NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4675 8.3349 115.2954 58.2665 63.4231 173.7516 3 V 3.6041 8.4470 120.2703 62.3956 31.9391 174.6803 4 I 4.0617 8.1159 121.8565 60.0909 36.8337 175.1460 5 K 4.7336 8.1635 124.9783 53.9019 34.3507 175.9924 6 P 4.8724 0.0000 0.0000 65.3511 31.4670 176.1282 7 D 5.5142 7.6768 117.4759 52.7863 43.4326 175.6544 8 M 5.0163 9.2148 121.9045 53.6906 37.0205 174.6959 9 K 5.0831 8.9636 120.3154 55.3377 35.4033 175.5689 10 I 5.0846 8.6994 121.4639 59.6952 41.6297 174.6817 11 K 5.0726 8.8302 126.9393 54.6954 35.6479 174.8662 12 L 5.2221 8.6940 125.9480 54.8098 44.7725 174.5531 13 R 5.0307 8.7991 119.7539 55.1969 33.7957 173.0879 14 M 5.3113 9.8426 126.6623 53.8361 35.0636 174.0304 15 E 4.8239 8.4510 125.1011 54.9023 33.3601 175.8775 16 G 4.1360 7.8368 107.7967 47.1381 0.0000 171.6535 17 A 5.5582 8.5768 119.6638 51.1827 23.4503 176.4786 18 V 4.6653 8.5568 119.7388 62.1508 33.8244 175.5734 19 N 4.3112 10.3492 125.4504 54.4582 36.5434 175.4545 20 G 3.8246 8.6584 103.8752 45.7361 0.0000 173.5982 21 H 4.8787 8.0949 118.1203 52.9636 29.6218 172.4170 22 P 5.2464 0.0000 0.0000 63.3026 32.2708 175.2895 23 F 5.0496 8.6155 114.4644 56.6269 41.8226 172.4301 24 A 5.1670 9.0113 120.2199 50.8109 22.8674 175.3833 25 I 5.2265 9.1691 120.7352 59.9028 42.2143 174.2256 26 E 5.2686 9.3825 124.2572 54.8750 33.7590 175.0216 27 G 4.4441 8.9437 107.5007 45.2470 0.0000 172.0912 28 V 4.9805 8.5257 113.1008 59.8737 36.2770 175.2307 29 G 4.3073 9.0139 111.5106 46.0005 0.0000 171.1887 30 L 5.1771 8.5694 118.2131 55.0900 44.2906 174.7610 31 G 4.0943 9.1884 106.7456 45.9148 0.0000 172.4134 32 K 5.5707 9.3739 120.1357 52.9823 32.6592 175.5674 33 P 4.1067 0.0000 0.0000 65.6385 31.3775 178.9402 34 F 4.4275 8.0147 113.4879 59.2863 39.0737 175.8287 35 E 4.4859 8.3514 118.8051 55.3521 30.3533 175.8654 36 G 4.0720 7.9440 107.6299 46.6475 0.0000 173.3316 37 K 5.4780 8.1680 116.6931 53.4114 36.7939 175.9299 38 Q 4.8798 8.3787 119.8406 55.5526 32.1164 172.9664 39 S 5.1212 8.5708 113.5801 57.8861 66.7483 172.9026 40 M 5.1014 9.0717 118.0247 54.5321 35.2478 172.8552 41 D 5.3907 9.0551 120.0199 52.6303 43.7296 175.2353 42 L 5.0998 9.1154 123.8762 52.8232 44.7309 175.6946 43 K 5.1404 9.0741 122.2474 54.3429 35.6789 175.7810 44 V 4.1330 8.6649 126.2257 63.2994 31.3183 175.6409 45 K 4.5616 9.3513 127.4679 57.4421 33.9408 176.5742 46 E 4.6602 7.9205 117.3264 55.6388 34.1145 176.8309 47 G 4.1508 9.2559 109.8904 45.7261 0.0000 174.0708 48 G 3.8881 7.7597 108.0359 43.8889 0.0000 171.8934 49 P 4.4184 0.0000 0.0000 61.4427 32.2158 176.3122 50 L 3.5772 8.4204 122.6656 54.8016 41.6625 175.2805 51 P 4.4625 0.0000 0.0000 62.7220 31.9214 175.3132 52 F 4.8986 6.4151 112.8207 54.2118 41.0104 174.5587 53 A 3.7539 8.4126 124.7830 52.4742 18.4164 178.2689 54 Y 3.8364 8.2070 124.2566 60.8957 38.7351 177.8145 55 D 4.6268 8.2464 119.6123 57.2240 40.6239 178.2489 56 I 4.4502 7.6977 111.9229 63.0121 37.9100 177.2299 57 L 3.9835 8.1065 121.2786 56.1044 41.7775 178.4249 58 T 4.2879 7.7592 109.2167 65.2320 68.5272 175.7758 59 T 4.2118 8.0515 108.7845 62.3746 69.2192 175.0820 60 V 4.1870 7.7659 122.3100 65.2733 32.4899 176.7981 61 F 4.7534 7.3832 119.5154 56.5571 37.0982 175.3255 *65 N 4.5633 7.6875 118.5810 53.3110 39.1669 174.2734 66 R 3.9184 8.2228 125.3969 56.9917 29.9661 177.8708 67 V 3.6123 7.4288 116.3743 64.9600 31.9835 177.0078 68 F 4.5385 7.5830 121.2989 55.3026 37.2186 174.5386 69 A 4.8140 7.3076 121.5151 50.2720 22.8683 176.9206 70 K 4.2425 9.2914 124.8173 56.5776 32.9535 175.0744 71 Y 4.8096 8.6095 126.2167 55.5156 39.3057 174.5474 72 P 4.5827 0.0000 0.0000 62.2600 32.3117 177.1861 73 E 4.0682 8.7847 119.0548 59.3613 29.4286 177.8872 74 N 4.7295 8.1530 113.5643 52.9457 37.8434 174.5329 75 I 4.5222 7.4948 120.1578 59.2030 39.8769 175.5345 76 V 3.4923 8.4590 125.3091 63.0586 31.4435 175.1058 77 D 3.7771 8.2887 