NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4222 8.1633 120.2676 54.6323 35.2840 174.1545 2 N 4.9851 8.1878 114.3062 48.3453 41.2664 173.0917 3 S 4.4733 8.1351 119.4633 57.3754 65.9407 172.6748 4 V 4.9470 8.1249 119.0750 61.3857 34.3991 174.1253 5 T 4.8279 9.1120 119.7257 60.2702 70.9927 172.4560 6 V 4.9442 8.3340 124.8132 61.1629 33.5714 175.2529 7 S 4.4262 8.4806 123.4845 57.9936 64.4544 174.7583 8 H 5.0797 8.9180 107.9142 54.1920 29.0388 175.1355 9 A 2.7834 7.5885 121.7816 52.2231 15.9239 175.8097 10 P 4.4438 0.0000 0.0000 62.1491 32.1297 177.5325 11 Y 4.3152 8.2606 119.1089 58.5599 37.4316 168.9613 12 T 5.0753 7.9424 107.8235 60.0662 72.3866 173.9706 13 I 4.5756 8.7785 124.1391 60.1655 40.9640 174.3248 14 T 5.0449 8.6986 124.4154 62.7028 69.7305 174.0840 15 Y 5.1341 8.2647 122.7208 55.2674 41.9187 174.3307 16 H 4.3689 9.6437 122.2987 56.1044 30.8462 175.8827 17 N 4.4327 8.0800 123.1675 56.7573 38.4224 176.8253 18 D 4.4634 8.4842 118.8287 56.4054 41.1456 177.4093 19 W 4.6698 8.7024 118.5910 56.8138 29.5731 177.5238 20 E 3.9058 8.2001 120.7657 59.0053 28.8798 176.9340 21 P 4.3765 0.0000 0.0000 64.3751 31.8103 176.8191 22 V 4.2304 7.5505 117.0076 63.4538 33.4125 177.4602 23 M 3.8719 7.8545 119.8847 58.1577 31.4446 178.3638 24 S 3.9869 7.8899 112.7987 61.6918 62.5420 176.2567 25 Q 3.6459 7.8340 120.0509 58.2933 28.3577 178.1475 26 L 4.0316 7.7701 121.6081 58.1119 42.1638 179.1535 27 V 3.5570 7.8050 118.0639 66.0896 31.0282 177.4240 28 E 3.9457 7.7765 117.9891 59.9257 29.0448 179.7808 29 F 4.7185 8.3979 117.7201 60.6307 38.9163 177.2908 30 Y 4.0921 8.6325 119.7472 60.7108 38.4738 177.1433 31 N 4.3628 8.6542 116.9712 56.2041 38.7901 176.3600 32 E 4.4017 7.8413 115.6264 57.2200 29.9740 177.3093 33 V 4.5216 7.0507 115.0760 61.5731 33.6709 177.7739 34 A 3.4470 7.6419 123.2039 54.7631 17.7086 179.6037 35 S 3.9033 7.6461 111.5782 61.1162 63.1494 176.6187 36 W 4.1182 7.7071 121.9534 59.3859 29.0558 177.7643 37 L 2.8081 6.5995 119.8703 57.9248 41.2902 178.8288 38 L 4.2890 7.8056 115.0766 56.1326 41.4203 178.1946 39 R 4.1216 7.6739 117.9664 57.5857 30.4315 176.1887 40 D 4.9963 7.6116 117.7875 52.0092 42.8112 176.0833 41 E 4.2915 8.7369 122.7560 57.1113 30.4267 176.0580 42 T 5.2134 8.5753 113.2812 59.9418 72.6621 172.9005 43 S 4.8435 8.6523 118.2023 56.1411 64.5043 172.4880 44 P 5.0386 0.0000 0.0000 61.0241 33.1517 175.2013 45 I 3.6016 8.1185 117.8069 61.3279 37.5501 175.2460 46 P 2.0000 0.0000 0.0000 65.2297 30.8493 178.2769 47 D 4.5236 7.7361 114.5278 55.7032 40.7518 177.2523 48 K 4.4670 7.8492 118.5012 55.6951 33.5179 177.8273 49 F 4.1559 7.0265 118.5378 60.0810 39.0670 176.4091 50 F 4.9170 7.6586 113.7769 56.9881 39.8168 177.2916 51 I 3.8105 7.5826 117.8373 64.0256 37.1958 177.8143 52 Q 4.2172 8.0223 120.3463 58.2159 28.9220 177.0196 53 L 3.2890 7.7544 118.6462 55.7516 41.2198 178.3016 54 K 4.3247 7.9285 118.7021 57.0061 32.7036 177.2550 55 Q 4.2756 7.7719 119.0726 54.9450 29.2604 174.5740 56 P 4.2538 0.0000 0.0000 62.5984 32.2711 176.0488 57 L 4.3787 9.3795 120.0946 55.4687 43.7045 179.4138 58 R 3.9944 8.0504 116.3067 58.1444 30.3903 176.7347 59 N 4.7437 8.0153 114.2932 52.2251 37.7378 174.0034 60 K 4.7805 7.6683 118.7006 55.2089 33.9060 176.2886 61 R 4.6337 8.8502 117.5136 55.4073 31.9387 175.0694 62 V 4.9323 7.7159 119.4427 61.0922 35.2968 173.4105 63 C 5.3319 9.1157 127.3473 57.6740 34.4735 172.4708 64 V 4.6279 8.6981 126.9453 61.6739 32.8174 173.8271 65 C 5.5339 9.5221 129.4640 57.7126 34.2128 173.2747 66 G 4.3656 8.9823 113.4749 44.5271 0.0000 174.2996 67 I 3.7881 8.4909 120.7105 63.7215 39.0249 174.8606 68 D 5.1006 7.3826 117.6406 51.6353 42.5047 172.8303 69 P 4.1503 0.0000 0.0000 61.6653 32.0404 176.0051 70 Y 4.3451 7.9423 116.8552 57.8829 38.5226 176.0790 71 P 4.3843 0.0000 0.0000 65.3345 31.2638 176.1828 72 K 4.8536 7.3383 114.4358 56.0506 35.5309 174.8614 73 D 4.5759 8.9562 116.9808 