NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3230 8.4444 120.2288 56.3449 31.6075 175.8346 2 V 3.9559 7.6186 117.7314 62.9644 32.2243 173.1867 3 Q 4.8231 9.8389 125.6431 54.4201 33.5889 173.4313 4 L 5.5071 8.5015 120.0038 53.2400 46.6656 176.0182 5 V 4.7880 8.8159 120.9320 60.5990 34.6724 173.7881 6 E 5.1144 9.0369 125.3877 55.7693 30.7043 175.9420 7 S 4.7125 9.6912 117.5797 57.4535 66.7793 174.4942 8 G 4.0860 8.3690 106.2564 45.4965 0.0000 172.9652 9 G 3.8336 9.2030 104.7578 43.2872 0.0000 172.3214 10 G 3.7458 9.1080 105.9687 43.8864 0.0000 171.5586 11 L 4.9225 8.0297 121.2048 53.9706 43.6267 177.5764 12 V 4.4677 8.5595 124.7623 60.9816 35.2680 174.7111 13 K 4.6085 8.7761 125.7886 54.8012 33.5719 176.3268 14 A 4.2524 8.2295 126.2682 54.4211 18.9014 178.4446 15 G 3.9676 9.6269 111.4358 45.0362 0.0000 173.8378 16 G 4.0753 7.9953 107.3639 45.8398 0.0000 172.6110 17 S 5.4251 8.3890 114.5558 56.7783 66.4981 173.9320 18 L 4.4984 8.5139 122.8935 53.8681 45.8044 174.1946 19 I 4.6723 8.1876 125.9197 59.4766 39.5734 174.8671 20 L 4.9632 8.5406 127.0589 53.0489 44.5651 175.5938 21 S 5.3091 8.9698 115.3431 56.7782 67.1644 171.9011 22 C 5.4384 9.4620 120.8420 54.9782 45.2744 173.1813 23 G 4.6120 9.2283 112.7475 44.6511 0.0000 171.7426 24 V 5.1552 7.7980 111.8090 59.7631 36.2967 175.2248 25 S 4.4448 8.5610 116.6034 57.7416 67.1432 174.7738 26 N 4.4644 9.5288 119.3157 53.6200 35.7782 173.5785 27 F 4.8964 7.5941 111.0109 56.1133 40.4258 173.1008 28 R 4.5094 8.3514 120.3064 54.2364 31.8186 177.8258 29 I 3.9470 8.8651 116.4876 63.0182 38.0454 178.2460 30 S 4.2434 7.3923 115.9934 61.3652 62.6034 175.5967 31 A 4.1349 7.9900 121.6863 53.5826 18.5514 176.5797 32 H 4.9740 8.0616 113.1968 53.7577 31.5423 174.1411 33 T 4.2952 8.3700 119.8684 64.0302 69.5209 173.3022 34 M 4.8337 8.8973 125.1761 53.6735 35.4325 174.6484 35 N 5.4872 8.5335 117.7164 51.4155 43.7769 173.2003 36 W 5.0911 9.0431 120.7652 55.0782 32.1286 175.2873 37 V 5.2458 9.2974 123.4703 61.1881 35.0991 174.2198 38 R 5.0490 9.2967 121.9383 54.3544 33.1463 174.0574 39 R 5.0658 9.1502 122.2040 54.9304 31.8466 176.4023 40 V 4.3000 8.4196 120.4323 59.9252 32.5914 175.7538 41 P 4.2784 0.0000 0.0000 65.6628 31.1725 178.3295 42 G 3.6617 7.9800 105.2845 46.3290 0.0000 174.1060 43 G 4.0407 8.1536 107.6434 45.2501 0.0000 174.5219 44 G 3.9388 8.0026 108.6202 44.9727 0.0000 172.3927 45 L 5.2216 8.1620 119.6875 53.2952 43.9028 176.1062 46 E 4.8003 9.2996 121.3842 54.1099 33.2567 175.0182 47 W 4.6253 9.3070 135.0000 58.1289 31.1892 174.7767 48 V 4.0112 8.4476 126.2100 63.9181 32.8037 174.9960 49 A 4.4264 6.8614 119.5965 50.6661 22.7118 174.3996 50 S 5.2249 9.3208 114.5430 56.5395 66.4875 172.7205 51 I 5.1502 8.8263 126.3198 59.2089 40.9408 175.1903 52 S 4.9853 9.0958 124.9688 57.3887 65.0352 173.7497 52A T 4.0570 8.5275 109.8542 63.2645 68.7487 174.3303 53 S 3.7074 9.4050 117.2401 59.0605 60.6520 172.5227 54 S 3.8709 8.1601 113.0937 59.7971 60.7558 173.4975 55 T 3.7737 7.6085 119.7843 65.9945 68.3801 174.4860 56 Y 4.9412 8.2223 118.8246 56.1130 41.5392 175.0038 57 R 5.1402 8.9512 122.6738 54.5373 32.9255 174.9179 58 D 5.1658 8.9258 122.5171 52.8853 45.3860 174.2810 59 Y 4.9483 8.6801 117.1155 55.7408 42.2883 175.0961 60 A 4.2505 8.1712 124.5331 52.3502 19.1853 178.3854 61 D 4.3307 9.2506 120.3013 57.6375 41.0788 179.2815 62 A 4.1391 7.9703 119.7686 54.1378 18.6917 177.9825 63 V 3.8373 7.5716 107.0679 60.1117 33.3251 175.6812 64 K 3.8248 7.2595 120.7201 57.9027 32.2398 176.9126 65 G 3.9743 8.7126 114.2052 45.1786 0.0000 173.7667 66 R 4.5964 7.9675 117.5005 56.3028 32.9770 175.9788 67 F 5.5773 8.1041 115.7748 55.9802 41.8191 175.5019 68 T 4.9682 8.8147 118.1866 61.8180 72.2323 173.1313 69 V 5.0729 9.2199 126.0985 60.3850 33.4999 175.3260 70 S 5.1377 9.1768 118.8917 56.9536 67.5957 172.9018 71 R 5.1889 8.6387 116.4495 54.8229 33.0487 174.5417 72 D 4.7631 9.4356 119.8023 52.7882 42.8268 175.7425 73 