127.2914 52.3633 40.1745 175.6739 78 Y 3.7090 7.7743 127.9739 60.2581 39.2746 177.7229 79 F 3.8388 7.3942 117.9914 60.3359 39.4700 177.8389 80 K 4.1810 8.2640 119.8948 59.3223 32.1235 179.5696 81 Q 4.0741 7.5179 117.2937 58.7603 28.7903 178.0897 82 S 3.9066 7.4678 112.5769 60.5699 63.0727 174.5797 83 F 4.9194 7.4449 118.0213 55.6241 39.6267 174.1204 84 P 4.7268 0.0000 0.0000 65.4652 31.4798 177.5926 85 E 3.9172 8.2168 118.5432 57.8325 29.7333 177.3815 86 G 2.9563 9.7223 104.6556 45.7262 0.0000 170.7578 87 Y 5.3452 7.5862 115.1025 56.2738 41.5525 173.2462 88 S 5.0945 9.2174 113.7095 56.4298 67.1785 172.7796 89 W 5.8788 8.5654 116.2479 55.2658 31.8039 173.5903 90 E 5.3438 9.1943 119.7238 55.0956 33.3172 174.8431 91 R 4.9952 8.8939 120.9769 55.3438 34.4433 173.4282 92 S 4.9986 8.6982 119.5231 56.6337 65.7551 172.4580 93 M 4.6131 9.1999 126.4468 53.6700 34.7003 174.4506 94 N 4.9546 8.9295 124.8313 52.1079 40.2204 173.5964 95 Y 4.6327 9.0039 125.3953 57.1621 38.9142 177.2241 96 E 4.0230 8.9909 121.4423 58.8255 29.7454 177.4854 97 D 4.7973 8.5102 117.6664 53.1173 39.6585 177.1882 98 G 3.9953 8.4642 109.6507 45.2204 0.0000 174.7061 99 G 3.0336 7.9277 107.1974 46.0751 0.0000 172.9244 100 I 5.1406 8.1309 124.2281 59.4799 41.2527 174.0670 101 C 5.0296 9.2068 124.5224 57.8951 31.2422 172.5952 102 N 5.3401 8.8180 121.1396 51.4803 40.9355 173.7825 103 A 5.2194 8.9958 124.0940 50.7449 23.4466 174.9493 104 T 4.6227 8.4664 108.7542 60.0673 73.0958 172.5951 105 N 4.7294 7.6941 121.0120 52.1532 42.7124 172.3342 106 D 4.8118 8.6548 126.6647 52.7165 42.8380 174.7306 107 I 5.1516 8.3034 128.0876 59.9973 39.4411 175.2326 108 T 4.8459 9.1091 116.7485 59.6815 72.7146 172.3391 109 L 5.1911 8.5909 122.3180 53.4103 45.1062 175.0731 110 D 4.7562 9.0688 126.1619 52.9062 43.4867 177.6629 111 G 3.9011 8.8123 120.5258 46.8657 0.0000 172.4840 112 D 4.7767 9.0093 122.1769 52.6227 41.2002 174.1532 113 C 5.1374 7.9684 120.1734 58.1099 34.2094 172.6559 114 Y 4.8342 8.8420 124.9705 58.0135 39.1089 174.5929 115 I 4.9318 9.2084 124.7235 59.7826 40.2168 174.0041 116 Y 5.3817 9.0312 124.9809 56.2549 40.9047 174.3747 117 E 4.7604 8.9212 125.0569 54.7845 31.7345 174.3626 118 I 4.9621 8.5512 128.2553 59.4079 40.5864 174.9176 119 R 5.1036 8.4652 125.3577 54.5011 33.4257 173.7793 120 F 5.1761 8.9794 127.4808 56.5805 43.0481 173.1498 121 D 5.0640 8.8271 125.7630 52.9229 44.7885 174.4529 122 G 4.5233 9.2492 111.6338 44.5300 0.0000 172.0128 123 V 4.8154 8.0946 115.3208 59.6600 36.8686 174.9249 124 N 4.2951 8.6760 115.8509 54.3681 35.8061 174.4634 125 F 4.5075 8.1795 117.5240 56.0354 39.6626 174.2914 126 P 4.3542 0.0000 0.0000 62.4427 31.7474 177.4270 127 A 4.0222 8.7626 125.3395 54.6804 18.4556 177.9492 128 N 4.7532 8.0835 110.7870 52.7183 37.8874 175.7359 129 G 3.8661 7.8657 107.0421 43.4811 0.0000 173.1624 130 P 4.0549 0.0000 0.0000 65.5005 30.8296 179.0282 131 V 3.2501 7.1697 117.5549 66.1797 31.3874 177.7460 132 M 4.1124 7.7427 115.7515 57.3218 32.0697 177.5069 133 Q 4.2201 7.9287 116.2430 54.3863 30.4796 175.2903 134 K 3.6477 7.5359 118.4411 58.0130 29.3480 175.1606 135 R 4.8823 8.5455 114.7478 55.3146 31.9308 178.1683 136 T 4.4050 7.6736 109.6294 61.9014 69.5440 174.0075 137 V 4.2843 8.1007 122.7884 63.4268 33.2116 175.4710 138 K 4.3346 7.2062 116.7491 56.1723 36.1509 173.4037 139 W 5.1536 8.8980 120.5750 56.0687 30.1112 176.6362 140 E 4.4906 9.1862 123.5818 55.2438 30.0463 174.9064 141 P 4.7171 0.0000 0.0000 63.2407 32.5137 175.3363 142 S 4.6672 9.0367 115.4839 57.6243 67.3388 172.8958 143 T 5.0127 8.1892 115.3772 61.7615 71.0790 173.6035 144 E 4.4472 9.4316 129.1300 55.5785 31.4500 175.2060 145 K 4.4922 9.1701 126.4611 54.8065 34.3825 175.1250 146 L 5.1695 8.1637 125.9856 53.0083 44.4788 175.2964 147 Y 5.0567 8.0505 120.0340 55.6068 41.8292 174.0723 148 V 4.3603 8.3703 120.4246 62.3769 33.3298 175.6273 149 R 4.4314 8.9325 126.4353 