00 2.25 2.78 0.00 5.77 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.02 3.28 0.95 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 0.46 0.00 0.00 0.05 0.00 0.00 63 V 8.28 4.33 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 0.81 0.00 0.00 0.89 0.00 0.00 64 W 8.79 5.22 0.00 3.41 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 65 Q 7.97 4.64 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 66 P 0.00 4.13 0.00 2.07 2.21 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 67 E 8.03 4.56 0.00 1.92 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 2.25 2.25 0.00 *69 L 7.66 4.33 0.00 1.73 1.73 0.95 0.84 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 70 G 8.27 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 0.00 0.00 0.00 0.00 71 L 7.97 4.13 0.00 1.54 1.81 1.21 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.77 3.90 1.22 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 0.00 0.00 73 R 8.47 3.99 0.00 1.66 1.97 0.00 2.90 0.00 0.00 2.83 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 *75 A 8.48 4.49 1.41 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 0.00 0.00 76 A 8.53 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.81 3.95 1.54 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 0.00 0.00 0.00 78 V 7.94 3.66 2.16 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 1.11 0.00 0.00 0.94 0.00 0.00 79 N 8.31 4.24 0.00 2.85 3.09 0.00 0.00 7.25 6.20 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 80 L 8.27 4.03 0.00 1.85 1.75 0.93 0.97 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 81 S 9.13 4.37 0.00 4.01 4.26 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 82 G 7.80 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.55 4.57 0.00 1.57 1.52 1.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.88 3.48 0.00 1.69 1.59 0.00 1.39 0.00 0.00 1.45 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.01 1.29 7.81 85 Y 7.85 4.22 0.00 3.02 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 86 Q 7.81 4.56 0.00 1.93 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.07 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 87 A 8.54 3.22 0.82 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 88 N 7.82 4.15 0.00 2.94 3.13 0.00 0.00 6.98 9.18 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 89 P 0.00 4.42 0.00 2.25 2.19 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 90 A 8.14 4.24 1.66 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 0.00 0.00 91 V 8.52 3.25 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 -0.26 0.00 0.00 0.95 0.00 0.00 92 F 8.58 4.07 0.00 3.36 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 93 K 8.69 3.88 0.00 2.01 2.11 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.56 1.75 7.81 94 A 7.72 4.35 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 7.60 3.49 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 1.18 0.00 0.00 0.69 0.00 0.00 96 Y 8.26 4.01 0.00 3.33 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 E 8.20 4.12 0.00 2.31 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 2.56 2.56 0.00 98 Q 8.33 4.22 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.13 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 99 K 7.69 3.98 0.00 1.86 1.88 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.36 7.81 100 I 7.92 3.90 1.82 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.46 0.68 0.00 0.00 101 R 8.17 4.29 0.00 1.84 1.85 0.00 3.11 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 102 L 7.78 4.26 0.00 1.37 1.45 -0.11 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.24 4.03 0.00 2.03 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 2.46 2.35 0.00 104 N 7.87 4.98 0.00 2.80 2.83 0.00 0.00 6.85 7.03 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 0.00 105 R 8.85 3.98 0.00 2.04 1.99 0.00 3.48 0.00 0.00 3.50 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.16 0.00 106 S 8.31 4.08 0.00 3.77 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.94 3.76 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 1.05 0.00 0.00 0.99 0.00 0.00 108 A 8.00 4.06 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.04 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 7.89 3.92 0.00 1.79 1.90 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 111 W 8.58 4.18 0.00 3.44 3.42 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 0.00 112 A 8.88 3.75 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.98 3.98 0.00 1.54 1.65 0.92 0.98 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 0.00 114 S 7.63 4.13 0.00 3.72 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 0.00 115 Q 6.10 3.92 0.00 1.26 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.34 0.00 116 K 8.03 4.40 0.00 1.68 1.67 0.00 1.44 0.00 0.00 1.53 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.20 1.29 7.81 117 G 7.21 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 0.00 118 F 7.01 4.57 0.00 3.12 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 0.00 119 D 8.54 3.92 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.61 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.03 4.06 0.00 1.74 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.51 7.81 122 K 8.02 4.08 0.00 2.04 1.91 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.72 7.81 123 L 8.16 3.97 0.00 1.94 1.83 1.