D 4.4254 8.8297 126.4019 56.6855 41.4506 178.4214 74 L 4.1241 8.0916 118.4220 56.9212 41.7587 177.4191 75 E 4.3161 8.1921 114.5663 55.2726 30.9019 175.0384 76 D 4.1130 7.8520 116.9157 55.2898 37.5372 173.1068 77 F 5.1900 8.1626 117.7336 55.6063 43.8966 176.1644 78 V 4.9161 8.4764 120.7232 61.4171 34.9152 173.9108 79 Y 5.3793 9.3964 123.3245 56.1560 42.2776 174.4802 80 L 4.6530 8.5981 123.9873 53.2949 45.0274 175.1843 81 Q 4.3466 9.0291 127.0317 55.3795 30.3742 175.0212 82 M 4.2187 8.3460 123.2853 53.5336 34.8851 174.5733 82A H 5.1215 8.7359 119.9323 53.2820 32.9481 173.1853 82B K 4.0871 8.5481 115.4319 56.5349 29.7834 175.8904 82C M 4.5330 8.0268 117.2497 55.6301 33.0611 176.5091 83 R 4.9557 9.0099 120.2224 53.9391 34.0057 177.0193 84 V 3.7879 8.5463 119.6568 66.2495 31.4396 178.0296 85 E 4.1071 8.1020 115.2704 58.4712 29.5191 177.3251 86 D 4.6506 8.0516 119.0041 56.3451 41.0999 176.5073 87 T 4.2974 8.0388 117.2149 64.3201 68.7970 173.4900 88 A 4.4480 8.8441 126.8674 51.5695 23.8811 174.6156 89 I 4.4773 8.0946 120.4589 60.8950 38.7582 174.9641 90 Y 4.9735 9.0609 125.2167 56.5189 40.1805 174.3240 91 Y 5.5161 9.5635 122.2066 56.3408 41.4734 172.4414 92 C 4.3968 9.4882 118.1844 54.1552 44.7343 172.4574 93 A 4.5724 8.0423 122.0625 50.1807 22.5580 174.8459 94 R 4.2636 8.2967 122.4845 54.7278 32.0898 175.0136 95 K 4.7012 8.0659 128.0460 55.7112 32.9631 175.9436 96 G 4.0564 8.6749 113.9384 46.9946 0.0000 171.3612 97 S 4.6615 8.4368 113.6926 56.9323 65.2539 173.7444 98 D 4.4379 8.7980 121.9396 55.3782 38.9591 176.7961 99 R 4.5160 7.1690 116.2366 53.5410 31.9994 174.9715 100 L 4.2910 8.5375 125.8711 54.9758 42.1859 176.2494 100A S 4.7767 8.8679 116.4918 56.4214 66.1471 173.7431 100B D 4.4187 8.5677 118.8783 56.7241 40.5065 176.9149 100C N 4.6407 7.8519 116.5982 52.9289 39.8989 172.7668 100D D 5.1025 8.1638 124.0382 51.5768 44.1536 174.5982 100E P 4.5560 0.0000 0.0000 62.5920 34.3535 174.7533 100F F 5.7687 8.9934 119.4810 56.1357 38.3582 175.8682 101 D 4.6413 8.7908 123.5688 54.3686 40.3593 176.6494 102 A 4.8936 7.4757 121.4097 50.1783 22.5789 174.9252 103 W 5.3172 8.8801 120.6683 54.6389 33.1778 175.5488 104 G 4.1691 9.0984 111.4751 45.1214 0.0000 172.2052 105 P 4.5746 0.0000 0.0000 63.8488 31.8005 177.6652 106 G 3.8903 9.0206 106.1492 45.4315 0.0000 172.5573 107 T 4.6548 8.7477 115.6422 59.7886 70.7266 173.0448 108 V 4.2104 8.4112 128.5403 62.6696 33.2322 174.5411 109 V 4.7911 9.0256 127.4557 61.4034 34.5528 174.0589 110 T 4.8529 8.9303 124.2996 61.7046 71.6941 172.9973 111 V 4.7960 8.6731 127.6225 60.9537 32.8463 175.4428 112 S 4.4851 8.8488 124.3991 57.3963 63.7037 174.0172 113 P 4.0918 0.0000 0.0000 65.2235 31.4134 176.2056 114 A 4.2921 7.8170 122.2028 51.2749 18.0639 177.1343 115 S 4.5595 8.6929 118.3227 61.0884 63.7912 174.1884 116 T 5.2567 7.6003 109.0889 60.1476 72.4096 173.6646 117 K 4.5039 9.4629 124.0667 55.1628 35.3960 175.6807 118 G 4.1791 8.8833 115.4294 45.4794 0.0000 171.0845 119 P 4.9153 0.0000 0.0000 62.6232 32.7907 175.5669 120 S 4.4959 9.0926 117.8791 57.2911 64.7945 173.2815 121 V 4.5518 7.7719 123.6556 61.0272 33.4175 174.5135 122 F 5.3175 8.8519 126.6665 54.8238 42.3847 173.1417 123 P 4.8347 0.0000 0.0000 63.0723 32.6516 176.3266 124 L 4.9015 9.4381 122.7769 52.4436 42.2315 174.9804 125 A 4.4838 8.3751 125.6613 50.6428 19.3632 175.2003 126 P 4.6591 0.0000 0.0000 63.0440 32.6786 175.7780 127 S 4.6023 8.8464 115.9962 57.1427 66.0938 174.7210 128 S 4.2710 8.5686 112.9866 60.3043 62.8883 175.8009 129 K 4.3015 8.1409 120.1411 57.0249 32.6906 176.7766 130 S 5.0477 7.4727 113.4629 57.5367 63.1798 174.4098 124 T 4.9115 9.4281 114.5769 59.1436 69.6315 172.0804 125 S 4.6338 8.4451 117.5613 56.4428 64.0632 172.0003 126 G 4.1991 8.6487 109.7344 44.8440 0.0000 173.3780 127 G 4.0923 8.8664 109.0962 43.9427 0.0000 175.0210 128 T 4.1510 8.4086 110.8866 63.8043 68.8883 175.9009 129 A 4.3015 8.0909 123.5411 53.3249 18.6906 177.9766 