56.3795 33.0260 174.7684 150 D 4.1692 9.7896 126.5980 55.5758 38.3026 174.9048 151 G 3.9348 8.4453 104.9079 45.6181 0.0000 173.3184 152 V 4.4938 7.4663 112.2141 59.2689 36.1244 173.8176 153 L 4.5222 7.8794 122.9897 53.4801 43.8187 175.3010 154 K 4.8637 8.7053 125.2791 54.5902 35.6985 175.6153 155 G 4.6406 8.6800 109.4364 44.3698 0.0000 171.2309 156 D 5.8207 9.3196 125.9705 52.5952 44.5648 175.7011 157 V 4.5222 8.3781 120.1759 60.4306 35.3160 173.2935 158 N 4.8387 8.6795 121.2330 52.7556 39.2270 174.3131 159 M 4.6830 8.6713 123.8189 53.5744 35.4827 175.1794 160 A 5.2442 8.5399 121.4490 50.7354 23.1643 174.8099 161 L 4.9632 9.1338 123.3149 52.8689 43.8652 176.4788 162 S 4.5323 8.8520 119.1930 58.2426 64.5672 173.1402 163 L 5.0299 8.3463 121.7356 52.9282 44.2455 177.5860 164 E 3.8501 9.1803 122.5281 59.6711 29.5707 179.1711 165 G 3.8129 7.9449 104.3791 45.5402 0.0000 174.4273 166 G 3.8616 7.8333 104.9891 46.5276 0.0000 174.8416 167 G 3.8779 8.6290 107.3025 44.7008 0.0000 171.6587 168 H 5.4768 8.4147 113.7600 54.0804 33.2007 172.8658 169 Y 5.0619 9.1021 121.2222 56.2214 41.0868 174.9164 170 R 4.9156 9.7658 126.6567 55.9648 32.3187 175.3228 171 C 4.8682 8.8172 120.7770 58.2677 35.7009 172.1329 172 D 5.2456 8.9359 125.5272 52.7626 43.0056 175.2593 173 F 5.1981 9.0138 122.7763 56.1544 41.5263 175.4225 174 K 4.9036 8.6243 121.2240 54.2618 35.6194 175.3344 175 T 4.8803 8.9301 122.4571 61.7808 71.9971 173.7111 176 T 4.7296 8.5314 120.8984 61.9473 72.0133 172.4179 177 Y 5.5397 9.3031 124.3691 56.3035 41.0371 175.0442 178 K 4.9659 9.7233 122.9130 54.4290 35.5488 175.8774 179 A 4.4274 9.3224 128.0251 51.6371 18.9849 177.2057 180 K 4.3401 8.5920 119.5762 56.0651 32.2238 176.8802 181 K 4.4412 7.1555 116.6199 55.3322 34.9190 175.4234 182 V 3.6598 8.1734 120.2503 63.1418 31.7829 175.6722 183 V 4.4900 7.8238 118.9923 59.1268 35.5839 175.1657 184 Q 4.1173 8.2774 121.0806 56.0257 29.0398 176.4063 185 L 4.4800 8.2772 122.5143 53.1707 42.8659 175.0101 186 P 4.5656 0.0000 0.0000 62.0039 32.5643 175.2030 187 D 4.7122 8.1729 119.3087 52.9512 42.0849 175.6578 188 Y 4.2807 8.3941 121.5871 59.0995 39.1432 174.9408 189 H 4.3768 7.9053 120.5395 54.8654 32.6542 171.8428 190 F 5.2817 8.7581 115.5958 55.7857 43.5233 174.9309 191 V 4.6346 8.5108 119.7057 61.3626 34.5084 174.2725 192 D 5.1288 9.1629 129.0665 54.5185 42.1701 175.4559 193 H 5.4655 9.3731 118.8552 54.6301 33.6900 172.6734 194 H 4.9504 9.0127 120.8498 55.6301 32.4249 171.6722 195 I 5.0022 8.5465 126.4125 59.5519 40.0197 174.5462 196 E 4.8570 9.3147 127.4656 55.0726 34.4194 174.3663 197 I 4.5344 8.5270 125.1437 60.6619 37.1350 175.9140 198 K 4.3232 8.8637 128.5152 58.9874 32.7417 177.4943 199 S 4.6753 7.4301 112.4022 57.8047 66.1052 173.1984 200 H 5.3579 8.1460 113.5168 55.7263 30.5506 173.2674 201 D 4.4671 7.9091 120.1568 51.8921 41.6094 176.9830 202 K 3.7902 8.5196 119.5989 59.5358 31.3203 176.8127 203 D 4.8710 8.0294 115.6209 52.8306 39.5277 175.9830 204 Y 3.4209 7.7433 114.5016 59.5960 36.0947 171.5396 205 S 4.4094 7.8464 119.4416 60.8885 64.2731 174.1741 206 N 5.5501 9.1318 117.5481 51.2882 42.0688 174.0890 207 V 4.6966 8.6637 122.6149 61.1565 35.6664 173.1420 208 N 5.3069 9.2237 126.9848 51.9597 40.7231 173.0009 209 L 5.4240 9.1976 128.6794 53.6683 45.2348 174.7643 210 H 5.5267 9.4566 122.3114 54.1733 33.1041 172.1599 211 E 5.2058 8.9966 120.8592 54.9804 33.8611 173.2997 212 H 5.5144 9.4609 126.1436 54.4535 32.5187 172.3535 213 A 5.6755 9.3963 127.1990 49.6390 22.8431 174.4795 214 E 4.9746 8.5468 119.8114 54.6710 34.0668 174.3850 215 A 5.0352 8.6050 126.3082 51.0296 20.8531 176.0136 216 H 5.0893 8.7364 114.8857 54.3828 32.2387 174.2082 217 S 4.8585 8.9721 112.8828 58.4374 63.9090 173.8113 218 E 4.9278 8.0404 119.5031 54.9423 33.2234 174.0803 219 L 4.7426 9.4983 122.8412 52.3543 45.7765 175.6467 220 P 4.5540 0.0000 0.0000 62.5276 31.4659 172.8153 