NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4189 8.3049 120.3679 54.6018 34.2715 175.1822 2 I 4.5384 7.8256 118.2022 59.2586 40.0403 174.2245 3 F 5.2231 8.4937 119.5133 57.0492 42.7188 173.9840 4 S 4.8243 7.9630 111.3261 57.3568 64.8585 174.8411 5 V 4.2769 7.9780 119.7194 61.2758 32.3462 172.3377 6 R 4.4943 8.3300 124.7206 55.5059 30.8819 175.1281 7 G 3.9844 8.9225 114.7544 46.3569 0.0000 171.3007 8 E 5.0545 8.1918 123.1094 54.2226 32.2334 176.3814 9 V 3.8418 8.9746 128.2607 63.5436 31.9225 175.0463 10 L 4.3448 9.0815 131.2075 54.9554 40.9240 176.6450 11 E 4.4784 8.1326 119.7678 55.2287 32.7667 175.4555 12 V 4.5273 8.1579 122.9960 60.4034 31.8226 176.9688 13 A 4.3034 8.1552 125.5172 51.6270 18.5280 176.9061 14 L 4.1503 8.1581 113.3605 57.6498 41.7340 177.7809 15 D 4.5633 7.1577 118.4476 55.3962 40.0030 175.1237 16 H 4.4277 8.0053 115.4435 55.8991 30.4912 173.5768 17 A 4.8708 8.0562 117.9357 50.9285 23.0949 175.4393 18 V 4.8804 9.3179 119.9064 61.1694 35.4605 174.5224 19 I 4.9840 8.3837 126.2174 59.6391 41.5002 174.3609 20 E 4.8026 9.0166 128.1977 55.0681 29.7667 174.5401 21 A 4.3457 9.4656 129.4033 51.3560 18.1691 176.5082 22 A 3.5367 9.6037 117.0252 53.2601 15.8143 176.0103 23 G 3.9757 8.2871 115.3561 44.4366 0.0000 172.1955 24 I 3.7199 8.2435 117.4332 61.0142 39.4347 175.8158 25 G 4.3080 8.1362 111.0748 44.8214 0.0000 171.6257 26 Y 4.6127 9.1634 123.8403 56.3869 40.1474 174.9341 27 R 4.2812 8.5615 124.8639 56.0884 29.9535 176.2391 28 V 4.3028 8.6140 127.1067 60.0035 32.5986 173.1665 29 N 4.4114 8.0032 122.0276 54.1146 39.7811 173.9488 30 A 4.3118 7.7249 121.5939 51.7549 22.6261 175.1719 31 T 4.6159 7.4540 105.1717 58.6806 71.8304 172.8091 32 P 4.1383 0.0000 0.0000 66.8209 30.7176 178.3481 33 S 4.1285 7.5153 113.7980 60.8345 62.9845 176.1056 34 A 4.3391 8.6385 123.0328 53.9904 18.9663 179.1029 35 L 3.8300 7.9196 116.5867 58.4394 41.8007 178.2041 36 A 3.9639 8.4567 121.8144 55.5532 19.0257 178.8173 37 T 4.1783 7.6895 108.3756 60.2080 66.4519 173.5273 38 L 4.0733 7.4769 125.8450 55.4140 43.6885 173.9067 39 N 4.7738 8.5080 125.1437 51.1520 39.5503 174.5931 40 Q 4.1572 8.6240 124.7979 57.1197 29.6559 177.8725 41 G 3.9095 8.8263 109.4836 46.0191 0.0000 173.6651 42 S 4.7216 7.8824 115.0488 56.8650 64.6366 173.1830 43 Q 4.8067 8.4776 125.0814 55.2832 30.4557 174.6864 44 A 4.5777 7.8475 123.9693 51.6871 22.9427 175.6115 45 R 5.1111 8.6305 122.3646 54.8411 31.4461 175.7072 46 L 4.3747 8.2409 124.1180 54.8819 43.9343 174.4201 47 V 3.7617 8.3232 123.1548 63.1280 32.4584 175.1830 48 T 4.9693 8.5574 124.1882 62.1723 72.0844 173.9218 49 A 4.1716 8.0659 117.0775 51.9913 22.2253 175.5159 50 M 4.6115 8.9217 122.4137 55.5547 32.6825 175.4720 51 V 4.2355 8.6351 127.1677 62.1597 33.2554 174.8523 52 V 4.6955 8.4346 126.6129 61.3784 34.3791 174.4714 53 R 4.7572 8.4813 124.7599 54.1883 34.5136 175.5802 54 E 4.0227 8.9698 119.7287 58.9130 29.4273 176.8752 55 D 5.0377 7.8056 116.8762 52.3468 40.0404 175.0948 56 S 4.6492 7.8851 113.8674 59.5989 67.8487 174.2790 57 M 4.9014 7.9386 115.9773 55.0363 34.1460 174.6285 58 T 4.4108 7.6685 114.5140 61.1847 69.8563 174.1503 59 L 5.2209 7.9961 125.0034 53.1084 45.3035 174.9241 60 Y 4.5671 8.7941 119.9204 55.9871 40.0955 174.9910 61 G 4.0468 8.6705 109.5474 44.4120 0.0000 171.6017 62 F 5.2644 9.3388 120.4379 55.0744 43.3548 176.0520 63 S 4.0606 9.0179 115.3348 61.4103 63.0734 174.1238 64 D 4.6565 7.7661 117.9025 50.5403 42.3877 175.8557 65 A 4.0919 8.7429 122.0892 56.2347 18.1041 178.8706 66 E 3.9765 8.0221 116.2597 58.8363 29.1926 178.3013 67 N 4.2307 10.8739 120.4985 55.3384 39.4833 176.6363 68 R 3.2164 7.5702 117.8677 58.1318 30.3384 178.1066 69 D 4.3068 7.6627 119.4632 57.0282 40.6593 178.9334 70 L 3.8760 7.7389 118.7126 57.9293 41.3486 178.5279 71 F 4.3743 8.0081 119.6132 61.6923 38.8048 176.6890 72 L 3.7271 8.2417 118.2706 58.7208 41.8408 178.8431 73 A 3.7540 8.6891 120.0511 54.9363 17.9948 179.1478 74 L 3.7423 9.1011 115.9482 57.5754 41.9814 179.5988 75 L 3.6124 8.2346 119.4760 58.4387 41.9028 178.8016 76 S 4.1282 8.3704 112.1696 60.3927 62.3860 174.2401 77 V 3.8027 7.4404 120.9614 62.3238 32.0123 