130 A 4.8977 7.4027 121.5629 51.7367 18.4798 177.6098 140 L 4.6581 8.0882 119.9221 54.8323 44.8460 174.6895 141 G 4.1849 7.7203 103.4185 46.6670 0.0000 172.8380 142 C 5.4691 9.0759 116.6145 55.1092 44.6778 173.2922 143 L 4.7950 9.3576 126.2784 54.0540 43.4955 175.3011 144 V 4.6063 9.3980 127.6435 61.3251 33.1183 173.8590 145 K 4.8875 9.2473 129.8829 54.7799 35.1578 175.1286 146 D 4.3862 8.6199 123.6027 56.0085 37.7016 172.1669 147 Y 5.2043 7.2814 117.0334 55.6199 42.2483 175.8450 148 F 5.1852 9.0780 120.0776 56.9804 43.5225 172.2863 149 P 3.7178 0.0000 0.0000 61.3608 33.4547 175.3911 150 E 4.1565 7.9637 118.6154 56.0720 29.8381 174.3606 151 P 4.8608 0.0000 0.0000 61.2901 33.8620 174.4022 152 V 4.4631 7.7913 111.1386 59.9489 34.1057 175.5177 153 T 4.6546 8.6182 119.5315 61.8161 71.9505 173.6115 154 V 4.9581 8.1916 123.5934 60.0179 34.8066 174.7176 *156 S 5.1330 8.4617 121.2787 58.3168 65.2752 172.1325 157 W 5.2451 8.2343 118.2906 53.3957 32.5056 176.5541 *162 N 4.4544 8.4488 122.4030 53.7010 39.4326 174.5848 163 S 3.6916 9.8639 109.1318 59.6518 61.0823 174.1609 164 G 3.9764 8.3411 108.9454 45.3282 0.0000 175.4187 165 A 4.0340 7.7408 121.6195 53.5727 18.6340 177.0471 166 L 4.7096 7.9726 117.5375 53.6639 43.1300 175.4356 167 T 4.4961 8.3512 114.9393 62.3503 70.9708 174.8468 168 S 3.9891 8.0117 115.9977 59.2576 63.1553 173.6854 169 G 3.5959 8.5569 114.1412 46.2526 0.0000 172.4080 *171 V 4.1294 7.5651 117.9411 62.7106 32.6766 174.2233 172 H 4.7778 8.8635 124.5376 54.2469 31.6056 172.8161 173 T 4.8477 8.3133 120.3706 61.6799 69.6840 174.6021 174 F 4.4060 8.8608 125.8926 56.2704 39.9120 174.2048 175 P 4.3366 0.0000 0.0000 62.7772 31.7679 176.4688 176 A 4.5534 8.5480 123.5798 52.2638 19.4342 176.7546 177 V 4.4575 8.8578 120.2589 60.9087 34.6027 174.4167 178 L 4.2585 8.4601 129.2873 54.4475 42.5980 176.3130 179 Q 4.4496 8.6735 126.0789 55.0049 29.9419 177.5736 180 S 3.9968 8.6340 115.5534 61.0787 63.1654 176.1115 *182 S 4.3688 7.4188 113.3297 57.2771 64.3452 174.6422 183 G 3.7742 8.4063 109.7516 45.0390 0.0000 172.9727 184 L 4.7523 7.1182 118.0095 53.0829 45.1215 175.3500 185 Y 4.7339 8.5092 118.7167 57.2284 40.1398 174.7467 186 S 5.3227 8.7680 115.2464 57.2261 66.6039 172.6078 187 L 5.0928 9.2128 124.2389 54.9841 44.4408 174.2173 188 S 5.4178 8.9168 114.8146 56.8832 66.5835 172.9231 189 S 5.4561 9.1853 117.9519 56.8171 64.6189 173.3386 190 V 5.1830 9.2420 120.1030 59.6596 35.7338 174.8913 191 V 5.0349 8.7081 121.1887 59.6438 34.7618 173.9585 192 T 5.4703 8.2337 113.0365 60.5060 70.6591 173.9220 193 V 4.5481 7.8606 115.5562 58.7934 36.3076 173.3673 194 P 4.4661 0.0000 0.0000 62.8290 31.8633 177.9798 195 S 4.1163 8.8593 118.5264 61.7439 62.9317 176.9200 196 S 4.2415 8.0276 113.5731 60.5519 63.0552 175.1427 197 S 4.4098 8.2982 115.7515 59.3395 63.4685 174.2394 198 L 4.3556 7.4338 122.6243 56.2775 41.5888 177.6109 199 G 4.0346 9.1732 111.7028 45.6960 0.0000 173.8167 200 T 4.1701 7.8076 115.7752 64.2000 69.5693 174.4753 *203 Q 4.1397 7.5522 117.5842 56.0708 29.6708 173.6443 *205 T 4.0472 7.8907 110.7939 62.0729 67.8871 172.1554 206 Y 5.0217 8.3225 123.4626 56.3711 41.1019 174.4861 207 I 5.1259 8.6848 124.6198 59.5315 41.0585 173.3240 208 C 3.6627 8.5560 122.1155 54.0614 38.9725 172.4428 209 N 5.2097 8.5722 120.1461 50.9497 40.2988 173.5580 210 V 4.3714 8.8292 125.2850 61.0485 33.8496 173.9695 211 N 5.1558 9.0611 126.5146 52.1730 41.9701 172.5099 212 H 4.6582 9.3315 127.2391 53.5961 29.9221 173.8349 213 K 3.7542 8.4792 125.1200 58.5926 32.3626 177.0018 214 P 4.1459 0.0000 0.0000 64.9722 31.2288 177.0691 215 S 4.5281 7.7668 109.2997 57.0506 63.6708 173.0013 216 N 4.0870 7.8193 118.4542 55.5419 37.7982 173.7670 217 T 4.6824 7.7900 112.9141 61.5468 71.5028 174.5324 218 K 5.0038 8.6556 125.0574 54.4933 35.3682 175.6910 219 V 4.3784 8.8557 124.1772 61.1313 35.0262 173.5882 220 D 5.2608 8.6351 126.9378 52.3715 43.6533 174.8947 221 K 4.4210 8.7729 124.7434 54.2728 35.4234 174.7938 222 K 4.8215 8.5192 128.8273 55.4469 33.7698 175.5968 *225 V 4.6586 8.5350 126.2635 63.1213 32.1664 173.9628 226 E 4.8885 8.8109 124.5815 53.9041 32.7905 174.1360 227 P 4.5041 0.0000 0.0000 62.7756 31.5934 176.0994 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 E 8.44 4.32 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 2 V 7.62 3.