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 2 S 8.33 4.47 0.00 3.90 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.45 3.60 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 0.78 0.00 0.00 1.06 0.00 0.00 4 I 8.12 4.06 1.98 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 1.35 0.77 0.57 0.00 0.00 5 K 8.16 4.73 0.00 1.94 1.76 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.38 7.81 6 P 0.00 4.87 0.00 2.26 2.22 0.00 3.61 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 2.15 2.17 0.00 7 D 7.68 5.51 0.00 2.75 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 8 M 9.21 5.02 0.00 1.89 2.10 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.42 0.00 9 K 8.96 5.08 0.00 1.61 1.71 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.53 7.81 10 I 8.70 5.08 1.89 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.00 0.52 0.00 0.00 11 K 8.83 5.07 0.00 1.72 1.53 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.33 7.81 12 L 8.69 5.22 0.00 2.04 1.61 1.10 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.80 5.03 0.00 1.85 1.80 0.00 3.19 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 14 M 9.84 5.31 0.00 2.40 2.11 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 15 E 8.45 4.82 0.00 1.87 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 0.00 2.16 2.19 0.00 16 G 7.84 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.58 5.56 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 18 V 8.56 4.67 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 0.86 0.00 0.00 0.11 0.00 0.00 19 N 10.35 4.31 0.00 2.96 2.96 0.00 0.00 7.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.66 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 21 H 8.09 4.88 0.00 3.49 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 5.25 0.00 2.13 2.11 0.00 3.94 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 23 F 8.62 5.05 0.00 3.45 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 24 A 9.01 5.17 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 25 I 9.17 5.23 2.27 0.00 0.00 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 1.50 1.33 1.04 0.00 0.00 26 E 9.38 5.27 0.00 1.89 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 2.37 2.27 0.00 27 G 8.94 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 0.00 0.00 0.00 0.00 28 V 8.53 4.98 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 0.70 0.00 0.00 0.96 0.00 0.00 29 G 9.01 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 30 L 8.57 5.18 0.00 1.76 1.73 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 31 G 9.19 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 32 K 9.37 5.57 0.00 1.77 1.89 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.70 1.30 7.81 33 P 0.00 4.11 0.00 1.58 1.64 0.00 3.93 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.90 0.00 34 F 8.01 4.43 0.00 3.11 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.35 4.49 0.00 2.16 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 2.41 2.47 0.00 36 G 7.94 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 37 K 8.17 5.48 0.00 1.71 1.65 0.00 1.96 0.00 0.00 1.79 0.00 0.00 2.60 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.48 7.81 38 Q 8.38 4.88 0.00 1.41 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 39 S 8.57 5.12 0.00 3.43 3.45 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 40 M 9.07 5.10 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 41 D 9.06 5.39 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 9.12 5.10 0.00 1.50 1.41 0.71 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 43 K 9.07 5.14 0.00 1.62 1.68 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.33 7.81 44 V 8.66 4.13 2.17 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 0.92 0.00 0.00 1.13 0.00 0.00 45 K 9.35 4.56 0.00 1.67 1.87 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.58 7.81 46 E 7.92 4.66 0.00 2.02 