175.2090 78 S 4.2628 8.3401 117.6705 58.5931 62.6894 172.8633 79 G 3.8665 7.5286 108.5894 44.5659 0.0000 179.6445 80 V 2.3457 7.9654 108.2752 58.5669 33.4253 178.4184 81 G 4.0564 8.9490 109.7075 45.4125 0.0000 172.8788 82 P 4.1811 0.0000 0.0000 64.9890 31.1011 177.8933 83 R 3.7839 7.5825 114.9493 60.3773 29.9572 178.3569 84 L 3.9577 7.8980 117.8745 56.2941 42.8405 181.5754 85 A 3.8041 7.9945 119.7948 55.4066 19.7793 178.7901 86 M 4.1620 8.9680 116.3218 57.5400 31.9306 179.1759 87 A 3.9417 8.4325 120.5396 56.1004 18.8593 179.1436 88 T 3.7993 8.3958 112.8196 67.6651 68.6692 176.1684 89 L 4.1705 8.4964 122.1142 56.9660 41.8836 179.2256 90 A 4.1732 8.2652 121.4534 55.7602 18.9112 178.8539 91 V 4.0836 8.0069 124.0721 62.3021 30.8146 176.3250 92 H 4.2616 8.8603 116.0243 55.8062 29.2882 175.8706 93 D 4.8408 8.7078 121.6417 53.1396 39.4493 177.3448 94 A 4.2684 8.6106 122.5777 51.8078 19.5273 180.2997 95 A 3.3594 9.9220 115.9405 54.0269 19.3808 180.7273 96 A 3.6493 8.0303 121.5036 53.6114 20.7093 178.5796 97 L 3.9989 8.4668 118.6219 56.4130 41.6111 179.9982 98 R 3.8387 7.5377 122.6068 59.3433 31.3237 178.5199 99 Q 3.9151 9.5457 120.0380 58.9517 27.6230 181.9949 100 A 4.1250 7.0832 121.6973 57.1343 20.1328 179.1567 101 L 3.7137 8.4276 115.4012 58.8468 41.6081 179.5679 102 A 3.7161 8.8816 118.5651 57.0550 18.5890 178.0804 103 D 4.4010 8.0904 111.9841 52.3967 40.6883 176.6590 104 S 3.8941 8.3585 114.4099 59.0194 62.2064 171.5429 105 D 4.2634 7.9439 122.1042 57.9391 41.9869 176.7345 106 V 3.7789 8.0475 121.1658 63.1124 30.3518 172.5970 107 A 3.8060 7.6556 117.8719 55.2729 18.5196 179.7083 108 S 4.0780 8.7782 112.2131 60.6212 64.5582 176.5900 109 L 3.1757 7.7337 114.9709 57.2487 41.3833 178.9130 110 T 3.7470 8.5709 124.5023 65.0016 68.7309 175.0018 111 R 4.0516 8.5998 120.2730 60.1684 29.2651 182.8954 112 V 3.8138 7.6458 109.6516 60.7506 32.2134 173.3282 113 P 4.6178 0.0000 0.0000 61.8387 33.0849 176.0355 114 G 3.9908 8.5755 103.0775 46.4131 0.0000 173.1008 115 I 4.3133 8.1442 120.6985 59.4146 38.7720 175.3239 116 G 4.1034 8.3772 116.4605 43.6157 0.0000 173.3182 117 R 3.7611 8.5538 118.3146 61.4571 28.5974 175.8726 118 R 4.5928 7.4169 117.9551 60.7477 31.5927 177.3192 119 G 3.8010 8.3405 105.0283 47.7118 0.0000 174.6852 120 A 4.1383 8.8128 123.6866 55.4532 18.5198 178.8313 121 E 3.7551 8.5663 115.5327 59.9608 29.2738 180.0272 122 R 3.8510 8.8997 120.2712 59.9286 30.7512 178.4551 123 I 3.7049 8.5452 120.1399 64.4658 37.1856 178.1903 124 V 3.5226 8.1556 118.6092 66.4450 31.2318 177.9662 125 L 3.9750 8.1487 118.6226 57.4002 41.9841 177.4126 126 E 4.6920 7.7892 118.1681 55.3062 30.9310 175.6410 127 L 4.6252 8.1059 116.4582 56.1799 49.8100 177.4014 128 A 4.0287 8.0030 120.4009 55.1303 18.7799 177.7327 129 D 4.3460 7.9274 113.2305 56.9278 41.7517 180.9859 130 K 4.3621 8.0252 125.2586 58.5566 33.0700 178.3372 131 V 3.6251 8.7350 115.6425 60.6670 30.4233 170.6982 132 G 3.8555 8.2663 108.8491 44.7218 0.0000 170.1732 133 P 4.1038 0.0000 0.0000 62.1663 31.7602 176.2434 *147 G 3.7902 8.1708 104.8737 45.8819 0.0000 173.9945 148 N 4.3588 8.3897 119.5648 56.4153 39.9029 176.3780 149 A 3.9207 8.1800 119.9586 55.3507 17.8730 179.2258 150 V 3.5224 7.9572 116.1527 66.6163 31.3032 178.1309 151 R 4.1008 8.6147 118.2367 59.1785 29.9986 177.6598 152 G 3.7689 9.5512 107.3629 45.4428 0.0000 176.5772 153 S 3.9660 7.8738 115.7805 61.3509 64.0853 175.7168 154 V 3.3842 7.9124 118.2705 66.4518 30.9025 178.2919 155 V 3.4097 7.9148 116.3744 65.9894 31.7643 177.7479 156 E 4.0445 8.2998 118.3089 60.2693 29.4003 178.4356 157 A 3.8302 8.3517 118.8862 55.5832 18.3105 179.1234 158 L 4.1001 8.2941 114.8886 57.9687 42.0420 180.3064 159 V 3.8929 8.6645 118.7574 66.0843 31.2304 177.6963 160 G 3.8190 10.3096 103.7035 48.1827 0.0000 175.1020 161 L 4.1069 8.4674 120.6120 55.1254 41.7486 178.2409 162 G 3.8889 8.1177 108.1042 44.9787 0.0000 173.9630 163 F 4.5057 7.8345 117.9832 56.9553 39.9143 174.5124 164 A 4.5270 8.4707 124.3071 50.7935 20.0586 178.0839 165 A 4.4054 8.3768 124.3467 52.6297 19.6854 176.9174 166 K 4.5828 8.5281 112.9758 56.6729 31.5772 174.2141 167 Q 4.3962 7.6399 124.3483 