NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4260 8.2893 120.3300 55.5122 32.3236 174.4803 2 K 4.2154 7.4555 122.0514 54.3989 33.1444 173.4327 3 E 4.9049 8.1435 120.0673 55.7731 31.1351 178.2260 4 V 4.4200 7.6277 117.2935 61.5945 34.2567 175.8973 5 A 4.2353 8.4985 131.2255 51.6620 18.9329 176.7449 6 V 4.4408 7.5673 112.1254 61.0690 29.8090 175.0716 7 Y 4.5474 7.8407 123.9630 58.4015 40.5004 175.5199 8 Q 4.4458 7.9812 125.0595 53.8142 31.5276 173.8878 9 I 4.3707 8.4684 127.6626 59.9297 37.9884 173.8058 10 P 4.2916 0.0000 0.0000 64.2075 31.2378 179.2770 11 V 4.2792 8.4989 119.2325 62.2490 31.3130 177.3487 12 L 4.1951 8.8398 117.6705 56.2508 42.0410 176.8524 13 S 4.0001 8.1594 113.4532 58.2392 62.7494 172.6163 14 P 4.4968 0.0000 0.0000 62.2789 32.0919 175.5287 15 S 3.7777 8.5172 116.7390 59.3655 63.0147 174.5079 16 G 4.4948 7.5703 117.4353 46.3989 0.0000 173.0863 17 R 4.6136 8.4404 120.7939 55.9873 32.9474 174.9623 18 R 4.3826 8.0742 126.1179 55.2856 32.5663 174.0759 19 E 5.1439 8.1044 116.0699 56.4580 31.4649 175.4788 20 L 4.2540 9.2155 119.0253 55.6587 45.5163 175.5757 21 A 3.9839 7.5974 121.7237 51.3857 21.5816 178.0055 22 A 4.4977 8.4482 121.7613 54.0991 18.7123 179.0239 23 D 4.5500 7.9624 119.0418 57.1834 41.0066 176.7383 24 L 5.0042 7.1427 117.7270 52.2626 43.9390 175.3792 25 P 4.6211 0.0000 0.0000 63.7128 28.7200 175.9352 26 A 4.1101 8.0157 126.6769 54.7303 19.1692 178.2581 27 E 4.7129 7.5820 108.9717 55.7686 33.2779 175.4359 28 I 4.3510 8.5227 117.6138 59.2593 39.5532 175.9350 29 N 4.6643 8.5582 123.5140 51.5125 37.9287 173.3647 30 P 4.1811 0.0000 0.0000 66.4031 31.8976 176.6086 31 H 4.0878 8.6764 115.1336 59.7510 29.5032 176.6404 32 L 3.7998 9.2762 121.3573 58.3154 42.3042 179.2429 33 L 4.0247 8.0100 118.6422 57.8401 41.6021 179.2563 34 W 4.3080 8.4914 128.0425 60.8648 30.6627 177.3366 35 E 3.1367 8.5558 118.4780 59.2250 28.7676 179.1809 36 V 3.6184 7.5162 117.8504 66.1087 31.7721 178.3341 37 V 3.9462 7.8676 117.9135 65.7732 31.4097 177.9713 38 R 3.6691 8.3947 119.4078 58.7857 29.7233 178.2811 39 W 3.8344 7.9510 128.2245 60.7017 30.8037 177.6728 40 Q 3.0395 8.3090 118.4240 58.4101 27.9456 178.3120 41 L 3.6768 7.9740 121.7518 58.2054 42.1301 177.8988 42 A 4.1145 7.4550 120.6225 52.8269 18.6203 178.7015 43 K 3.9186 8.1804 116.1285 59.5102 32.5306 178.8204 44 R 4.2784 7.2654 114.7858 55.5661 30.3524 176.4190 45 R 4.3988 7.2995 118.2189 55.7143 31.7664 177.0753 46 R 3.8148 8.6531 122.1959 59.4401 29.8277 177.0041 47 G 4.1533 8.4067 103.4476 46.7304 0.0000 173.4912 48 T 4.4848 7.5751 100.7225 61.2524 69.7787 174.7169 49 A 4.4944 8.2375 125.8198 51.7587 19.6752 176.9810 50 S 4.8328 8.4521 117.2153 57.4878 64.5424 173.8413 51 T 4.4908 8.5067 117.7587 60.7715 71.6175 173.3541 52 K 4.7974 8.1915 120.3623 54.6285 34.5352 176.8683 53 T 4.4600 8.8504 119.9333 61.2754 68.0216 175.1612 54 R 3.7808 8.5928 120.6850 58.3636 29.2869 177.5370 55 G 4.0332 7.9836 105.7517 45.3969 0.0000 173.4125 56 E 4.5895 8.7514 117.9356 55.6738 30.7494 175.8915 57 V 3.9875 7.3974 118.5490 61.2356 32.9648 176.3317 58 A 4.0752 7.9189 125.2086 53.1306 17.7055 177.2305 59 Y 4.7689 7.0568 116.0999 58.0669 39.2404 174.7403 60 S 4.7025 8.2193 115.6901 56.6056 64.1581 174.0921 61 G 3.7027 8.8130 111.7164 48.3124 0.0000 174.3885 62 R 3.5348 7.2898 117.6113 55.0212 30.4358 175.4606 63 K 4.9237 8.9066 124.1738 54.6605 31.0507 177.8869 64 I 3.1552 6.8708 124.4030 62.2517 39.6797 175.2250 65 W 5.3643 7.7701 118.8250 54.0416 32.5773 174.5299 66 P 4.3318 0.0000 0.0000 63.5104 31.0326 178.4697 67 Q 3.7508 8.4951 123.6869 56.1763 31.2970 173.9268 68 K 4.1633 9.0525 115.1465 56.9459 32.4094 177.6522 69 H 4.6669 9.1265 112.8442 