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 2.33 2.35 0.00 47 G 9.26 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 G 7.76 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 49 P 0.00 4.42 0.00 2.16 2.06 0.00 3.78 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 1.95 1.96 0.00 50 L 8.42 3.58 0.00 1.17 0.37 0.67 0.84 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 51 P 0.00 4.46 0.00 2.16 2.09 0.00 3.43 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 2.09 1.97 0.00 52 F 6.42 4.90 0.00 2.81 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.41 3.75 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.21 3.84 0.00 2.40 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 55 D 8.25 4.63 0.00 2.58 2.40 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 56 I 7.70 4.45 2.22 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.41 0.76 0.00 0.00 57 L 8.11 3.98 0.00 1.42 1.10 0.39 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.76 4.29 4.60 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 1.68 0.00 0.00 59 T 8.05 4.21 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 0.83 0.00 0.00 60 V 7.77 4.19 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 0.91 0.00 0.00 1.23 0.00 0.00 61 F 7.38 4.75 0.00 3.46 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *65 N 7.69 4.56 0.00 2.77 3.16 0.00 0.00 6.69 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 66 R 8.22 3.92 0.00 0.79 0.66 0.00 3.25 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.16 0.00 67 V 7.43 3.61 1.96 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 -0.41 0.00 0.00 0.59 0.00 0.00 68 F 7.58 4.54 0.00 3.25 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 69 A 7.31 4.81 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 70 K 9.29 4.24 0.00 1.99 1.79 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.75 7.81 71 Y 8.61 4.81 0.00 3.00 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 72 P 0.00 4.58 0.00 2.45 2.22 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.01 0.00 73 E 8.78 4.07 0.00 2.02 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 2.36 2.28 0.00 74 N 8.15 4.73 0.00 2.86 2.96 0.00 0.00 5.82 7.81 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 75 I 7.49 4.52 2.07 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.73 0.91 0.00 0.00 76 V 8.46 3.49 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.93 0.00 0.00 77 D 8.29 3.78 0.00 2.44 2.35 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 78 Y 7.77 3.71 0.00 2.42 1.79 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 79 F 7.39 3.84 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.26 4.18 0.00 1.77 1.84 0.00 1.69 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.28 1.37 7.81 81 Q 7.52 4.07 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 82 S 7.47 3.91 0.00 3.77 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 83 F 7.44 4.92 0.00 3.18 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 84 P 0.00 4.73 0.00 2.26 2.28 0.00 3.82 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 2.03 2.03 0.00 85 E 8.22 3.92 0.00 2.04 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 2.29 2.37 0.00 86 G 9.72 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 0.00 0.00 0.00 87 Y 7.59 5.35 0.00 3.16 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 88 S 9.22 5.09 0.00 3.81 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 89 W 8.57 5.88 0.00 3.25 3.40 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 90 E 9.19 5.34 0.00 1.91 1.82 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 2.17 2.21 0.00 91 R 8.89 5.00 0.00 1.72 1.84 0.00 2.51 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.36 0.00 92 S 8.70 5.00 0.00 3.84 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 93 M 9.20 4.61 0.00 1.67 1.85 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 