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.83 0.00 0.00 3 Q 9.84 4.82 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.48 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 4 L 8.50 5.51 0.00 1.71 1.50 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.82 4.79 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 0.75 0.00 0.00 0.99 0.00 0.00 6 E 9.04 5.11 0.00 2.00 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 2.78 2.52 0.00 7 S 9.69 4.71 0.00 3.80 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.37 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 0.00 0.00 0.00 9 G 9.20 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 10 G 9.11 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.03 4.92 0.00 1.60 1.50 0.95 0.70 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 12 V 8.56 4.47 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 0.96 0.00 0.00 0.84 0.00 0.00 13 K 8.78 4.61 0.00 1.63 1.76 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 0.97 7.81 14 A 8.23 4.25 1.37 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 15 G 9.63 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 0.00 0.00 0.00 16 G 8.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.39 5.43 0.00 3.71 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.51 4.50 0.00 1.55 1.17 0.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.19 4.67 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.95 0.90 0.00 0.00 20 L 8.54 4.96 0.00 0.80 1.45 0.21 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.97 5.31 0.00 3.58 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 22 C 9.46 5.44 0.00 2.73 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 23 G 9.23 4.61 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 0.00 0.00 0.00 24 V 7.80 5.16 1.48 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 0.55 0.00 0.00 0.30 0.00 0.00 25 S 8.56 4.44 0.00 3.76 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 26 N 9.53 4.46 0.00 2.97 2.99 0.00 0.00 6.80 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.59 4.90 0.00 3.12 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.35 4.51 0.00 1.84 1.79 0.00 3.16 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.50 0.00 29 I 8.87 3.95 1.83 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 1.36 1.21 0.61 0.00 0.00 30 S 7.39 4.24 0.00 4.02 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 31 A 7.99 4.13 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 32 H 8.06 4.97 0.00 3.25 3.18 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.37 4.30 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 1.24 0.00 0.00 34 M 8.90 4.83 0.00 1.72 1.86 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 2.46 2.77 0.00 35 N 8.53 5.49 0.00 2.01 2.57 0.00 0.00 6.95 8.17 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 36 W 9.04 5.09 0.00 3.33 3.27 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 37 V 9.30 5.25 2.54 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 1.38 0.00 0.00 1.26 0.00 0.00 38 R 9.30 5.05 0.00 1.20 0.93 0.00 2.53 0.00 0.00 2.89 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.41 0.00 39 R 9.15 5.07 0.00 2.21 2.04 0.00 3.21 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 40 V 8.42 4.30 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 0.68 0.00 0.00 0.99 0.00 0.00 41 P 0.00 4.28 0.00 2.06 2.14 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 42 G 7.98 3.66 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 0.00 43 G 8.15 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 44 G 8.