56.0124 28.6381 176.5157 70 T 3.9613 7.7325 117.8979 66.2439 69.1932 175.7266 71 G 3.9799 8.1475 107.4085 45.9116 0.0000 173.9775 72 R 3.9272 6.8977 116.9812 54.6380 31.2288 175.5445 73 A 4.2205 7.8573 121.5599 51.3089 19.1640 177.6886 74 R 4.1622 8.1686 116.5804 57.4137 29.9309 175.7248 75 H 4.8463 8.5871 114.4595 56.0653 33.1103 173.2441 76 G 4.0065 9.2141 108.3246 46.7174 0.0000 175.3386 77 D 5.6516 9.4187 121.2694 50.2508 42.4833 178.1158 78 I 2.7269 8.0938 112.9436 62.0672 37.5750 177.0228 79 G 3.8141 7.9369 109.3697 47.2811 0.0000 174.0320 80 A 4.3572 7.8369 123.6508 51.4162 19.0444 175.3724 81 P 4.6712 0.0000 0.0000 65.6616 31.1004 178.2505 82 I 3.6536 7.7826 110.4801 61.5548 36.4250 175.7504 83 F 4.7009 8.5462 126.1469 59.5639 40.1390 178.6983 84 V 3.1445 8.3146 123.3935 63.9967 32.6773 175.9689 85 G 4.0174 9.3918 104.2665 45.6919 0.0000 171.8985 86 G 4.3490 7.2906 104.2387 43.4773 0.0000 173.4922 87 G 4.1282 8.6852 107.5111 46.4527 0.0000 173.0296 88 V 4.6035 8.0053 119.5829 58.3392 34.1213 178.7286 89 V 4.2601 8.1172 128.1378 62.3465 30.2040 179.0129 90 F 5.1180 8.4221 113.0507 56.5228 37.6074 175.4876 91 G 3.9594 9.1478 109.9878 44.1369 0.0000 172.4629 92 P 4.4153 0.0000 0.0000 62.6513 31.9215 175.3159 93 K 5.1389 8.1327 118.7988 53.4426 35.7863 173.9410 94 P 4.5823 0.0000 0.0000 63.2823 31.4835 175.7480 95 R 4.5328 8.1249 115.6463 55.2842 33.3007 173.3310 96 D 4.7485 8.4832 120.0975 54.0384 41.7156 175.6036 97 Y 4.4667 8.7308 123.2333 57.8289 38.5138 175.5345 98 S 4.8291 7.9708 114.9179 57.2200 64.9312 172.7613 99 Y 4.9493 7.8820 118.0847 56.5864 40.7975 175.3935 100 T 4.4334 8.3416 114.7404 61.3960 67.6866 173.0806 101 L 3.9034 7.2953 125.2294 53.8100 43.1285 174.9475 102 P 4.1538 0.0000 0.0000 63.0847 32.0294 177.5711 103 K 3.8610 8.5352 121.4082 59.3891 32.3330 178.8345 104 K 4.2238 7.9841 115.6516 57.2966 31.2922 177.7819 105 V 4.3201 7.4858 118.4273 62.6845 32.6108 176.9591 106 R 3.9767 7.7065 117.1158 58.6363 29.5302 176.9336 107 K 4.2365 7.9581 117.6014 57.2970 32.9788 179.7640 108 K 4.7801 7.8795 116.7566 58.9325 32.3364 178.5844 109 G 3.8158 7.7071 105.7070 46.5709 0.0000 175.5195 110 L 4.0927 9.4000 123.0790 57.9641 41.2658 178.7089 111 A 4.2491 8.0187 120.3993 55.5387 18.6114 179.1153 112 M 4.4402 7.9766 116.3131 58.8686 32.0443 179.0115 113 A 3.9842 8.2596 120.6064 55.2508 18.4518 179.7195 114 V 3.5012 7.4864 115.3355 66.6656 31.8909 177.2487 115 A 4.4381 9.8657 121.8814 53.2118 17.9045 178.7120 116 D 4.3643 8.6681 115.4950 56.7498 41.6750 179.6367 117 R 3.8470 8.0132 118.0672 59.3837 30.4968 177.8447 118 A 4.1710 8.0663 120.5489 55.2997 18.1286 179.0659 119 R 3.8293 8.1208 115.2499 60.2080 30.1029 178.0881 120 E 4.0913 7.8304 116.3307 57.9329 29.7125 178.1430 121 G 4.0683 8.8473 107.9254 45.1778 0.0000 175.0272 122 K 4.1316 7.9787 117.1284 57.8902 32.9039 175.9916 123 L 4.8882 7.9363 123.5905 54.1848 43.2167 175.7446 124 L 4.7998 8.9682 127.5886 53.3642 45.9294 174.7076 125 L 5.6991 8.5147 126.3962 53.4989 41.5672 176.2227 126 V 4.2472 8.0962 125.0449 63.1239 33.5356 174.3285 127 E 4.7415 8.3392 125.1551 57.2695 33.2330 177.0371 128 A 4.4811 7.9037 121.7317 51.1488 20.3931 177.5311 129 F 4.2752 8.2164 120.4132 55.1545 39.9265 174.0335 130 A 4.2219 8.5084 126.8363 55.2375 18.7798 179.2319 131 G 3.8166 7.9949 103.3244 45.9319 0.0000 172.7772 132 V 4.1355 9.1799 121.6419 61.6789 34.6681 172.0927 133 N 3.9384 8.3726 113.8225 58.2307 34.9658 177.1237 134 G 3.7260 7.7205 99.9863 46.2430 0.0000 172.3443 135 K 4.4264 7.4392 123.3368 54.5267 35.6637 174.9787 136 T 4.1402 8.6810 125.2949 66.3234 68.3775 175.8844 137 K 3.9291 8.2046 119.1529 60.0144 32.1689 178.7636 138 E 3.9592 8.3792 