1.83 0.81 0.00 94 N 8.93 4.95 0.00 2.79 2.68 0.00 0.00 6.84 8.36 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 95 Y 9.00 4.63 0.00 3.29 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 96 E 8.99 4.02 0.00 2.13 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 0.00 2.52 2.48 0.00 97 D 8.51 4.80 0.00 2.94 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.46 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 0.00 0.00 0.00 99 G 7.93 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.13 5.14 1.75 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 1.31 0.92 0.88 0.00 0.00 101 C 9.21 5.03 0.00 2.86 2.23 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 0.00 102 N 8.82 5.34 0.00 2.46 2.57 0.00 0.00 6.26 7.39 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 0.00 103 A 9.00 5.22 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 0.00 104 T 8.47 4.62 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 1.09 0.00 0.00 105 N 7.69 4.73 0.00 1.44 1.42 0.00 0.00 6.93 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.65 4.81 0.00 2.64 2.43 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 0.00 107 I 8.30 5.15 1.69 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.50 1.36 0.00 0.00 108 T 9.11 4.85 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 1.30 0.00 0.00 109 L 8.59 5.19 0.00 1.96 1.94 0.38 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.07 4.76 0.00 2.71 2.50 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 0.00 111 G 8.81 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 9.01 4.78 0.00 2.62 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 0.00 113 C 7.97 5.14 0.00 2.95 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 0.00 114 Y 8.84 4.83 0.00 3.16 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 0.00 115 I 9.21 4.93 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.03 0.96 0.00 0.00 116 Y 9.03 5.38 0.00 2.89 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 0.00 117 E 8.92 4.76 0.00 2.06 1.77 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 2.17 2.25 0.00 118 I 8.55 4.96 2.07 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.65 0.92 0.00 0.00 119 R 8.47 5.10 0.00 1.83 1.61 0.00 3.17 0.00 0.00 3.04 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 120 F 8.98 5.18 0.00 3.14 2.80 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 0.00 121 D 8.83 5.06 0.00 2.50 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 0.00 0.00 0.00 0.00 122 G 9.25 4.52 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 0.00 123 V 8.09 4.82 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 0.71 0.00 0.00 0.88 0.00 0.00 124 N 8.68 4.30 0.00 2.73 2.84 0.00 0.00 6.97 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 0.00 125 F 8.18 4.51 0.00 3.25 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 0.00 126 P 0.00 4.35 0.00 2.22 2.01 0.00 3.86 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.15 0.00 127 A 8.76 4.02 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 0.00 128 N 8.08 4.75 0.00 2.81 2.90 0.00 0.00 5.99 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.87 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 0.00 130 P 0.00 4.05 0.00 1.82 2.00 0.00 3.34 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.94 0.00 131 V 7.17 3.25 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 0.16 0.00 0.00 0.45 0.00 0.00 132 M 7.74 4.11 0.00 2.02 2.33 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 133 Q 7.93 4.22 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.67 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 134 K 7.54 3.65 0.00 1.79 1.72 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.18 1.33 7.81 135 R 8.55 4.88 0.00 1.54 1.82 0.00 3.33 0.00 0.00 3.26 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 136 T 7.67 4.41 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 