55.2100 37.6818 174.8631 74 G 3.8457 7.9140 107.7669 45.9378 0.0000 174.5007 75 T 4.3861 8.7445 111.2751 60.7845 70.4789 174.7848 76 G 3.8538 8.5024 109.8396 44.9446 0.0000 173.3734 77 V 4.2680 7.6050 120.0500 60.3187 31.9778 173.4501 78 P 4.1600 0.0000 0.0000 63.8271 31.6352 177.5125 79 F 4.0386 7.9783 117.8669 57.9566 37.7384 175.0445 80 E 4.1027 8.1067 121.7637 56.3884 29.5257 176.2745 81 S 4.5748 8.6316 120.7742 55.3776 63.2790 171.9709 82 P 4.3000 0.0000 0.0000 65.4989 31.1412 177.6721 83 N 4.5400 8.1728 111.1628 52.6363 38.0889 173.9957 84 F 4.0295 8.1300 120.3158 60.0661 37.8517 174.9002 85 T 4.2241 7.9324 114.4677 62.8135 68.7000 175.1211 86 K 3.9829 7.4925 121.6305 55.4711 33.6200 177.8271 87 K 3.8940 8.6183 123.5934 59.6169 32.0249 179.7208 88 S 4.1876 8.1043 114.9275 61.7713 62.9856 176.4345 89 I 3.9991 7.9938 120.5133 63.7088 37.8218 177.7555 90 K 4.0697 7.7316 119.3500 59.0888 31.7874 179.0055 91 E 4.1094 8.1413 118.4795 59.0053 29.3653 179.3422 92 I 3.5738 7.8341 119.9823 64.1158 37.0630 178.1913 93 A 3.1061 8.0222 121.6110 55.0785 18.2355 179.7749 94 S 4.2342 8.1257 113.6044 61.8797 62.9124 177.2206 95 S 4.1139 7.8131 117.4194 61.8380 62.6006 176.9168 96 I 3.5978 7.5859 122.4342 64.2039 36.6912 178.4585 97 S 4.4636 8.4528 114.5291 61.6084 62.0230 176.4694 98 R 4.0340 7.9263 119.9023 58.7126 29.8759 178.5026 99 L 4.1340 7.8236 119.9881 58.1926 42.2428 178.4641 100 T 4.3610 8.3322 108.5448 62.1690 69.5101 175.9093 101 G 3.8946 8.3066 108.3291 44.6717 0.0000 173.3120 102 V 3.7625 7.4143 120.4524 62.3130 31.2212 175.1084 103 I 4.4093 8.1545 120.7260 60.2164 39.6389 172.6308 104 D 4.3927 9.7564 125.5750 54.6603 36.9773 173.2023 105 Y 4.9726 6.9527 119.5738 55.2503 41.0004 175.1193 106 K 4.1077 9.0614 123.2244 59.1809 33.3420 176.1769 107 G 3.0451 7.3755 104.5622 45.8042 0.0000 171.2004 108 Y 5.0968 8.1838 119.4679 56.1645 42.3333 174.3923 109 N 4.8848 8.5728 124.4555 51.8878 41.7154 174.8177 110 L 4.1657 8.8895 126.0641 56.3561 42.0085 177.1231 111 N 4.8010 8.0427 116.9067 53.4971 38.8596 174.7563 112 I 4.5055 7.4553 108.8951 60.9377 38.4865 174.6404 113 I 4.3929 7.5157 122.0649 59.8568 38.4522 174.9920 114 D 4.4220 8.4728 126.1250 56.0729 41.1514 177.3871 115 G 4.2834 8.9608 110.8029 44.4179 0.0000 172.3199 116 V 4.7950 7.3967 118.9615 60.7738 34.0366 174.5190 117 I 4.6509 8.7937 128.7491 58.4072 40.0262 172.7575 118 P 5.1985 0.0000 0.0000 62.8308 32.2393 175.5241 119 W 5.4225 9.9647 131.7718 55.9655 34.8770 173.1039 120 N 4.9361 7.2333 122.1871 51.5204 39.4617 173.6750 121 Y 4.3139 9.0982 126.7222 60.8857 39.1017 175.9161 122 Y 4.4400 7.8832 117.2181 55.9677 39.5255 176.3273 123 L 3.5718 6.0891 121.9575 54.7890 42.1260 175.9795 124 S 4.9374 6.3765 112.0961 57.4505 66.1474 172.8956 125 C 4.8387 8.7166 113.9278 55.8306 33.4232 173.3588 126 K 4.2880 8.0045 121.3468 56.2328 33.0788 175.8609 127 L 3.9998 8.5905 129.4709 57.1538 42.0512 177.3403 128 G 3.9030 9.1624 114.7231 45.3729 0.0000 172.8477 129 E 4.4908 8.1765 119.5393 54.0056 30.5884 175.1599 130 T 4.0032 8.2244 120.3490 64.8817 69.1824 175.4715 131 K 4.0979 9.9358 124.3384 56.6640 30.8267 178.0058 132 S 4.2268 7.6511 112.7984 60.3972 63.4465 175.1619 133 H 4.8796 7.9369 117.7085 55.7393 28.9877 175.8602 134 A 2.5885 7.2325 126.0808 54.9602 17.7610 180.3854 135 I 3.3523 7.1376 115.5721 64.0900 37.9938 177.0709 136 Y 4.2526 7.0107 116.0348 60.0414 38.3360 177.1192 137 W 4.5574 8.6294 118.5745 59.0141 29.1647 179.9998 138 D 4.3263 8.0408 117.1676 56.0062 42.0356 178.1279 139 K 4.0173 7.6995 117.4143 58.6996 32.3257 179.4831 140 I 4.0321 7.7062 119.8324 64.5988 37.1543 178.3379 141 S 3.9672 8.9715 116.5434 61.3186 62.5054 176.7399 142 K 4.2226 7.8278 121.9160 59.4628 32.0072 178.2271 143 L 4.0848 8.0072 120.5572 58.4985 41.9463 179.0195 144 L 4.2337 8.4754 118.7857 57.9272 41.6263 179.3890 145 L 3.8769 8.0614 119.9437 58.2417 41.8327 