117.8997 59.8109 29.2019 178.9253 139 F 4.3538 8.2588 120.3252 60.7109 39.5800 176.6703 140 L 4.0723 8.8593 120.0164 59.1202 41.7339 178.4178 141 A 3.9660 8.6987 119.2649 54.6700 18.4818 178.5530 142 W 4.2788 8.7531 124.5984 60.3699 30.9177 178.3923 143 A 3.6746 8.9566 121.5783 55.2128 17.3987 179.3073 144 K 3.6707 8.0477 117.6546 59.8496 31.9010 177.6511 145 E 4.1534 7.4473 115.4524 56.7957 29.4470 176.7918 146 A 4.2813 7.9494 120.9618 51.4057 19.7837 176.8269 147 G 3.8202 7.8628 103.2443 46.3683 0.0000 175.5093 148 L 4.5088 7.3123 121.2643 53.2147 40.1048 176.0467 149 D 4.1978 7.7291 120.6011 54.2736 40.3293 178.3844 150 G 2.0764 7.5409 107.3779 45.1591 0.0000 173.9364 151 S 4.3904 7.7344 113.9424 58.1736 63.3307 174.9788 152 E 4.7067 7.9251 119.6431 53.9251 31.0485 173.9884 153 S 4.6087 8.6966 117.7048 59.0113 63.9331 173.7286 154 V 5.3414 9.7936 124.0750 60.0255 34.8572 173.8068 155 L 4.5670 8.4890 128.7989 54.2543 43.3392 174.6121 156 L 5.1845 8.8778 128.8058 53.4031 44.7851 175.3108 157 V 5.3552 8.4474 118.5883 59.0140 35.3037 174.5320 158 T 4.5326 8.3383 117.5647 61.4709 70.0513 172.9366 159 G 3.8614 8.7777 113.2826 45.3599 0.0000 172.8304 160 N 4.6814 7.7682 119.6446 51.9274 39.5905 174.8437 161 E 4.2297 8.4279 127.4343 57.0182 30.4899 177.4922 162 L 4.4664 7.4981 117.8503 55.5937 45.0855 179.5436 163 V 3.4123 7.4001 117.1758 65.6749 30.8624 177.6933 164 R 3.6337 7.1411 116.9508 59.0759 30.0587 178.2030 165 R 3.9000 7.7576 117.7583 59.7458 29.8449 177.8987 166 A 3.9224 8.2002 121.2962 53.3304 18.3109 180.9208 167 A 3.8854 8.0081 122.6123 49.8199 17.3868 177.9769 168 R 3.7507 8.1945 120.4705 59.7033 28.9141 176.7677 169 N 4.4466 7.9827 113.5257 54.5349 39.2794 174.4384 170 L 4.6188 8.0717 118.3341 52.0670 42.9179 175.6272 171 P 4.5998 0.0000 0.0000 64.0089 31.4516 176.3995 172 W 5.2103 7.7684 114.5807 55.9378 30.4426 174.0898 173 V 4.6685 7.5135 120.4535 61.4819 33.2244 175.7851 174 V 4.0821 8.9617 129.3173 61.0596 31.2937 173.9250 175 T 4.0607 8.0495 120.6344 62.2385 68.2069 172.6485 176 L 4.2896 8.1125 125.8723 54.2282 46.3786 174.8403 177 A 4.5845 8.6804 129.8169 51.7005 18.9571 174.5705 178 P 4.5986 0.0000 0.0000 64.0228 32.4771 177.0468 179 E 4.1839 8.2558 119.2769 59.1102 29.8762 179.0907 180 G 3.8509 8.0462 101.9421 46.3359 0.0000 174.1945 181 L 4.2724 8.1373 124.4224 55.0067 39.6892 174.3228 182 N 4.9614 8.0191 119.0869 50.6467 39.1836 177.4650 183 V 3.7691 8.6668 116.3029 64.5189 31.4581 177.6610 184 Y 4.3756 7.9864 119.3633 60.6920 38.2064 177.0747 185 D 4.0990 10.6100 119.1219 57.5585 40.8117 179.0439 186 I 3.7126 7.5458 119.1829 64.3556 37.1552 178.1239 187 V 3.8816 7.3298 118.0332 65.4302 31.6724 177.8694 188 R 3.9162 7.8892 115.4543 57.9443 29.2397 176.7917 189 T 4.5756 6.6226 107.3245 60.0710 70.4690 174.4132 190 E 4.2916 8.5001 122.7725 58.3462 31.1109 176.7181 191 R 4.8633 7.9861 118.7767 54.2539 33.8070 173.8103 192 L 5.0805 8.6949 127.7149 53.3182 44.8727 175.0270 193 V 5.0484 8.9453 125.6028 61.5631 34.4386 174.0569 194 M 5.3762 9.5541 127.2304 53.5079 35.9626 176.5655 195 D 5.0143 8.5708 121.9929 54.5583 42.8463 175.9124 196 L 4.7578 10.8200 113.0297 56.4976 43.6633 178.3512 197 D 4.4393 8.5654 118.0887 57.1890 40.6413 178.4590 198 A 4.3129 8.2399 120.9455 54.5867 18.2460 179.1524 199 W 4.0464 8.1340 125.8963 60.1248 31.2358 177.5545 200 E 4.4338 8.8691 120.2348 59.1194 28.7669 179.0291 201 V 3.7074 8.4488 119.4025 64.3910 31.1776 178.0634 202 F 4.1640 7.6173 120.7266 60.8321 39.2563 176.4998 203 Q 3.7416 7.7920 115.8666 57.2363 29.0246 177.0015 204 N 4.5930 7.6390 117.3244 54.9774 39.0212 176.3141 205 R 4.1328 7.1229 116.1892 55.5695 30.2606 174.9963 206 I 4.4425 