57.9091 32.8242 174.1380 168 A 4.0257 7.3714 122.2792 54.0564 19.3153 178.8808 169 E 4.4611 8.2352 111.4549 58.8040 29.6976 177.9858 170 E 4.6544 7.9440 119.2277 52.8811 27.4092 176.3725 171 A 5.2868 7.7159 135.0000 53.3111 18.1955 178.9363 172 T 3.8552 6.7934 113.2325 66.3662 68.2487 176.0938 173 D 4.3366 8.8417 119.9985 58.5318 40.9795 179.9939 174 Q 3.7137 7.5883 118.7884 59.7790 29.8617 178.8503 175 V 3.6787 8.4308 120.7004 63.9802 31.4015 177.3565 176 L 3.9475 7.7971 118.8416 58.1208 43.2251 178.0741 177 D 4.9530 8.1333 118.4651 52.1225 39.3578 175.9998 178 G 4.1523 8.2362 113.3735 46.2374 0.0000 172.2736 179 E 3.1242 7.9736 119.3421 53.1730 32.4667 175.4290 *187 A 4.0481 8.0402 124.0509 53.5602 19.2524 179.0065 188 T 3.6080 7.3762 117.7949 64.3880 69.3636 173.8605 189 S 4.6321 8.9205 117.7342 59.6776 64.7135 176.2383 190 S 4.1957 8.2883 113.3285 61.0147 64.1100 175.9722 191 A 3.9313 9.0371 123.2601 53.4420 16.6224 181.3734 192 L 3.2898 8.0655 121.4393 55.8672 44.7753 175.5960 193 R 4.0187 8.1540 116.7254 59.1506 30.1897 178.1399 194 A 4.1700 12.0000 120.9742 53.6080 18.7447 178.9611 195 A 3.8175 7.8070 116.8680 55.5007 18.4195 179.5487 196 L 3.9387 7.8337 115.9838 58.1262 41.8975 179.3779 197 S 4.2285 7.3551 111.4881 62.1072 62.2855 175.0240 198 L 4.0934 8.9392 123.9858 55.5776 41.5406 178.6249 199 L 3.4911 8.7583 121.2947 56.8668 41.9070 178.8141 200 G 3.7358 9.3671 108.1619 47.1510 0.0000 178.8897 201 K 3.5045 6.7737 115.2706 55.6616 35.4003 174.6089 202 T 4.1641 7.9435 131.1314 62.7325 68.9158 175.9154 *203 R 4.1539 8.3615 123.9606 56.2986 30.1278 172.8290 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 8.30 4.42 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 2 I 7.83 4.54 1.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.90 0.91 0.00 0.00 3 F 8.49 5.22 0.00 2.84 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 4 S 7.96 4.82 0.00 3.85 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 5 V 7.98 4.28 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 0.92 0.00 0.00 0.64 0.00 0.00 6 R 8.33 4.49 0.00 1.87 1.82 0.00 3.33 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 7 G 8.92 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 0.00 0.00 0.00 8 E 8.19 5.05 0.00 2.14 1.81 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 2.20 2.22 0.00 9 V 8.97 3.84 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 0.98 0.00 0.00 0.93 0.00 0.00 10 L 9.08 4.34 0.00 1.55 1.51 0.90 1.16 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 11 E 8.13 4.48 0.00 2.00 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 2.30 2.22 0.00 12 V 8.16 4.53 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 0.83 0.00 0.00 0.92 0.00 0.00 13 A 8.16 4.30 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 14 L 8.16 4.15 0.00 1.61 1.66 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 15 D 7.16 4.56 0.00 2.72 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 16 H 8.01 4.43 0.00 3.07 3.23 0.00 5.65 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 17 A 8.06 4.87 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.32 4.88 2.14 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 1.04 0.00 0.00 0.90 0.00 0.00 19 I 8.38 4.98 1.95 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 1.13 0.54 0.95 0.00 0.00 20 E 9.02 4.80 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.26 0.00 21 A 9.47 4.35 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 22 A 9.60 3.54 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 23 G 8.29 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 0.00 0.00 0.00 24 I 8.24 3.72 1.63 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.35 0.18 0.00 0.00 25 G 8.14 4.31 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 0.00 26 Y 9.16 4.61 0.00 2.93 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 27 R 8.56 4.28 0.00 1.73 1.73 0.00 3.01 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.37 0.00 28 V 8.61 4.30 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 0.77 0.00 0.00 0.95 0.00 0.00 29 N 8.00 4.41 0.00 2.38 2.65 0.00 0.00 6.61 