178.8598 146 Q 4.1900 8.1613 118.5514 58.7128 28.7190 178.1583 147 H 4.3149 8.3984 119.2322 59.2101 29.8106 177.4357 148 I 3.4602 7.8227 122.0912 64.3347 36.8485 178.0120 149 T 4.0607 8.1385 109.1846 63.1377 68.5247 175.9510 150 K 4.0895 7.5202 120.6898 57.9850 32.3233 176.8098 151 H 4.5883 7.8642 115.3941 57.0167 30.5144 175.6357 152 V 3.9575 7.3980 110.4875 61.1899 32.4489 176.1439 153 S 4.4791 9.0753 118.7977 60.0628 64.4559 174.4965 154 V 4.5846 7.6590 118.9992 60.8135 34.9580 173.8964 155 L 4.9506 9.0098 130.2364 53.6508 44.2013 174.2655 156 Y 5.2915 9.5626 129.3225 56.3455 40.3457 173.7533 157 C 4.4822 9.1887 125.6086 58.4934 30.1036 172.9111 158 L 4.5956 8.1380 123.8872 54.7647 43.0951 176.4746 159 G 4.2798 8.8478 114.8417 45.4048 0.0000 174.2343 160 K 4.0272 8.6577 126.9789 59.0137 32.6023 179.4617 161 T 4.0803 8.1200 108.0777 64.8598 69.3502 175.3579 162 D 4.4833 8.1605 121.3183 56.4443 41.4788 176.7960 163 F 4.5607 7.6052 119.1659 58.8208 39.4617 173.7895 164 S 4.1767 8.6778 122.2348 61.4281 62.7763 168.3934 165 N 3.9452 8.5288 119.7561 54.8451 38.6268 176.1404 166 I 3.5749 7.7086 116.2878 64.1433 37.5273 177.9810 167 R 4.0956 7.9404 118.8027 58.8547 30.3608 178.6186 168 A 4.1217 7.9280 119.3062 54.4030 18.1831 179.3105 169 K 4.1637 7.4578 115.9652 58.7197 32.0939 178.2639 170 L 4.2310 7.9220 116.7749 54.7293 41.2221 176.7953 171 E 3.6362 8.3365 119.3194 58.1664 26.7015 175.7365 172 S 3.5804 7.7584 115.3702 58.3798 62.3423 170.8527 173 P 4.6283 0.0000 0.0000 63.3790 31.5755 175.8893 174 V 3.6666 7.5981 112.2434 62.0513 32.7128 176.1215 175 T 4.1766 8.2452 118.5424 63.8023 69.1451 173.7766 176 T 4.9877 8.4581 123.7629 61.8210 70.6759 174.0980 177 I 4.3739 8.9556 127.7550 59.4960 39.8222 174.8978 178 V 4.5819 8.5370 127.0275 61.4325 32.8733 174.7033 179 G 4.1424 8.6852 116.7779 44.5446 0.0000 170.5685 180 Y 4.7679 8.1460 117.2677 57.7714 38.5049 176.3708 181 H 4.3133 9.0004 122.6494 55.6290 30.7927 173.3623 182 P 4.3536 0.0000 0.0000 65.4048 31.4968 177.2521 183 A 4.6990 7.7266 121.0716 50.3101 18.4916 175.9180 184 A 4.5086 7.4585 132.4377 50.3808 20.5615 177.5578 185 R 4.6268 8.5376 115.8589 56.4457 33.9443 174.3832 186 D 4.7569 8.5851 121.7293 54.2709 42.9380 176.6716 187 R 4.5563 7.4092 114.3763 54.0581 31.5383 174.9900 188 Q 4.0992 8.8554 124.5986 58.5850 29.4315 176.0721 189 F 4.6137 8.0432 120.2444 58.1599 36.3974 173.9829 190 E 3.7590 7.8133 123.2387 57.4598 30.0325 177.1493 191 K 4.2541 7.1850 127.6369 55.0082 33.9550 175.0480 192 D 4.5723 8.3203 125.2654 55.6831 41.3156 178.1074 *196 E 3.9523 7.9059 116.8752 56.0790 31.5076 178.2140 197 I 3.8441 7.5403 119.7760 64.2800 37.1911 178.2113 198 I 3.6181 7.6415 113.3649 63.3426 37.4411 177.2647 199 N 4.1248 7.4313 116.8947 57.1746 38.6457 176.8944 200 V 3.6785 7.5998 118.6439 65.7315 31.4672 178.0411 201 L 4.0088 7.8113 118.6587 57.5341 41.3100 179.1836 202 L 3.9739 8.1464 118.6005 57.6873 41.6380 178.8465 203 E 4.0830 8.2815 118.6339 59.6383 29.6244 179.0253 204 L 4.0261 8.1468 120.2300 58.4734 41.7032 179.1789 205 D 4.6286 7.7075 114.5115 54.0830 40.5296 175.4326 206 N 4.3225 7.2985 123.3928 53.1337 42.0951 174.3778 207 K 4.5268 9.8941 115.7528 53.1669 35.0661 175.5391 208 A 4.1431 8.1600 122.6454 51.4493 18.7542 175.8093 209 P 4.4741 0.0000 0.0000 62.3311 32.3542 175.7668 210 I 3.7119 7.7438 120.0024 60.3722 37.7048 176.7270 211 N 4.5634 8.1267 123.8905 52.3560 37.7655 175.2606 212 W 4.4201 8.4382 127.2011 58.6720 28.9898 177.2731 213 A 4.5992 8.3449 120.0527 54.2182 17.7685 179.0139 214 Q 4.1856 7.8465 116.2531 58.2790 28.9426 178.3814 215 G 3.0554 7.5420 105.6908 46.7438 0.0000 173.7430 216 F 4.6842 6.8764 119.0730 57.7681 39.7608 175.0284 217 I 4.3211 8.4213 123.3780 59.5697 40.1327 175.4076 218 Y 4.4970 8.4635 122.9256 58.1151 37.7604 175.6874 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 M 8.16 4.42 