1.07 0.00 0.00 137 V 8.10 4.28 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 0.82 0.00 0.00 0.93 0.00 0.00 138 K 7.21 4.33 0.00 1.85 1.91 0.00 1.42 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.39 7.81 139 W 8.90 5.15 0.00 3.29 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 9.19 4.49 0.00 1.94 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 2.62 2.51 0.00 141 P 0.00 4.72 0.00 1.86 1.86 0.00 3.63 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.53 0.00 142 S 9.04 4.67 0.00 3.70 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 0.00 143 T 8.19 5.01 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 144 E 9.43 4.45 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 145 K 9.17 4.49 0.00 1.82 1.67 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.23 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.63 1.79 7.81 146 L 8.16 5.17 0.00 1.02 1.30 0.80 0.44 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 0.00 147 Y 8.05 5.06 0.00 3.12 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 0.00 148 V 8.37 4.36 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 0.90 0.00 0.00 149 R 8.93 4.43 0.00 1.92 1.66 0.00 3.36 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 1.54 1.64 0.00 150 D 9.79 4.17 0.00 2.83 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 0.00 151 G 8.45 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 0.00 0.00 0.00 152 V 7.47 4.49 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 0.73 0.00 0.00 0.92 0.00 0.00 153 L 7.88 4.52 0.00 0.57 0.99 0.65 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.71 4.86 0.00 0.79 1.03 0.00 1.52 0.00 0.00 1.47 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.01 1.14 7.81 155 G 8.68 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 D 9.32 5.82 0.00 2.70 2.60 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 0.00 157 V 8.38 4.52 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 0.39 0.00 0.00 0.69 0.00 0.00 158 N 8.68 4.84 0.00 2.57 2.76 0.00 0.00 6.87 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 0.00 159 M 8.67 4.68 0.00 1.39 1.44 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.50 0.00 160 A 8.54 5.24 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 9.13 4.96 0.00 1.59 1.42 0.74 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 162 S 8.85 4.53 0.00 3.82 4.11 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 0.00 163 L 8.35 5.03 0.00 1.75 1.52 0.89 0.70 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 0.00 164 E 9.18 3.85 0.00 1.97 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 0.00 2.31 2.41 0.00 165 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 0.00 166 G 7.83 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 0.00 167 G 8.63 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.41 5.48 0.00 3.02 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 9.10 5.06 0.00 2.93 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 0.00 170 R 9.77 4.92 0.00 1.84 1.79 0.00 3.57 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 171 C 8.82 4.87 0.00 2.22 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 0.00 172 D 8.94 5.25 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 F 9.01 5.20 0.00 2.86 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 0.00 174 K 8.62 4.90 0.00 1.64 1.65 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.54 1.25 7.81 175 T 8.93 4.88 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 0.19 0.00 0.00 176 T 8.53 4.73 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 1.17 0.00 0.00 177 Y 9.30 5.54 0.00 2.83 3.18 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 0.00 178 K 9.72 4.97 0.00 1.74 1.78 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 179 A 9.32 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.59 4.34 0.00 1.77 1.81 0.00 1.92 