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.16 5.22 0.00 1.64 1.79 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.30 4.80 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 47 W 9.31 4.63 0.00 3.42 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.45 4.01 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 1.28 0.00 0.00 1.09 0.00 0.00 49 A 6.86 4.43 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 50 S 9.32 5.22 0.00 4.39 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 51 I 8.83 5.15 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.39 1.02 0.00 0.00 52 S 9.10 4.99 0.00 4.12 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 0.00 52A T 8.53 4.06 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 1.29 0.00 0.00 53 S 9.40 3.71 0.00 3.99 3.96 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 54 S 8.16 3.87 0.00 4.05 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 55 T 7.61 3.77 3.56 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 0.66 0.00 0.00 56 Y 8.22 4.94 0.00 2.99 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 57 R 8.95 5.14 0.00 1.81 1.79 0.00 3.31 0.00 0.00 3.58 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 58 D 8.93 5.17 0.00 2.84 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 59 Y 8.68 4.95 0.00 2.78 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 60 A 8.17 4.25 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 61 D 9.25 4.33 0.00 2.84 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 62 A 7.97 4.14 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 63 V 7.57 3.84 0.67 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 -0.03 0.00 0.00 0.70 0.00 0.00 64 K 7.26 3.82 0.00 1.91 1.70 0.00 1.87 0.00 0.00 1.80 0.00 0.00 3.15 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.42 7.81 65 G 8.71 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 0.00 0.00 0.00 66 R 7.97 4.60 0.00 1.94 2.34 0.00 3.43 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 67 F 8.10 5.58 0.00 2.64 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 68 T 8.81 4.97 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 1.32 0.00 0.00 69 V 9.22 5.07 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 0.73 0.00 0.00 1.30 0.00 0.00 70 S 9.18 5.14 0.00 4.01 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 71 R 8.64 5.19 0.00 1.80 1.92 0.00 3.02 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 72 D 9.44 4.76 0.00 2.93 2.82 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 73 D 8.83 4.43 0.00 2.71 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 74 L 8.09 4.12 0.00 1.66 1.73 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.19 4.32 0.00 2.31 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 2.27 2.49 0.00 76 D 7.85 4.11 0.00 2.30 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 77 F 8.16 5.19 0.00 2.92 2.36 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 78 V 8.48 4.92 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 1.28 0.00 0.00 0.84 0.00 0.00 79 Y 9.40 5.38 0.00 2.97 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 80 L 8.60 4.65 0.00 0.27 0.17 0.86 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.03 4.35 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.52 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 82 M 8.35 4.22 0.00 1.05 1.41 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 0.00 82A H 8.74 5.12 0.00 3.15 3.15 0.00 5.80 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82B K 8.55 4.09 0.00 1.91 1.88 0.00 1.82 0.00 0.00 2.37 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.43 7.81 82C M 8.03 4.53 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.54 0.00 83 R 9.01 4.96 0.00 1.85 1.97 0.00 3.15 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 84 V 8.55 3.79 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 