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 30 A 7.72 4.31 1.12 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 31 T 7.45 4.62 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 1.20 0.00 0.00 32 P 0.00 4.14 0.00 2.28 2.37 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 33 S 7.52 4.13 0.00 3.94 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 34 A 8.64 4.34 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 35 L 7.92 3.83 0.00 1.60 1.77 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.46 3.96 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.69 4.18 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 1.21 0.00 0.00 38 L 7.48 4.07 0.00 1.67 1.56 0.91 1.04 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 39 N 8.51 4.77 0.00 2.77 2.72 0.00 0.00 6.64 8.18 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 40 Q 8.62 4.16 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.06 0.00 0.00 0.00 0.00 0.00 2.35 2.71 0.00 41 G 8.83 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 7.88 4.72 0.00 3.90 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.48 4.81 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 44 A 7.85 4.58 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 45 R 8.63 5.11 0.00 1.82 1.81 0.00 3.29 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 46 L 8.24 4.37 0.00 1.93 1.71 0.90 0.76 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 47 V 8.32 3.76 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.97 0.00 0.00 48 T 8.56 4.97 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 49 A 8.07 4.17 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 50 M 8.92 4.61 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 51 V 8.64 4.24 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.08 0.00 0.00 52 V 8.43 4.70 2.14 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 0.92 0.00 0.00 0.98 0.00 0.00 53 R 8.48 4.76 0.00 1.81 1.78 0.00 3.38 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 54 E 8.97 4.02 0.00 1.93 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 2.31 2.33 0.00 55 D 7.81 5.04 0.00 2.76 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 56 S 7.89 4.65 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 M 7.94 4.90 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 58 T 7.67 4.41 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 59 L 8.00 5.22 0.00 1.46 1.42 0.92 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 60 Y 8.79 4.57 0.00 2.74 2.26 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 61 G 8.67 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 62 F 9.34 5.26 0.00 2.83 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 63 S 9.02 4.06 0.00 4.00 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 64 D 7.77 4.66 0.00 3.01 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 65 A 8.74 4.09 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 66 E 8.02 3.98 0.00 2.48 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 2.32 2.39 0.00 67 N 10.87 4.23 0.00 2.74 2.80 0.00 0.00 7.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.57 3.22 0.00 1.92 2.18 0.00 2.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.47 0.00 69 D 7.66 4.31 0.00 2.88 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.74 3.88 0.00 1.63 1.67 0.89 1.00 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 71 F 8.01 4.37 0.00 2.53 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 72 L 8.24 3.73 0.00 1.69 1.69 0.93 0.72 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 73 A 8.69 3.75 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 9.10 3.74 0.00 1.47 1.70 0.96 0.51 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 75 L 8.23 3.61 0.00 0.63 1.51 0.63 0.66 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 76 S 8.37 4.13 0.00 3.80 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 77 V 7.44 3.80 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 0.79 0.00 0.00 0.91 0.00 0.00 78 S 8.34 4.26 0.00 3.88 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 79 G 7.53 3.87 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 0.00 