7.9797 122.2014 60.0097 40.1124 177.3122 207 G 4.8644 8.6253 127.0700 47.1400 0.0000 172.0737 *208 G 3.7078 7.5614 111.4148 45.7069 0.0000 172.1271 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 8.29 4.43 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 2 K 7.46 4.22 0.00 1.99 1.82 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.52 7.81 3 E 8.14 4.90 0.00 2.10 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 0.00 2.35 2.20 0.00 4 V 7.63 4.42 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 0.98 0.00 0.00 5 A 8.50 4.24 1.14 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 6 V 7.57 4.44 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 0.80 0.00 0.00 0.94 0.00 0.00 7 Y 7.84 4.55 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 7.98 4.45 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 9 I 8.47 4.37 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.47 0.92 0.00 0.00 10 P 0.00 4.29 0.00 2.23 1.99 0.00 3.88 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 11 V 8.50 4.28 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 0.83 0.00 0.00 0.96 0.00 0.00 12 L 8.84 4.20 0.00 1.68 1.70 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.16 4.00 0.00 4.05 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 14 P 0.00 4.50 0.00 1.92 2.04 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 15 S 8.52 3.78 0.00 3.68 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 16 G 7.57 4.49 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 0.00 17 R 8.44 4.61 0.00 1.68 2.02 0.00 3.21 0.00 0.00 3.16 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 18 R 8.07 4.38 0.00 1.57 1.43 0.00 2.93 0.00 0.00 2.66 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 19 E 8.10 5.14 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 20 L 9.22 4.25 0.00 1.81 1.90 1.16 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.60 3.98 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 22 A 8.45 4.50 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 23 D 7.96 4.55 0.00 3.09 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.14 5.00 0.00 1.78 1.76 1.02 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.62 0.00 2.21 2.15 0.00 3.83 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 2.03 2.01 0.00 26 A 8.02 4.11 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 27 E 7.58 4.71 0.00 1.93 1.84 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 2.12 2.19 0.00 28 I 8.52 4.35 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.93 0.96 0.00 0.00 29 N 8.56 4.66 0.00 2.82 2.82 0.00 0.00 7.17 7.71 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 30 P 0.00 4.18 0.00 2.10 2.15 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.22 0.00 31 H 8.68 4.09 0.00 3.27 3.59 0.00 5.90 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 32 L 9.28 3.80 0.00 1.86 1.87 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.01 4.02 0.00 2.11 1.85 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 34 W 8.49 4.31 0.00 3.41 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.56 3.14 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 36 V 7.52 3.62 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 1.04 0.00 0.00 1.03 0.00 0.00 37 V 7.87 3.95 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 0.87 0.00 0.00 1.17 0.00 0.00 38 R 8.39 3.67 0.00 0.94 1.64 0.00 2.87 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.30 0.00 39 W 7.95 3.83 0.00 3.20 3.28 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 40 Q 8.31 3.04 0.00 1.93 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.53 0.00 0.00 0.00 0.00 0.00 1.89 2.61 0.00 41 L 7.97 3.68 0.00 1.53 1.50 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.46 4.11 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 43 K 8.18 3.92 0.00 1.70 1.67 0.00 0.92 0.00 0.00 0.74 0.00 0.00 2.13 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.75 1.05 7.81 44 R 7.27 4.28 0.00 1.87 1.83 0.00 2.91 0.00 0.00 2.