1.12 0.00 0.00 0.95 0.00 0.00 85 E 8.10 4.11 0.00 2.14 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 2.30 2.29 0.00 86 D 8.05 4.65 0.00 3.00 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 87 T 8.04 4.30 4.34 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 1.25 0.00 0.00 88 A 8.84 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.09 4.48 1.74 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.69 0.51 0.00 0.00 90 Y 9.06 4.97 0.00 2.94 3.13 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 91 Y 9.56 5.52 0.00 3.23 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 9.49 4.40 0.00 2.08 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 93 A 8.04 4.57 -0.12 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 94 R 8.30 4.26 0.00 1.63 1.45 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.26 0.00 95 K 8.07 4.70 0.00 1.83 1.77 0.00 2.04 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.73 7.81 96 G 8.67 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 97 S 8.44 4.66 0.00 3.81 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 98 D 8.80 4.44 0.00 2.81 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 99 R 7.17 4.52 0.00 1.79 1.81 0.00 3.26 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 100 L 8.54 4.29 0.00 1.65 1.57 0.81 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 100A S 8.87 4.78 0.00 3.89 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 100B D 8.57 4.42 0.00 2.68 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 100C N 7.85 4.64 0.00 2.63 2.66 0.00 0.00 7.04 8.25 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 100D D 8.16 5.10 0.00 2.61 2.70 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 100E P 0.00 4.56 0.00 2.16 2.21 0.00 3.80 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 2.23 2.01 0.00 100F F 8.99 5.77 0.00 3.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 8.79 4.64 0.00 2.79 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.48 4.89 1.03 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 0.00 0.00 103 W 8.88 5.32 0.00 3.03 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 9.10 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 0.00 0.00 0.00 105 P 0.00 4.57 0.00 2.29 2.29 0.00 4.02 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 2.09 2.04 0.00 106 G 9.02 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 0.00 107 T 8.75 4.65 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 1.35 0.00 0.00 108 V 8.41 4.21 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 0.90 0.00 0.00 0.95 0.00 0.00 109 V 9.03 4.79 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 0.80 0.00 0.00 0.68 0.00 0.00 110 T 8.93 4.85 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 1.21 0.00 0.00 111 V 8.67 4.80 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.96 0.00 0.00 112 S 8.85 4.49 0.00 3.91 3.93 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 0.00 113 P 0.00 4.09 0.00 2.21 2.24 0.00 3.75 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 1.99 1.97 0.00 114 A 7.82 4.29 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 0.00 115 S 8.69 4.56 0.00 4.10 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 0.00 116 T 7.60 5.26 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 1.35 0.00 0.00 117 K 9.46 4.50 0.00 1.89 1.83 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.46 7.81 118 G 8.88 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.92 0.00 2.02 1.96 0.00 3.68 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 120 S 9.09 4.50 0.00 3.61 3.29 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 0.00 121 V 7.77 4.55 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 0.70 0.00 0.00 0.78 0.00 0.00 122 F 8.85 5.32 0.00 3.05 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.83 0.00 2.18 2.15 0.00 3.97 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 124 L 9.44 4.90 0.00 1.79 