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.42 1.43 7.81 181 K 7.16 4.44 0.00 1.76 1.68 0.00 1.52 0.00 0.00 1.91 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.19 1.30 7.81 182 V 8.17 3.66 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 0.80 0.00 0.00 0.91 0.00 0.00 183 V 7.82 4.49 1.82 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 0.56 0.00 0.00 0.41 0.00 0.00 184 Q 8.28 4.12 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 185 L 8.28 4.48 0.00 1.63 1.56 0.92 1.15 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 0.00 186 P 0.00 4.57 0.00 2.16 2.21 0.00 3.61 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 1.89 1.87 0.00 187 D 8.17 4.71 0.00 2.73 2.72 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 0.00 188 Y 8.39 4.28 0.00 2.94 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 0.00 189 H 7.91 4.38 0.00 3.27 3.28 0.00 5.26 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 8.76 5.28 0.00 2.63 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 0.00 191 V 8.51 4.63 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 0.70 0.00 0.00 0.81 0.00 0.00 192 D 9.16 5.13 0.00 2.59 2.52 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 0.00 193 H 9.37 5.47 0.00 2.92 3.10 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 9.01 4.95 0.00 3.23 3.18 0.00 5.57 0.00 0.00 0.00 0.00 6.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 I 8.55 5.00 1.95 0.00 0.00 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 1.55 1.31 1.11 0.00 0.00 196 E 9.31 4.86 0.00 1.90 1.79 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 2.25 2.17 0.00 197 I 8.53 4.53 2.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.71 1.03 0.00 0.00 198 K 8.86 4.32 0.00 1.76 1.77 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.28 0.98 7.81 199 S 7.43 4.68 0.00 3.75 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 0.00 200 H 8.15 5.36 0.00 2.53 2.96 0.00 5.32 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 7.91 4.47 0.00 2.68 2.75 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 0.00 202 K 8.52 3.79 0.00 1.66 1.88 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.53 7.81 203 D 8.03 4.87 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Y 7.74 3.42 0.00 3.04 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 0.00 205 S 7.85 4.41 0.00 4.17 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 0.00 206 N 9.13 5.55 0.00 2.61 2.60 0.00 0.00 6.27 7.23 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 0.00 207 V 8.66 4.70 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 0.90 0.00 0.00 0.28 0.00 0.00 208 N 9.22 5.31 0.00 2.79 2.66 0.00 0.00 6.31 6.21 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 0.00 209 L 9.20 5.42 0.00 1.85 1.54 1.18 1.17 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 0.00 210 H 9.46 5.53 0.00 3.07 3.15 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 9.00 5.21 0.00 2.09 1.77 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 2.30 2.34 0.00 212 H 9.46 5.51 0.00 3.30 3.18 0.00 5.78 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 0.00 213 A 9.40 5.68 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 0.00 214 E 8.55 4.97 0.00 1.84 1.77 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 2.33 2.20 0.00 215 A 8.60 5.04 0.39 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 0.00 216 H 8.74 5.09 0.00 3.29 3.37 0.00 5.44 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.97 4.86 0.00 4.08 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 0.00 218 E 8.04 4.93 0.00 1.98 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 2.30 2.40 0.00 219 L 9.50 4.74 0.00 1.35 1.32 -0.50 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 220 P 0.00 4.55 0.00 2.19 1.92 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.30 0.00 * Residues marked with a * may have inaccurate shift predictions.