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.64 0.00 2 N 8.19 4.99 0.00 2.57 2.63 0.00 0.00 7.28 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 3 S 8.14 4.47 0.00 3.80 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 V 8.12 4.95 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 0.87 0.00 0.00 0.91 0.00 0.00 5 T 9.11 4.83 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 1.11 0.00 0.00 6 V 8.33 4.94 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 0.92 0.00 0.00 0.96 0.00 0.00 7 S 8.48 4.43 0.00 4.20 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.92 5.08 0.00 3.10 3.32 0.00 5.86 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 9 A 7.59 2.78 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 10 P 0.00 4.44 0.00 2.24 2.17 0.00 3.93 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.25 0.00 11 Y 8.26 4.32 0.00 3.34 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 12 T 7.94 5.08 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 1.27 0.00 0.00 13 I 8.78 4.58 1.70 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.45 0.70 0.00 0.00 14 T 8.70 5.04 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 1.23 0.00 0.00 15 Y 8.26 5.13 0.00 3.07 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 16 H 9.64 4.37 0.00 3.56 3.72 0.00 5.79 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.08 4.43 0.00 2.93 2.81 0.00 0.00 7.15 8.37 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 18 D 8.48 4.46 0.00 2.46 2.32 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 19 W 8.70 4.67 0.00 3.70 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.20 3.91 0.00 2.42 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.70 0.00 21 P 0.00 4.38 0.00 2.06 2.12 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 22 V 7.55 4.23 2.13 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 1.09 0.00 0.00 0.93 0.00 0.00 23 M 7.85 3.87 0.00 1.65 1.73 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.21 0.00 24 S 7.89 3.99 0.00 3.83 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 7.83 3.65 0.00 1.97 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.68 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 26 L 7.77 4.03 0.00 1.87 1.75 1.09 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.80 3.56 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 0.91 0.00 0.00 0.87 0.00 0.00 28 E 7.78 3.95 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 29 F 8.40 4.72 0.00 3.17 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 30 Y 8.63 4.09 0.00 3.24 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 31 N 8.65 4.36 0.00 2.80 2.97 0.00 0.00 7.11 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.84 4.40 0.00 2.26 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 0.00 2.64 2.40 0.00 33 V 7.05 4.52 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 0.54 0.00 0.00 1.00 0.00 0.00 34 A 7.64 3.45 0.62 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 0.00 0.00 0.00 0.00 0.00 35 S 7.65 3.90 0.00 3.63 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 36 W 7.71 4.12 0.00 3.38 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 6.60 2.81 0.00 0.54 1.29 0.52 0.35 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 38 L 7.81 4.29 0.00 1.65 1.64 1.10 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.67 4.12 0.00 1.98 2.00 0.00 3.18 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 40 D 7.61 5.00 0.00 2.84 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 41 E 8.74 4.29 0.00 1.96 1.91 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 2.42 2.34 0.00 42 T 8.58 5.21 4.55 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 1.58 0.00 0.00 43 S 8.65 4.84 0.00 3.97 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 44 P 0.00 5.04 0.00 2.20 2.14 0.00 4.14 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 45 I 8.12 3.60 