1.72 1.05 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.38 4.48 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 0.00 126 P 0.00 4.66 0.00 2.07 2.12 0.00 3.89 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.96 0.00 127 S 8.85 4.60 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.57 4.27 0.00 4.02 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 0.00 129 K 8.14 4.30 0.00 1.82 1.88 0.00 1.61 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.51 7.81 130 S 7.47 5.05 0.00 3.94 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 0.00 124 T 9.43 4.91 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 0.00 125 S 8.45 4.63 0.00 3.89 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 0.00 126 G 8.65 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.87 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 0.00 0.00 0.00 128 T 8.41 4.15 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 0.00 129 A 8.09 4.30 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 0.00 130 A 7.40 4.90 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 0.00 140 L 8.09 4.66 0.00 1.81 1.64 0.46 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.72 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 C 9.08 5.47 0.00 2.86 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 9.36 4.80 0.00 1.87 1.78 1.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 144 V 9.40 4.61 2.27 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 0.77 0.00 0.00 0.92 0.00 0.00 145 K 9.25 4.89 0.00 2.02 1.80 0.00 2.07 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.51 7.81 146 D 8.62 4.39 0.00 2.96 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 0.00 147 Y 7.28 5.20 0.00 2.92 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 0.00 148 F 9.08 5.19 0.00 3.26 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 3.72 0.00 1.67 1.08 0.00 3.82 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 1.79 1.80 0.00 150 E 7.96 4.16 0.00 1.63 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.47 0.00 151 P 0.00 4.86 0.00 2.08 1.96 0.00 3.63 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 152 V 7.79 4.46 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 0.65 0.00 0.00 153 T 8.62 4.65 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 1.17 0.00 0.00 154 V 8.19 4.96 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 1.05 0.00 0.00 0.87 0.00 0.00 *156 S 8.46 5.13 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 0.00 157 W 8.23 5.25 0.00 3.56 3.25 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 0.00 *162 N 8.45 4.45 0.00 3.02 2.92 0.00 0.00 7.16 7.24 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 0.00 163 S 9.86 3.69 0.00 3.97 3.93 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 G 8.34 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 0.00 165 A 7.74 4.03 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 0.00 166 L 7.97 4.71 0.00 1.69 1.93 0.95 0.99 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 0.00 167 T 8.35 4.50 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 1.28 0.00 0.00 168 S 8.01 3.99 0.00 3.83 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 0.00 169 G 8.56 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *171 V 7.57 4.13 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 0.98 0.00 0.00 0.83 0.00 0.00 172 H 8.86 4.78 0.00 2.74 2.52 0.00 5.63 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.31 4.85 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 1.27 0.00 0.00 174 F 8.86 4.41 0.00 3.17 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.34 0.00 2.14 2.06 0.00 3.97 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 176 A 8.55 4.55 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 0.00 177 V 8.86 4.46 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 0.93 0.00 0.00 0.97 0.00 0.00 178 L 8.46 4.26 0.00 1.61 1.50 0.25 