80 V 7.97 2.35 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 0.66 0.00 0.00 0.92 0.00 0.00 81 G 8.95 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 82 P 0.00 4.18 0.00 2.27 1.56 0.00 3.64 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 2.18 1.94 0.00 83 R 7.58 3.78 0.00 1.90 1.89 0.00 3.17 0.00 0.00 3.35 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.97 0.00 84 L 7.90 3.96 0.00 1.75 1.57 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.99 3.80 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 86 M 8.97 4.16 0.00 2.15 2.58 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.87 0.00 87 A 8.43 3.94 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 88 T 8.40 3.80 4.42 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 1.24 0.00 0.00 89 L 8.50 4.17 0.00 1.84 1.81 0.95 0.84 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 90 A 8.27 4.17 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 91 V 8.01 4.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.97 0.00 0.00 92 H 8.86 4.26 0.00 3.19 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.71 4.84 0.00 2.80 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 94 A 8.61 4.27 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 95 A 9.92 3.36 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.03 3.65 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 97 L 8.47 4.00 0.00 1.94 1.50 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.54 3.84 0.00 1.94 1.93 0.00 3.26 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 99 Q 9.55 3.92 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.37 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 100 A 7.08 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.43 3.71 0.00 1.92 1.68 0.91 0.91 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 0.00 102 A 8.88 3.72 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.09 4.40 0.00 2.88 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 0.00 104 S 8.36 3.89 0.00 4.01 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 0.00 105 D 7.94 4.26 0.00 2.65 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 0.00 106 V 8.05 3.78 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 0.87 0.00 0.00 0.99 0.00 0.00 107 A 7.66 3.81 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 0.00 108 S 8.78 4.08 0.00 4.01 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.73 3.18 0.00 2.09 1.56 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 118 R 7.42 4.59 0.00 1.92 1.91 0.00 3.25 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 119 G 8.34 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.81 4.14 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 E 8.57 3.76 0.00 2.18 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 0.00 2.34 2.39 0.00 122 R 8.90 3.85 0.00 1.93 2.00 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 123 I 8.55 3.70 1.98 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 1.64 0.81 0.89 0.00 0.00 124 V 8.16 3.52 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 0.99 0.00 0.00 0.99 0.00 0.00 125 L 8.15 3.98 0.00 1.62 1.81 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 E 7.79 4.69 0.00 2.21 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 127 L 8.11 4.63 0.00 1.75 1.61 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.00 4.03 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 0.00 129 D 7.93 4.35 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.03 4.36 0.00 1.89 1.66 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 131 V 8.73 3.63 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 0.66 0.00 0.00 0.91 0.00 0.00 132 G 8.27 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 0.00 0.00 0.00 133 P 0.00 4.10 0.00 2.05 2.09 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 *147 G 8.17 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 0.00 148 N 8.39 4.36 0.00 2.77 2.82 0.00 0.00 6.90 7.76 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 0.00 149 A 8.18 3.92 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 0.00 150 V 7.96 3.52 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 1.02 0.00 0.00 0.96 0.00 0.00 151 R 8.61 4.10 0.00 1.88 1.95 0.00 3.30 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 152 G 9.55 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 0.00 153 S 7.87 3.97 0.00 3.90 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 0.00 154 V 7.91 3.38 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 1.00 0.00 0.00 0.99 0.00 0.00 155 V 7.91 3.