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.57 0.81 0.00 0.00 46 P 0.00 2.00 0.00 1.85 1.72 0.00 3.40 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 47 D 7.74 4.52 0.00 2.56 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 48 K 7.85 4.47 0.00 1.74 1.86 0.00 1.91 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.54 7.81 49 F 7.03 4.16 0.00 2.32 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 7.66 4.92 0.00 3.04 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 51 I 7.58 3.81 1.90 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 1.54 0.63 0.97 0.00 0.00 52 Q 8.02 4.22 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.04 0.00 0.00 0.00 0.00 0.00 2.75 2.91 0.00 53 L 7.75 3.29 0.00 1.67 1.10 0.76 -0.26 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 54 K 7.93 4.32 0.00 1.96 1.95 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.62 7.81 55 Q 7.77 4.28 0.00 2.56 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.55 2.64 0.00 56 P 0.00 4.25 0.00 2.13 1.77 0.00 3.62 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 1.98 1.95 0.00 57 L 9.38 4.38 0.00 0.86 0.88 -0.55 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.05 3.99 0.00 1.75 1.96 0.00 3.18 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.92 0.00 59 N 8.02 4.74 0.00 2.89 2.98 0.00 0.00 6.18 6.53 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 60 K 7.67 4.78 0.00 1.80 1.70 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.39 1.44 7.81 61 R 8.85 4.63 0.00 1.77 2.06 0.00 2.66 0.00 0.00 3.04 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 62 V 7.72 4.93 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 1.34 0.00 0.00 0.98 0.00 0.00 63 C 9.12 5.33 0.00 3.00 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 64 V 8.70 4.63 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 0.40 0.00 0.00 1.19 0.00 0.00 65 C 9.52 5.53 0.00 3.12 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 66 G 8.98 4.37 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 0.00 0.00 0.00 67 I 8.49 3.79 1.69 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.05 0.90 0.00 0.00 68 D 7.38 5.10 0.00 2.66 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 69 P 0.00 4.15 0.00 1.97 1.87 0.00 3.57 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.82 0.00 70 Y 7.94 4.35 0.00 3.02 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 71 P 0.00 4.38 0.00 2.24 2.37 0.00 3.89 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 72 K 7.34 4.85 0.00 1.83 1.77 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.31 1.44 7.81 73 D 8.96 4.58 0.00 2.85 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 74 G 7.91 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 0.00 0.00 0.00 75 T 8.74 4.39 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 1.35 0.00 0.00 76 G 8.50 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 0.00 0.00 0.00 77 V 7.60 4.27 2.29 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 1.05 0.00 0.00 1.02 0.00 0.00 78 P 0.00 4.16 0.00 2.17 1.76 0.00 3.91 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.81 0.00 79 F 7.98 4.04 0.00 3.31 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.11 4.10 0.00 2.13 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 0.00 2.42 2.33 0.00 81 S 8.63 4.57 0.00 3.75 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 82 P 0.00 4.30 0.00 2.12 2.16 0.00 3.77 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 2.08 2.15 0.00 83 N 8.17 4.54 0.00 2.86 2.97 0.00 0.00 5.95 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.13 4.03 0.00 3.11 3.24 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 85 T 7.93 4.22 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 1.15 0.00 0.00 86 K 7.49 3.98 0.00 1.36 0.98 0.00 1.12 0.00 0.00 1.47 0.00 0.00 2.70 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.97 0.21 7.81 87 K 8.62 3.89 0.00 1.83 1.88 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.50 7.81 88 S 8.10 4.19 0.00 4.26 4.14 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 89 I 7.99 4.00 2.39 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 2.08 1.65 1.12 0.00 0.00 90 K 7.73 4.07 0.00 1.80 1.64 0.00 1.35 0.00 0.00 1.34 0.00 0.00 2.63 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.30 1.13 7.81 91 E 8.14 4.11 0.00 2.03 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 2.57 2.69 0.00 92 I 7.83 3.57 2.