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 45 R 7.30 4.40 0.00 1.83 1.75 0.00 2.84 0.00 0.00 2.62 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.66 0.00 46 R 8.65 3.81 0.00 1.72 1.94 0.00 3.39 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 47 G 8.41 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 48 T 7.58 4.48 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 49 A 8.24 4.49 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 50 S 8.45 4.83 0.00 3.85 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.51 4.49 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 1.23 0.00 0.00 52 K 8.19 4.80 0.00 1.68 1.70 0.00 1.61 0.00 0.00 1.90 0.00 0.00 2.70 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.37 7.81 53 T 8.85 4.46 4.35 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 1.30 0.00 0.00 54 R 8.59 3.78 0.00 2.09 2.06 0.00 3.07 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 55 G 7.98 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 56 E 8.75 4.59 0.00 2.03 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 2.21 2.19 0.00 57 V 7.40 3.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.92 0.00 0.00 58 A 7.92 4.08 1.10 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 0.00 0.00 59 Y 7.06 4.77 0.00 2.98 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.22 4.70 0.00 3.82 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.81 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 0.00 0.00 0.00 62 R 7.29 3.53 0.00 1.84 1.77 0.00 3.08 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 63 K 8.91 4.92 0.00 1.80 1.73 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.67 1.52 7.81 64 I 6.87 3.16 1.42 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.02 0.77 0.00 0.00 65 W 7.77 5.36 0.00 3.55 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 66 P 0.00 4.33 0.00 2.23 2.14 0.00 3.96 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 67 Q 8.50 3.75 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 68 K 9.05 4.16 0.00 1.64 1.37 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.56 7.81 69 H 9.13 4.67 0.00 3.14 3.25 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.73 3.96 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 0.51 0.00 0.00 71 G 8.15 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 72 R 6.90 3.93 0.00 0.67 0.94 0.00 3.11 0.00 0.00 3.02 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 73 A 7.86 4.22 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 74 R 8.17 4.16 0.00 1.96 1.97 0.00 3.07 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 75 H 8.59 4.85 0.00 3.40 3.31 0.00 5.68 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 9.21 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 0.00 0.00 0.00 77 D 9.42 5.65 0.00 2.80 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 78 I 8.09 2.73 0.92 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.07 -0.47 0.00 0.00 79 G 7.94 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 0.00 0.00 0.00 80 A 7.84 4.36 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 4.67 0.00 2.20 2.33 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 2.08 1.92 0.00 82 I 7.78 3.65 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.34 0.89 0.00 0.00 83 F 8.55 4.70 0.00 3.32 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 84 V 8.31 3.14 