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 156 E 8.30 4.04 0.00 2.09 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 0.00 2.33 2.52 0.00 157 A 8.35 3.83 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 0.00 158 L 8.29 4.10 0.00 2.01 1.96 1.10 0.79 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 0.00 159 V 8.66 3.89 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 1.14 0.00 0.00 1.09 0.00 0.00 160 G 10.31 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.47 4.11 0.00 1.44 1.60 0.91 1.12 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 0.00 162 G 8.12 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 0.00 163 F 7.83 4.51 0.00 3.17 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 0.00 164 A 8.47 4.53 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 8.38 4.41 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 0.00 166 K 8.53 4.58 0.00 1.95 1.95 0.00 1.23 0.00 0.00 2.29 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.37 7.81 167 Q 7.64 4.40 0.00 1.94 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.14 0.00 0.00 0.00 0.00 0.00 2.13 2.38 0.00 168 A 7.37 4.03 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 0.00 169 E 8.24 4.46 0.00 2.14 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 0.00 2.40 2.32 0.00 170 E 7.94 4.65 0.00 1.94 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 2.29 2.28 0.00 171 A 7.72 5.29 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 T 6.79 3.86 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 1.20 0.00 0.00 173 D 8.84 4.34 0.00 2.66 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 0.00 174 Q 7.59 3.71 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.12 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 175 V 8.43 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 0.93 0.00 0.00 0.98 0.00 0.00 176 L 7.80 3.95 0.00 1.78 1.68 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 177 D 8.13 4.95 0.00 2.70 2.62 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 0.00 178 G 8.24 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 E 7.97 3.12 0.00 2.15 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 2.29 2.29 0.00 *187 A 8.04 4.05 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 T 7.38 3.61 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 1.22 0.00 0.00 189 S 8.92 4.63 0.00 3.86 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 0.00 190 S 8.29 4.20 0.00 3.97 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 0.00 191 A 9.04 3.93 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 0.00 192 L 8.07 3.29 0.00 1.83 1.90 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 193 R 8.15 4.02 0.00 1.94 1.99 0.00 3.17 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 194 A 12.00 4.17 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 0.00 195 A 7.81 3.82 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 0.00 196 L 7.83 3.94 0.00 1.70 1.88 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 197 S 7.36 4.23 0.00 3.96 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 L 8.94 4.09 0.00 1.62 1.62 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 199 L 8.76 3.49 0.00 1.72 1.43 0.79 -0.01 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 0.00 200 G 9.37 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 0.00 201 K 6.77 3.50 0.00 1.84 1.95 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.42 7.81 202 T 7.94 4.16 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 1.22 0.00 0.00 *203 R 8.36 4.15 0.00 1.58 1.75 0.00 3.23 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 1.45 1.70 0.00 * Residues marked with a * may have inaccurate shift predictions.