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.57 0.65 0.00 0.00 93 A 8.02 3.11 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 94 S 8.13 4.23 0.00 4.09 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 95 S 7.81 4.11 0.00 3.87 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 96 I 7.59 3.60 1.19 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.39 0.89 0.00 0.00 97 S 8.45 4.46 0.00 4.23 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 98 R 7.93 4.03 0.00 2.00 1.98 0.00 3.01 0.00 0.00 2.82 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 99 L 7.82 4.13 0.00 1.67 1.92 0.95 0.67 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 0.00 100 T 8.33 4.36 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 1.47 0.00 0.00 101 G 8.31 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 0.00 102 V 7.41 3.76 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 0.49 0.00 0.00 1.04 0.00 0.00 103 I 8.15 4.41 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 1.41 1.08 0.94 0.00 0.00 104 D 9.76 4.39 0.00 2.84 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 0.00 105 Y 6.95 4.97 0.00 3.08 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 0.00 106 K 9.06 4.11 0.00 1.94 1.94 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.41 7.81 107 G 7.38 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 0.00 0.00 0.00 108 Y 8.18 5.10 0.00 2.72 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 0.00 109 N 8.57 4.88 0.00 2.71 2.44 0.00 0.00 7.07 7.20 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 0.00 110 L 8.89 4.17 0.00 1.76 1.79 0.42 1.35 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 0.00 111 N 8.04 4.80 0.00 2.69 2.84 0.00 0.00 6.91 9.08 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 0.00 112 I 7.46 4.51 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.89 0.00 0.00 113 I 7.52 4.39 1.74 0.00 0.00 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 1.34 0.91 0.68 0.00 0.00 114 D 8.47 4.42 0.00 2.59 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 0.00 115 G 8.96 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.40 4.80 2.13 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 0.94 0.00 0.00 0.54 0.00 0.00 117 I 8.79 4.65 1.92 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.97 0.00 0.00 118 P 0.00 5.20 0.00 2.60 2.28 0.00 3.92 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.19 0.00 119 W 9.96 5.42 0.00 3.40 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 0.00 120 N 7.23 4.94 0.00 1.93 2.44 0.00 0.00 6.90 7.46 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 0.00 121 Y 9.10 4.31 0.00 2.97 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 7.88 4.44 0.00 2.75 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 0.00 123 L 6.09 3.57 0.00 0.27 0.38 0.27 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 124 S 6.38 4.94 0.00 3.98 3.44 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 0.00 125 C 8.72 4.84 0.00 3.14 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.00 4.29 0.00 1.94 1.71 0.00 1.98 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 127 L 8.59 4.00 0.00 1.80 1.62 0.98 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.16 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 0.00 129 E 8.18 4.49 0.00 1.97 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 2.21 2.24 0.00 130 T 8.22 4.