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 0.86 0.00 0.00 1.00 0.00 0.00 85 G 9.39 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 0.00 0.00 0.00 86 G 7.29 4.35 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 0.00 87 G 8.69 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 0.00 0.00 0.00 88 V 8.01 4.60 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 0.76 0.00 0.00 0.94 0.00 0.00 89 V 8.12 4.26 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 0.18 0.00 0.00 0.80 0.00 0.00 90 F 8.42 5.12 0.00 3.14 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 91 G 9.15 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 0.00 0.00 0.00 92 P 0.00 4.42 0.00 2.29 2.26 0.00 3.68 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 2.11 2.04 0.00 93 K 8.13 5.14 0.00 1.61 1.73 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.35 7.81 94 P 0.00 4.58 0.00 2.08 2.07 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 95 R 8.12 4.53 0.00 1.66 1.90 0.00 2.34 0.00 0.00 2.87 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.91 0.00 96 D 8.48 4.75 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.73 4.47 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 7.97 4.83 0.00 3.96 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 99 Y 7.88 4.95 0.00 3.08 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 0.00 100 T 8.34 4.43 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 1.18 0.00 0.00 101 L 7.30 3.90 0.00 0.30 0.35 1.10 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.15 0.00 2.12 1.92 0.00 3.53 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 103 K 8.54 3.86 0.00 1.74 1.77 0.00 1.62 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.36 7.81 104 K 7.98 4.22 0.00 1.77 1.79 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.38 7.81 105 V 7.49 4.32 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 0.94 0.00 0.00 0.87 0.00 0.00 106 R 7.71 3.98 0.00 1.79 1.83 0.00 2.54 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 107 K 7.96 4.24 0.00 1.69 1.65 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.37 7.81 108 K 7.88 4.78 0.00 1.89 1.78 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.65 7.81 109 G 7.71 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 0.00 110 L 9.40 4.09 0.00 1.94 1.81 1.14 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.02 4.25 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 0.00 112 M 7.98 4.44 0.00 2.11 2.35 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.79 0.00 113 A 8.26 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.49 3.50 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 0.60 0.00 0.00 0.53 0.00 0.00 115 A 9.87 4.44 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.67 4.36 0.00 2.81 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 0.00 117 R 8.01 3.85 0.00 2.01 2.13 0.00 3.41 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 118 A 8.07 4.17 1.47 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 0.00 0.00 119 R 8.12 3.83 0.00 1.85 2.25 0.00 3.28 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 120 E 7.83 4.09 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 121 G 8.85 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 K 7.98 4.13 0.00 1.73 1.97 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.53 7.81 123 L 7.94 4.89 0.00 1.70 1.62 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.97 4.80 0.00 1.81 1.62 0.96 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.51 5.70 0.00 1.68 1.75 0.39 0.85 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 0.00 126 V 8.10 4.25 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 0.84 0.00 