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.67 4.45 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 180 S 8.63 4.00 0.00 3.96 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 *182 S 7.42 4.37 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 0.00 183 G 8.41 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 0.00 184 L 7.12 4.75 0.00 1.55 1.50 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.51 4.73 0.00 1.64 2.36 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 0.00 186 S 8.77 5.32 0.00 3.89 3.66 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 0.00 187 L 9.21 5.09 0.00 2.06 1.90 1.05 0.95 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 0.00 188 S 8.92 5.42 0.00 3.90 3.96 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 0.00 189 S 9.19 5.46 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 V 9.24 5.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.07 0.00 0.00 191 V 8.71 5.03 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 -0.22 0.00 0.00 0.59 0.00 0.00 192 T 8.23 5.47 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 1.15 0.00 0.00 193 V 7.86 4.55 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 0.46 0.00 0.00 0.73 0.00 0.00 194 P 0.00 4.47 0.00 2.18 1.97 0.00 3.62 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 195 S 8.86 4.12 0.00 3.88 3.93 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 0.00 196 S 8.03 4.24 0.00 3.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 S 8.30 4.41 0.00 4.11 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 L 7.43 4.36 0.00 1.73 1.72 0.92 1.18 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 0.00 199 G 9.17 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 0.00 0.00 0.00 200 T 7.81 4.17 4.36 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 1.20 0.00 0.00 *203 Q 7.55 4.14 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.64 0.00 0.00 0.00 0.00 0.00 2.07 1.44 0.00 *205 T 7.89 4.05 4.21 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 1.17 0.00 0.00 206 Y 8.32 5.02 0.00 3.08 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 0.00 207 I 8.68 5.13 1.89 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 1.43 0.91 0.87 0.00 0.00 208 C 8.56 3.66 0.00 1.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.57 5.21 0.00 2.55 2.74 0.00 0.00 6.41 7.22 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 0.00 210 V 8.83 4.37 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 0.82 0.00 0.00 0.74 0.00 0.00 211 N 9.06 5.16 0.00 2.67 2.53 0.00 0.00 6.28 7.91 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 0.00 212 H 9.33 4.66 0.00 3.00 3.08 0.00 5.68 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 K 8.48 3.75 0.00 1.79 1.72 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.49 7.81 214 P 0.00 4.15 0.00 1.86 2.02 0.00 3.19 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 215 S 7.77 4.53 0.00 4.03 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 0.00 216 N 7.82 4.09 0.00 2.80 2.86 0.00 0.00 6.94 7.22 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 0.00 217 T 7.79 4.68 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 1.19 0.00 0.00 218 K 8.66 5.00 0.00 1.55 1.62 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.35 7.81 219 V 8.86 4.38 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 0.88 0.00 0.00 0.85 0.00 0.00 220 D 8.64 5.26 0.00 2.59 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.77 4.42 0.00 1.72 1.51 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.40 7.81 222 K 8.52 4.82 0.00 1.91 1.69 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.33 7.81 *225 V 8.54 4.66 2.38 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 1.24 0.00 0.00 1.28 0.00 0.00 226 E 8.81 4.89 0.00 2.12 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 2.22 2.33 0.00 227 P 0.00 4.50 0.00 2.09 2.02 0.00 3.90 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.