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 131 K 9.94 4.10 0.00 1.94 1.96 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.38 7.81 132 S 7.65 4.23 0.00 3.97 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 0.00 133 H 7.94 4.88 0.00 3.55 3.66 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.23 2.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 7.14 3.35 1.47 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 1.06 0.31 -0.26 0.00 0.00 136 Y 7.01 4.25 0.00 2.58 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 0.00 137 W 8.63 4.56 0.00 3.60 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 8.04 4.33 0.00 2.98 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 0.00 139 K 7.70 4.02 0.00 1.25 0.74 0.00 1.36 0.00 0.00 0.79 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.29 7.81 140 I 7.71 4.03 2.48 0.00 0.00 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 2.04 0.98 1.43 0.00 0.00 141 S 8.97 3.97 0.00 3.64 2.63 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 0.00 142 K 7.83 4.22 0.00 2.09 2.05 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.60 7.81 143 L 8.01 4.08 0.00 2.20 2.19 1.08 0.89 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 0.00 144 L 8.48 4.23 0.00 2.06 2.08 1.25 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.06 3.88 0.00 2.19 1.94 1.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 8.16 4.19 0.00 2.47 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 147 H 8.40 4.31 0.00 3.42 3.58 0.00 5.78 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 0.00 148 I 7.82 3.46 1.81 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 1.14 0.36 0.71 0.00 0.00 149 T 8.14 4.06 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 1.26 0.00 0.00 150 K 7.52 4.09 0.00 1.76 1.66 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.41 7.81 151 H 7.86 4.59 0.00 3.04 3.31 0.00 5.65 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 0.00 152 V 7.40 3.96 2.25 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 0.65 0.00 0.00 0.94 0.00 0.00 153 S 9.08 4.48 0.00 3.81 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.66 4.58 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 1.13 0.00 0.00 0.94 0.00 0.00 155 L 9.01 4.95 0.00 1.78 1.50 0.99 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 156 Y 9.56 5.29 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 0.00 157 C 9.19 4.48 0.00 2.54 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.14 4.60 0.00 1.50 1.58 0.77 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 159 G 8.85 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 K 8.66 4.03 0.00 1.76 1.85 0.00 1.17 0.00 0.00 1.56 0.00 0.00 2.66 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.26 1.21 7.81 161 T 8.12 4.08 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 1.25 0.00 0.00 162 D 8.16 4.48 0.00 2.85 2.31 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 0.00 163 F 7.61 4.56 0.00 2.86 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 0.00 164 S 8.68 4.18 0.00 4.10 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 8.53 3.95 0.00 3.07 3.41 0.00 0.00 5.99 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 7.71 3.57 1.85 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 1.52 0.53 0.99 0.00 0.00 167 R 7.94 4.10 0.00 1.88 2.00 0.00 3.30 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.58 0.00 168 A 7.93 4.12 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 0.00 169 K 7.46 4.16 0.00 1.98 1.91 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.72 7.81 170 L 7.92 4.23 0.00 1.92 1.77 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.34 3.64 0.00 2.15 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 2.27 2.41 0.00 172 S 7.76 3.58 0.00 3.99 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 0.00 173 P 0.00 4.63 0.00 2.16 2.13 0.00 3.79 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 