0.00 0.68 0.00 0.00 127 E 8.34 4.74 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 128 A 7.90 4.48 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 0.00 129 F 8.22 4.28 0.00 2.88 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 0.00 130 A 8.51 4.22 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.99 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 0.00 132 V 9.18 4.14 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 0.69 0.00 0.00 0.90 0.00 0.00 133 N 8.37 3.94 0.00 2.91 2.96 0.00 0.00 7.03 7.65 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 0.00 134 G 7.72 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.44 4.43 0.00 1.99 1.70 0.00 1.66 0.00 0.00 1.83 0.00 0.00 3.28 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.61 7.81 136 T 8.68 4.14 4.30 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 1.31 0.00 0.00 137 K 8.20 3.93 0.00 1.85 1.95 0.00 1.72 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.61 7.81 138 E 8.38 3.96 0.00 2.26 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 2.46 2.44 0.00 139 F 8.26 4.35 0.00 3.07 3.31 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 0.00 140 L 8.86 4.07 0.00 2.01 1.94 1.26 1.17 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 0.00 141 A 8.70 3.97 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 0.00 142 W 8.75 4.28 0.00 3.55 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.96 3.67 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 0.00 144 K 8.05 3.67 0.00 1.80 1.99 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.45 7.81 145 E 7.45 4.15 0.00 1.69 1.61 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 2.17 2.30 0.00 146 A 7.95 4.28 0.78 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 0.00 0.00 147 G 7.86 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 0.00 148 L 7.31 4.51 0.00 1.78 2.12 1.12 1.31 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 0.00 149 D 7.73 4.20 0.00 2.57 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 0.00 150 G 7.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 S 7.73 4.39 0.00 3.87 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 0.00 152 E 7.93 4.71 0.00 1.98 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 2.22 2.25 0.00 153 S 8.70 4.61 0.00 4.01 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 0.00 154 V 9.79 5.34 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 1.24 0.00 0.00 1.30 0.00 0.00 155 L 8.49 4.57 0.00 1.80 1.53 0.96 0.45 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 0.00 156 L 8.88 5.18 0.00 1.73 1.37 1.07 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.45 5.36 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 1.03 0.00 0.00 158 T 8.34 4.53 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 159 G 8.78 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 0.00 160 N 7.77 4.68 0.00 2.65 2.39 0.00 0.00 7.18 7.25 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 0.00 161 E 8.43 4.23 0.00 1.92 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 2.20 2.25 0.00 162 L 7.50 4.47 0.00 1.76 1.49 0.85 0.80 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 0.00 163 V 7.40 3.41 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 0.13 0.00 0.00 -0.15 0.00 0.00 164 R 7.14 3.63 0.00 1.85 1.72 0.00 3.27 0.00 0.00 3.06 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 165 R 7.76 3.90 0.00 1.71 1.92 0.00 3.20 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 166 A 8.20 3.92 1.10 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 0.00 0.00 167 A 8.01 3.89 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 R 8.19 3.75 0.00 2.03 1.77 0.00 3.04 0.00 0.00 3.16 