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 *125 R 8.04 4.54 0.00 2.27 2.04 0.00 3.22 0.00 0.00 3.51 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 126 A 8.52 4.04 1.41 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 0.00 0.00 127 Y 8.94 4.01 0.00 3.01 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 7.97 4.80 0.00 2.77 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 0.00 129 S 7.96 4.60 0.00 4.14 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 0.00 130 P 0.00 4.31 0.00 2.28 2.34 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 131 E 8.17 3.87 0.00 2.07 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 2.40 2.44 0.00 132 A 8.49 3.86 1.32 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 0.00 0.00 133 A 8.01 3.86 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.72 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.26 3.92 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 0.00 136 A 7.68 3.96 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 0.00 137 L 7.72 4.11 0.00 1.82 1.74 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 K 7.71 4.23 0.00 2.03 1.79 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.60 7.81 *140 Q 7.96 4.18 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 141 K 7.90 3.97 0.00 2.01 2.07 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.51 7.81 142 L 8.35 4.33 0.00 1.93 2.07 1.02 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.05 3.79 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 144 E 8.24 3.97 0.00 1.98 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 0.00 2.38 2.39 0.00 145 Q 8.18 3.79 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.23 0.00 0.00 0.00 0.00 0.00 1.70 2.11 0.00 146 Y 8.19 4.50 0.00 3.20 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 0.00 147 R 7.56 3.80 0.00 1.90 1.83 0.00 3.26 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.00 148 I 7.54 4.08 1.72 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 -0.36 0.77 0.00 0.00 149 D 8.46 4.88 0.00 2.49 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 S 8.05 4.90 0.00 4.09 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 0.00 151 T 8.63 5.09 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 1.26 0.00 0.00 152 P 0.00 4.92 0.00 2.13 2.07 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.29 0.00 153 T 8.74 4.88 4.53 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 1.36 0.00 0.00 154 V 8.66 4.89 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.30 0.00 0.00 155 I 8.49 4.74 1.92 0.00 0.00 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 1.21 0.61 0.96 0.00 0.00 156 V 9.27 3.98 2.16 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 0.81 0.00 0.00 0.94 0.00 0.00 157 G 7.86 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 G 8.05 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 K 7.76 4.70 0.00 1.64 1.81 0.00 1.25 0.00 0.00 1.45 0.00 0.00 2.63 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.62 0.57 7.81 160 Y 7.86 5.31 0.00 2.97 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 0.00 161 R 8.92 4.93 0.00 2.03 2.10 0.00 3.18 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 162 V 9.13 3.96 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 -0.24 0.00 0.00 0.91 0.00 0.00 163 I 7.82 4.17 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.86 0.00 0.00 164 F 7.91 4.46 0.00 2.50 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 7.71 4.66 0.00 2.65 2.81 0.00 0.00 6.97 8.00 0.00 0.00 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 N 7.63 4.91 0.00 2.73 2.77 0.00 0.00 6.35 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.87 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 0.00 168 F 8.24 3.40 0.00 2.92 2.15 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 0.00 169 D 8.45 4.70 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 G 8.22 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 0.00 0.00 0.00 171 G 8.36 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 7.72 3.82 2.16 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 1.00 0.00 0.00 1.08 0.00 0.00 173 H 8.35 4.24 0.00 3.25 3.55 0.00 5.87 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 0.00 174 T 7.52 3.76 4.16 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 1.14 0.00 0.00 175 I 8.15 3.71 2.10 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.12 0.95 0.00 0.00 176 K 8.28 4.04 0.00 2.05 1.90 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.65 7.81 177 E 8.10 4.15 0.00 2.03 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 0.00 2.53 2.45 0.00 178 L 7.74 3.92 0.00 1.81 1.67 0.71 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 179 V 8.00 3.71 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 0.81 0.00 0.00 1.00 0.00 0.00 180 A 7.69 3.96 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 0.00 181 K 8.08 3.72 0.00 1.88 1.98 0.00 0.98 0.00 0.00 1.75 0.00 0.00 2.73 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.24 7.81 182 V 8.15 3.61 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 0.99 0.00 0.00 1.05 0.00 0.00 183 R 8.03 3.84 0.00 1.99 2.07 0.00 3.34 0.00 0.00 3.23 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 184 E 8.65 4.02 0.00 2.01 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 2.36 2.51 0.00 185 E 8.19 4.01 0.00 2.22 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 2.41 2.55 0.00 186 R 8.83 4.09 0.00 1.84 1.78 0.00 3.28 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 * Residues marked with a * may have inaccurate shift predictions.