1.96 0.00 174 V 7.60 3.67 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 0.76 0.00 0.00 0.93 0.00 0.00 175 T 8.25 4.18 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 1.19 0.00 0.00 176 T 8.46 4.99 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 1.17 0.00 0.00 177 I 8.96 4.37 1.88 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 1.07 0.75 0.81 0.00 0.00 178 V 8.54 4.58 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 0.76 0.00 0.00 0.86 0.00 0.00 179 G 8.69 4.14 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 0.00 0.00 0.00 180 Y 8.15 4.77 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 H 9.00 4.31 0.00 3.18 3.32 0.00 5.94 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 P 0.00 4.35 0.00 2.08 2.19 0.00 3.28 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 183 A 7.73 4.70 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 A 7.46 4.51 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 0.00 185 R 8.54 4.63 0.00 1.75 1.77 0.00 3.17 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 186 D 8.59 4.76 0.00 2.58 2.65 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 0.00 187 R 7.41 4.56 0.00 2.02 1.90 0.00 3.01 0.00 0.00 3.05 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.55 0.00 188 Q 8.86 4.10 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.43 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 189 F 8.04 4.61 0.00 2.94 3.02 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 0.00 190 E 7.81 3.76 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 191 K 7.18 4.25 0.00 1.11 1.27 0.00 2.25 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.28 1.44 7.81 192 D 8.32 4.57 0.00 2.91 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *196 E 7.91 3.95 0.00 1.68 1.33 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 1.47 1.71 0.00 197 I 7.54 3.84 1.83 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 1.65 0.77 0.92 0.00 0.00 198 I 7.64 3.62 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.02 0.82 0.00 0.00 199 N 7.43 4.12 0.00 2.79 3.16 0.00 0.00 6.71 7.59 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 0.00 200 V 7.60 3.68 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 1.11 0.00 0.00 1.08 0.00 0.00 201 L 7.81 4.01 0.00 1.89 1.70 0.92 0.68 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 0.00 202 L 8.15 3.97 0.00 1.76 1.72 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 203 E 8.28 4.08 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 204 L 8.15 4.03 0.00 1.90 1.80 0.92 1.56 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 0.00 205 D 7.71 4.63 0.00 2.84 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 0.00 206 N 7.30 4.32 0.00 2.79 2.84 0.00 0.00 6.66 6.43 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 0.00 207 K 9.89 4.53 0.00 1.71 1.74 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.46 7.81 208 A 8.16 4.14 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.47 0.00 2.16 2.06 0.00 3.73 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 1.95 1.97 0.00 210 I 7.74 3.71 0.70 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 1.05 0.33 -0.66 0.00 0.00 211 N 8.13 4.56 0.00 2.77 2.64 0.00 0.00 7.23 7.95 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 0.00 212 W 8.44 4.42 0.00 3.48 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 0.00 213 A 8.34 4.60 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 0.00 0.00 0.00 0.00 0.00 214 Q 7.85 4.19 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 215 G 7.54 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 0.00 0.00 0.00 216 F 6.88 4.68 0.00 2.88 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 I 8.42 4.32 1.76 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 1.16 0.55 0.89 0.00 0.00 218 Y 8.46 4.50 0.00 2.88 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.