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 169 N 7.98 4.45 0.00 2.63 2.78 0.00 0.00 6.86 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.07 4.62 0.00 1.32 1.02 1.06 0.91 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 0.00 171 P 0.00 4.60 0.00 2.32 2.25 0.00 3.83 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 2.33 2.10 0.00 172 W 7.77 5.21 0.00 3.50 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 0.00 173 V 7.51 4.67 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 -0.10 0.00 0.00 174 V 8.96 4.08 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 0.86 0.00 0.00 0.93 0.00 0.00 175 T 8.05 4.06 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 1.12 0.00 0.00 176 L 8.11 4.29 0.00 1.73 1.59 0.93 0.83 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 0.00 177 A 8.68 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 0.00 178 P 0.00 4.60 0.00 2.22 2.20 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 179 E 8.26 4.18 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 180 G 8.05 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 0.00 181 L 8.14 4.27 0.00 1.73 1.70 0.89 1.04 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 0.00 182 N 8.02 4.96 0.00 3.07 3.03 0.00 0.00 6.10 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 0.00 183 V 8.67 3.77 2.19 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 0.90 0.00 0.00 1.11 0.00 0.00 184 Y 7.99 4.38 0.00 3.31 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 0.00 185 D 10.61 4.10 0.00 2.92 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 0.00 186 I 7.55 3.71 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.61 0.93 0.00 0.00 187 V 7.33 3.88 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 0.91 0.00 0.00 1.07 0.00 0.00 188 R 7.89 3.92 0.00 1.76 1.58 0.00 2.21 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.49 0.00 189 T 6.62 4.58 4.44 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 1.23 0.00 0.00 190 E 8.50 4.29 0.00 1.97 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 2.34 2.29 0.00 191 R 7.99 4.86 0.00 2.02 1.82 0.00 3.47 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 192 L 8.69 5.08 0.00 1.79 1.52 0.89 0.76 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 0.00 193 V 8.95 5.05 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.11 0.00 0.00 194 M 9.55 5.38 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 195 D 8.57 5.01 0.00 3.01 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 0.00 196 L 10.82 4.76 0.00 1.79 1.72 1.06 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 197 D 8.57 4.44 0.00 2.76 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 0.00 198 A 8.24 4.31 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 0.00 199 W 8.13 4.05 0.00 3.54 3.43 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 0.00 200 E 8.87 4.43 0.00 2.36 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 0.00 2.42 2.43 0.00 201 V 8.45 3.71 2.24 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 0.87 0.00 0.00 0.95 0.00 0.00 202 F 7.62 4.16 0.00 2.84 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 0.00 203 Q 7.79 3.74 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.79 0.00 204 N 7.64 4.59 0.00 2.80 2.80 0.00 0.00 6.78 7.66 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 0.00 205 R 7.12 4.13 0.00 1.73 1.87 0.00 3.25 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 1.56 1.62 0.00 206 I 7.98 4.44 1.45 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.20 0.71 0.00 0.00 207 G 8.63 4.86 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 *208 G 7.56 3.71 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.